smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCC(CC)[N@H+](CCOC)Cc1c(O)cccc1Cl ZINC000133490012 1125462354 /nfs/dbraw/zinc/46/23/54/1125462354.db2.gz MSVZYVRDGQSHOX-UHFFFAOYSA-N 1 0 285.815 3.683 20 10 CHCDRO c1csc(SCCC[NH2+]C2CC3(CCC3)C2)n1 ZINC000772877553 1131442568 /nfs/dbraw/zinc/44/25/68/1131442568.db2.gz GMKGEIAEXMKTBF-UHFFFAOYSA-N 1 0 268.451 3.548 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)c1cscn1 ZINC000850512208 1119963617 /nfs/dbraw/zinc/96/36/17/1119963617.db2.gz YGEJJQOOLYLYMB-IUCAKERBSA-N 1 0 282.796 3.914 20 10 CHCDRO CC[C@]1(C)CC[N@H+](Cc2cc3c(cc2O)CCC3)C1 ZINC000758394913 1121721051 /nfs/dbraw/zinc/72/10/51/1121721051.db2.gz GVNBDGHOXMJQNY-QGZVFWFLSA-N 1 0 259.393 3.503 20 10 CHCDRO C[C@H]1CCCC[C@H]1[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000733322122 1121975998 /nfs/dbraw/zinc/97/59/98/1121975998.db2.gz MYEITAKOGLJVQL-SWLSCSKDSA-N 1 0 264.388 3.560 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCCOC(C)(C)C)c(O)c1C ZINC000850527410 1123281522 /nfs/dbraw/zinc/28/15/22/1123281522.db2.gz WXKGDHHIEWGPNP-CQSZACIVSA-N 1 0 279.424 3.865 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2C(C)(C)C2(F)F)c1 ZINC000850552881 1123290059 /nfs/dbraw/zinc/29/00/59/1123290059.db2.gz QHCKVEMVXPXCTM-GXFFZTMASA-N 1 0 269.335 3.643 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CC2SCCS2)cc1 ZINC000850560775 1123292127 /nfs/dbraw/zinc/29/21/27/1123292127.db2.gz OJZNFLUIYOZDIC-GFCCVEGCSA-N 1 0 296.505 3.599 20 10 CHCDRO Cc1cccc(C[NH2+]CC[C@H]2CCCC2(F)F)c1O ZINC000895545577 1123491417 /nfs/dbraw/zinc/49/14/17/1123491417.db2.gz SDNJCZQATAYICJ-CYBMUJFWSA-N 1 0 269.335 3.616 20 10 CHCDRO CC[C@@H]([NH2+]CC(CC)(CC)CO)c1ccc(C)cc1O ZINC000794819768 1123961717 /nfs/dbraw/zinc/96/17/17/1123961717.db2.gz XUUSZGJAJQSEGC-OAHLLOKOSA-N 1 0 279.424 3.540 20 10 CHCDRO CC[C@@H]1CCCC[N@@H+]1Cc1ccc(Cl)cc1O ZINC001140465891 1131750250 /nfs/dbraw/zinc/75/02/50/1131750250.db2.gz UGJQDKGTZFFTBX-CYBMUJFWSA-N 1 0 253.773 3.810 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CS[C@@H](C)C1)c1cc(Cl)ccc1O ZINC000840860946 1132297486 /nfs/dbraw/zinc/29/74/86/1132297486.db2.gz YBWJTPYOXQGFTQ-NDMJEZRESA-N 1 0 285.840 3.980 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2CCC[C@H](C)[C@@H]2C)cc1Cl ZINC001231871111 1132385089 /nfs/dbraw/zinc/38/50/89/1132385089.db2.gz YKNOIQRRYBBWSE-JQWIXIFHSA-N 1 0 267.800 3.974 20 10 CHCDRO CC1(C)CC[N@H+](Cc2cccc(OC(F)(F)F)c2O)C1 ZINC001233755553 1132674642 /nfs/dbraw/zinc/67/46/42/1132674642.db2.gz VYQSBNBVVVZEPS-UHFFFAOYSA-N 1 0 289.297 3.523 20 10 CHCDRO COc1cc(Cl)cc(C[N@H+](C)C[C@@H]2CC2(C)C)c1O ZINC001206809789 1133750639 /nfs/dbraw/zinc/75/06/39/1133750639.db2.gz MFAJTXYPYVOGEI-NSHDSACASA-N 1 0 283.799 3.532 20 10 CHCDRO C[C@H]([NH2+]C[C@@]1(C)CCCS1)c1ccc(N(C)C)cc1 ZINC000133949048 1125511928 /nfs/dbraw/zinc/51/19/28/1125511928.db2.gz RPQZUHPGOVIEOR-XJKSGUPXSA-N 1 0 278.465 3.689 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)cn1 ZINC000841746307 1125569482 /nfs/dbraw/zinc/56/94/82/1125569482.db2.gz YFVCZMMXQOMQAQ-NSHDSACASA-N 1 0 276.767 3.600 20 10 CHCDRO CC[C@H]1CC[C@H](C)[N@@H+]1Cc1cc(Cl)ccc1O ZINC000136819776 1125647921 /nfs/dbraw/zinc/64/79/21/1125647921.db2.gz ANPCJPKVEYGTCG-GWCFXTLKSA-N 1 0 253.773 3.809 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C[C@]2(C)CCOC3(CCC3)C2)c1 ZINC000886343534 1125671335 /nfs/dbraw/zinc/67/13/35/1125671335.db2.gz ZRGHCVFKFIYQBG-QGZVFWFLSA-N 1 0 289.419 3.530 20 10 CHCDRO CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)c1c([O-])cccc1F ZINC000886487853 1125680552 /nfs/dbraw/zinc/68/05/52/1125680552.db2.gz XYAMTAJNJMWBLW-KGLIPLIRSA-N 1 0 296.430 3.692 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(C2CC2)no1)c1ccc(C)cc1O ZINC000886684867 1125709108 /nfs/dbraw/zinc/70/91/08/1125709108.db2.gz UXFHDSWHZPKSNP-HNNXBMFYSA-N 1 0 286.375 3.807 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCC2(CCC2)CO1)c1cc(F)ccc1O ZINC000886731102 1125714356 /nfs/dbraw/zinc/71/43/56/1125714356.db2.gz UZTVSOKTRJJNEM-TZMCWYRMSA-N 1 0 293.382 3.531 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1CCCSC1)c1ccccc1O ZINC000286963312 1125756898 /nfs/dbraw/zinc/75/68/98/1125756898.db2.gz IBPYJIUOBXAPQB-TZMCWYRMSA-N 1 0 265.422 3.576 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CCCC[C@H]2CC)c(O)c1 ZINC000768138525 1129835945 /nfs/dbraw/zinc/83/59/45/1129835945.db2.gz NRUPOFBQFSLZQR-CQSZACIVSA-N 1 0 263.381 3.555 20 10 CHCDRO COC(C)(C)[C@H](C)[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000903329671 1130157339 /nfs/dbraw/zinc/15/73/39/1130157339.db2.gz CPTUIMZLLHAOGY-UWVGGRQHSA-N 1 0 271.788 3.510 20 10 CHCDRO COc1cccc(C2([NH2+]Cc3ccc(N(C)C)cc3)CC2)c1 ZINC000150907234 1126747395 /nfs/dbraw/zinc/74/73/95/1126747395.db2.gz HYGHAYCCNZZSOZ-UHFFFAOYSA-N 1 0 296.414 3.540 20 10 CHCDRO CC[NH+](CC)CCC[C@@H](C)[NH2+]Cc1cccc(Cl)c1[O-] ZINC000159731164 1126752204 /nfs/dbraw/zinc/75/22/04/1126752204.db2.gz VKCBJVPCCLBIAJ-CYBMUJFWSA-N 1 0 298.858 3.646 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H]2CCCc3occc32)cc1C ZINC000174265303 1126768016 /nfs/dbraw/zinc/76/80/16/1126768016.db2.gz IZJLYZRCYXXYOC-HNNXBMFYSA-N 1 0 271.360 3.769 20 10 CHCDRO C[C@@H](O)c1ccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)cc1 ZINC000178546875 1126816520 /nfs/dbraw/zinc/81/65/20/1126816520.db2.gz KIXBMOWSJJGNCK-LSDHHAIUSA-N 1 0 298.430 3.657 20 10 CHCDRO Cc1nc2c(s1)[C@H]([N@H+](C)Cc1ccccc1O)CCC2 ZINC000179574680 1126830535 /nfs/dbraw/zinc/83/05/35/1126830535.db2.gz WRSRCOMWIWJMIS-CQSZACIVSA-N 1 0 288.416 3.667 20 10 CHCDRO CN(C)c1ccc(CNc2ccc(C(C)(C)[NH3+])cc2)cc1 ZINC000904472049 1126853392 /nfs/dbraw/zinc/85/33/92/1126853392.db2.gz KXSREAMNIGOZTC-UHFFFAOYSA-N 1 0 283.419 3.559 20 10 CHCDRO C[C@H](C[NH2+][C@@H](C)c1ccccc1O)Oc1ccccc1 ZINC000183605566 1126889225 /nfs/dbraw/zinc/88/92/25/1126889225.db2.gz UHGRBRQGDOXHSO-KGLIPLIRSA-N 1 0 271.360 3.510 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2cn3c(cccc3C)n2)c(O)c1 ZINC000185412664 1126899967 /nfs/dbraw/zinc/89/99/67/1126899967.db2.gz WXTIPJZLIAJMKG-AWEZNQCLSA-N 1 0 295.386 3.508 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1cc(F)ccc1O)c1ccncc1 ZINC000185541857 1126900816 /nfs/dbraw/zinc/90/08/16/1126900816.db2.gz SRAKESJUTGGJFD-NHYWBVRUSA-N 1 0 274.339 3.728 20 10 CHCDRO CCOC1CC(CC[NH2+][C@H](C)c2cc(C)ccc2O)C1 ZINC000189259686 1126929610 /nfs/dbraw/zinc/92/96/10/1126929610.db2.gz CJSIPGPUGBPIMV-WLYUNCDWSA-N 1 0 277.408 3.556 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCO[C@H]1c1ccccc1)c1ccccc1O ZINC000191858040 1126955759 /nfs/dbraw/zinc/95/57/59/1126955759.db2.gz HHAGINHHUYLNIW-ALKREAHSSA-N 1 0 297.398 3.821 20 10 CHCDRO CSC1(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)CC1 ZINC000193821550 1126970929 /nfs/dbraw/zinc/97/09/29/1126970929.db2.gz FKRGUNYHSXNWTI-VIFPVBQESA-N 1 0 271.813 3.592 20 10 CHCDRO CCO[C@H](C[NH2+]Cc1cccc(C)c1O)c1ccccc1 ZINC000195190868 1126979056 /nfs/dbraw/zinc/97/90/56/1126979056.db2.gz VWERMYQANOUQMV-QGZVFWFLSA-N 1 0 285.387 3.568 20 10 CHCDRO COc1cccc(C[NH2+][C@H]2CC(C)(C)CC[C@@H]2C)c1O ZINC000717522527 1126989353 /nfs/dbraw/zinc/98/93/53/1126989353.db2.gz BJVYOLXFXXXBFQ-JSGCOSHPSA-N 1 0 277.408 3.705 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H]2CCc3c2cccc3F)c1 ZINC000113329853 1127003073 /nfs/dbraw/zinc/00/30/73/1127003073.db2.gz QIGCBOBMAQOGBF-MRXNPFEDSA-N 1 0 271.335 3.617 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc2c(c1)COC2 ZINC000268727647 1127021971 /nfs/dbraw/zinc/02/19/71/1127021971.db2.gz LHWYTJRHAGBDGD-AWEZNQCLSA-N 1 0 296.414 3.634 20 10 CHCDRO CCN(Cc1ccccc1)c1ccc(C[NH2+]C2CC2)cc1 ZINC000034652031 1127076529 /nfs/dbraw/zinc/07/65/29/1127076529.db2.gz BHROYNMFAGMUCW-UHFFFAOYSA-N 1 0 280.415 3.965 20 10 CHCDRO Cc1nnc([C@@H](C)[NH2+][C@@H](C)c2ccc(C)c(C)c2O)s1 ZINC000274150163 1127109831 /nfs/dbraw/zinc/10/98/31/1127109831.db2.gz FGJSIUDYEICJOF-WDEREUQCSA-N 1 0 291.420 3.581 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCC(C)(C)C1)c1ccc(N(C)C)cc1 ZINC000163633255 1127126366 /nfs/dbraw/zinc/12/63/66/1127126366.db2.gz HSJCDVAXXVIWIX-HIFRSBDPSA-N 1 0 260.425 3.982 20 10 CHCDRO CC[C@H](CSC)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000164073766 1127152185 /nfs/dbraw/zinc/15/21/85/1127152185.db2.gz DOLVABUXNKXONV-GXTWGEPZSA-N 1 0 266.454 3.545 20 10 CHCDRO CC[C@@H](CC(F)(F)F)[NH2+]Cc1cc(C)ccc1O ZINC000760658436 1127151371 /nfs/dbraw/zinc/15/13/71/1127151371.db2.gz LREDNBVXHITEPJ-NSHDSACASA-N 1 0 261.287 3.521 20 10 CHCDRO COc1cc(C[N@H+](C)C2CCC2)c(O)c(C(C)(C)C)c1 ZINC000164411484 1127164459 /nfs/dbraw/zinc/16/44/59/1127164459.db2.gz BVLQAPLQEALHQF-UHFFFAOYSA-N 1 0 277.408 3.683 20 10 CHCDRO Cc1cc(C)c(O)c(C[NH+]2CCC(OC(C)(C)C)CC2)c1 ZINC000164491753 1127167080 /nfs/dbraw/zinc/16/70/80/1127167080.db2.gz PDZRNTZRMOFLAY-UHFFFAOYSA-N 1 0 291.435 3.789 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCC(F)(F)F)cc1 ZINC000165473406 1127233166 /nfs/dbraw/zinc/23/31/66/1127233166.db2.gz LXXMSWPUWNSTAV-LLVKDONJSA-N 1 0 274.330 3.746 20 10 CHCDRO CC1(C[NH2+]Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000224170396 1127254001 /nfs/dbraw/zinc/25/40/01/1127254001.db2.gz MKEKDGKXGDMMLK-UHFFFAOYSA-N 1 0 258.409 3.567 20 10 CHCDRO CS[C@@H]1CC[C@H]([NH2+][C@@H](C)c2ccc(N(C)C)cc2)C1 ZINC000224273323 1127257028 /nfs/dbraw/zinc/25/70/28/1127257028.db2.gz DVHSTWCVKOCGFR-DUVNUKRYSA-N 1 0 278.465 3.687 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H]2CC23CC3)c1O ZINC000818355324 1131210577 /nfs/dbraw/zinc/21/05/77/1131210577.db2.gz COJSSVHJVBBQEB-SKDRFNHKSA-N 1 0 251.757 3.557 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)Cc2ccccc2)cc1C ZINC000058583696 1127361231 /nfs/dbraw/zinc/36/12/31/1127361231.db2.gz VXFSVSDNYYBJHU-UHFFFAOYSA-N 1 0 255.361 3.641 20 10 CHCDRO CC1(C)CCC[C@H]1[NH2+]Cc1cc(Br)ccc1O ZINC000226785685 1127425719 /nfs/dbraw/zinc/42/57/19/1127425719.db2.gz WBZQGGSLVGWZIH-CYBMUJFWSA-N 1 0 298.224 3.823 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCCCS1)c1ccc(N(C)C)cc1 ZINC000158084529 1127436620 /nfs/dbraw/zinc/43/66/20/1127436620.db2.gz OKERBGOTDFEXOR-XJKSGUPXSA-N 1 0 278.465 3.689 20 10 CHCDRO CC(C)c1ccc(O)c(C[N@@H+]2CC(C)(C)OC[C@@H]2C)c1 ZINC001308738702 1127452743 /nfs/dbraw/zinc/45/27/43/1127452743.db2.gz BOCLBXYTWGAJIG-ZDUSSCGKSA-N 1 0 277.408 3.515 20 10 CHCDRO CCOc1cccc(C[NH2+]CCCC2CCCC2)c1O ZINC000227435824 1127478215 /nfs/dbraw/zinc/47/82/15/1127478215.db2.gz WEEKNFCBODHXAO-UHFFFAOYSA-N 1 0 277.408 3.851 20 10 CHCDRO CCCc1nc(C)c(C[NH2+][C@H](C)c2cc(F)ccc2O)o1 ZINC000293685838 1127512731 /nfs/dbraw/zinc/51/27/31/1127512731.db2.gz NKXBKYCKESGEGT-SNVBAGLBSA-N 1 0 292.354 3.631 20 10 CHCDRO Cc1ccoc1C[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000293785217 1127520196 /nfs/dbraw/zinc/52/01/96/1127520196.db2.gz UCKJTQLOJFWVPT-SNVBAGLBSA-N 1 0 265.740 3.798 20 10 CHCDRO Cc1cc(C[N@H+](Cc2cccnc2)C2CC2)ccc1N(C)C ZINC000293806894 1127522435 /nfs/dbraw/zinc/52/24/35/1127522435.db2.gz NVAQWJYMTUGVRS-UHFFFAOYSA-N 1 0 295.430 3.621 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2CC[C@H](C)C[C@@H]2C)cc1Cl ZINC001231870792 1127544502 /nfs/dbraw/zinc/54/45/02/1127544502.db2.gz UFQOUVPCTDFWLR-JQWIXIFHSA-N 1 0 267.800 3.974 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CCO[C@@H](C3CC3)C2)c(O)c1 ZINC000294343937 1127566399 /nfs/dbraw/zinc/56/63/99/1127566399.db2.gz PNRDBDTZMOZXHN-YSVLISHTSA-N 1 0 289.419 3.617 20 10 CHCDRO CCC(C)(C)[N@H+](C)Cc1cc(Cl)cc(OC)c1O ZINC000228663100 1127580953 /nfs/dbraw/zinc/58/09/53/1127580953.db2.gz MIAOUFQOFLEYQS-UHFFFAOYSA-N 1 0 271.788 3.675 20 10 CHCDRO CC[C@H]([NH2+]CC(C)(C)c1ccccn1)c1ccccc1O ZINC000294733309 1127595874 /nfs/dbraw/zinc/59/58/74/1127595874.db2.gz GMPJYKCSKRHQAR-HNNXBMFYSA-N 1 0 284.403 3.806 20 10 CHCDRO C[C@@H]1[C@H](CC(F)(F)F)C[C@H](C)[N@H+]1Cc1ccccc1O ZINC000295021436 1127614259 /nfs/dbraw/zinc/61/42/59/1127614259.db2.gz CHCXHIZSFFOLDW-LOWVWBTDSA-N 1 0 287.325 3.944 20 10 CHCDRO CCC[N@@H+](Cc1ccccc1O)CC1CC(F)(F)C1 ZINC000295074128 1127618634 /nfs/dbraw/zinc/61/86/34/1127618634.db2.gz QOIWXJWKBADKFH-UHFFFAOYSA-N 1 0 269.335 3.650 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+][C@H](C)c2ccsc2)c1O ZINC000229051872 1127643652 /nfs/dbraw/zinc/64/36/52/1127643652.db2.gz ZACCIXVXBHCMTH-SECBINFHSA-N 1 0 297.807 3.967 20 10 CHCDRO CCn1cc([C@H](C)[NH2+][C@H](C)c2ccc(C)c(C)c2O)cn1 ZINC000295990676 1127659872 /nfs/dbraw/zinc/65/98/72/1127659872.db2.gz PMRJKAIDOGCRMI-UONOGXRCSA-N 1 0 287.407 3.637 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2cc(F)cnc2Cl)c1 ZINC000296245889 1127666623 /nfs/dbraw/zinc/66/66/23/1127666623.db2.gz BADMUUIXEXMGKF-SNVBAGLBSA-N 1 0 294.757 3.739 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCc2cccc(O)c21)c1ccccc1[N+](=O)[O-] ZINC000296920012 1127685898 /nfs/dbraw/zinc/68/58/98/1127685898.db2.gz PPSSNAVVXYVWCS-FZMZJTMJSA-N 1 0 298.342 3.639 20 10 CHCDRO CC(C)C[N@H+](Cc1ccco1)Cc1ccccc1O ZINC000171922802 1127734568 /nfs/dbraw/zinc/73/45/68/1127734568.db2.gz IDJVYCFLIBQLBH-UHFFFAOYSA-N 1 0 259.349 3.643 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CC[C@]2(C1)CCCOC2 ZINC000366942935 1127748661 /nfs/dbraw/zinc/74/86/61/1127748661.db2.gz IYEIGXFVLKTZKP-IBGZPJMESA-N 1 0 297.398 3.548 20 10 CHCDRO Cc1cc(C[N@@H+]2CCCO[C@H](C)C2)c(O)c(C(C)(C)C)c1 ZINC000172495072 1127766602 /nfs/dbraw/zinc/76/66/02/1127766602.db2.gz KZJXITJJMPPRTD-CQSZACIVSA-N 1 0 291.435 3.609 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CC[C@@H](SC)C2)cc1 ZINC000230697889 1127772635 /nfs/dbraw/zinc/77/26/35/1127772635.db2.gz ZCTPGVYSOIKTQC-NVXWUHKLSA-N 1 0 292.492 3.907 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2OCCc3ccccc32)c(O)c1 ZINC000371869989 1127782425 /nfs/dbraw/zinc/78/24/25/1127782425.db2.gz MCBKKAJLNJRQMK-IFXJQAMLSA-N 1 0 297.398 3.665 20 10 CHCDRO Cc1cccc(C[NH2+][C@H]2COc3c2cccc3Cl)c1O ZINC000373189929 1127827734 /nfs/dbraw/zinc/82/77/34/1127827734.db2.gz GUSZJLHQXUQEOB-AWEZNQCLSA-N 1 0 289.762 3.577 20 10 CHCDRO COc1ccc2ccc(O)c(C[N@@H+]3CCC[C@@H]3C)c2c1 ZINC000173528259 1127837507 /nfs/dbraw/zinc/83/75/07/1127837507.db2.gz JVUBXBASRXJYBX-LBPRGKRZSA-N 1 0 271.360 3.538 20 10 CHCDRO C[C@H](CC(F)(F)F)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000231790916 1127853877 /nfs/dbraw/zinc/85/38/77/1127853877.db2.gz LDRSGJIHBGMWLK-MNOVXSKESA-N 1 0 274.330 3.744 20 10 CHCDRO C[C@]1(F)CCC[N@H+](Cc2ccc(C(F)(F)F)cc2O)C1 ZINC001233451835 1127967199 /nfs/dbraw/zinc/96/71/99/1127967199.db2.gz AUNPPORSOKOUSR-ZDUSSCGKSA-N 1 0 291.288 3.735 20 10 CHCDRO CCCC[NH2+][C@H](C)c1cc(Br)c(F)cc1[O-] ZINC000134902785 1128077075 /nfs/dbraw/zinc/07/70/75/1128077075.db2.gz XXOOEOAPEKKAOP-MRVPVSSYSA-N 1 0 290.176 3.745 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[NH2+][C@@H]1CC[C@@H]1C1CCC1 ZINC000800967818 1128160137 /nfs/dbraw/zinc/16/01/37/1128160137.db2.gz RZEFBHMRMYWPGD-RTBURBONSA-N 1 0 284.447 3.955 20 10 CHCDRO FCCC[C@H]1CCC[C@H]1[NH2+]Cc1ccc2c(c1)CCO2 ZINC000800969092 1128161281 /nfs/dbraw/zinc/16/12/81/1128161281.db2.gz HACXFFULLMNLIN-GDBMZVCRSA-N 1 0 277.383 3.630 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H](c2ccccc2)C2CC2)cc1 ZINC000035053015 1128254089 /nfs/dbraw/zinc/25/40/89/1128254089.db2.gz JWWALOOTJMVBMQ-LJQANCHMSA-N 1 0 280.415 3.994 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(CF)cc2)c1 ZINC000777721414 1128254814 /nfs/dbraw/zinc/25/48/14/1128254814.db2.gz MDQBOHCMBAOBRU-GFCCVEGCSA-N 1 0 289.350 3.721 20 10 CHCDRO CC[C@@](C)(CCO)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000761973246 1128258028 /nfs/dbraw/zinc/25/80/28/1128258028.db2.gz KPFZCJHQFILTRK-IBGZPJMESA-N 1 0 299.414 3.700 20 10 CHCDRO COc1cc(C)cc(C[N@H+](C)Cc2cc(C)ccc2C)c1O ZINC000762068432 1128266006 /nfs/dbraw/zinc/26/60/06/1128266006.db2.gz OAFGZBIROLBSAG-UHFFFAOYSA-N 1 0 299.414 3.958 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2CCCc3cccnc32)c1 ZINC000927063260 1128213571 /nfs/dbraw/zinc/21/35/71/1128213571.db2.gz BHNSGIAKJTWARP-LRDDRELGSA-N 1 0 298.386 3.524 20 10 CHCDRO CC1(C)C[C@@H](C[NH2+][C@H]2CCc3cccc(O)c32)C(C)(C)O1 ZINC000927099376 1128217143 /nfs/dbraw/zinc/21/71/43/1128217143.db2.gz NDIIRQDXZMNLKY-KBPBESRZSA-N 1 0 289.419 3.563 20 10 CHCDRO CC(C)[C@H](C)[N@H+](C)Cc1cc(C(C)(C)C)cc(O)c1O ZINC000915209852 1128292012 /nfs/dbraw/zinc/29/20/12/1128292012.db2.gz VFFLTJFPZRORLD-LBPRGKRZSA-N 1 0 279.424 3.872 20 10 CHCDRO CCC1(C[NH2+]Cc2cccc(OC)c2O)CCCCC1 ZINC000762569204 1128307767 /nfs/dbraw/zinc/30/77/67/1128307767.db2.gz SSWVUHZDGZJBGT-UHFFFAOYSA-N 1 0 277.408 3.851 20 10 CHCDRO CC[C@@H]([NH2+]C1Cc2ccccc2C1)c1ccc(N(C)C)cc1 ZINC000762775546 1128317823 /nfs/dbraw/zinc/31/78/23/1128317823.db2.gz AQKULVQBRVAGQZ-HXUWFJFHSA-N 1 0 294.442 3.961 20 10 CHCDRO CCC[N@H+](Cc1ccc(Cl)cn1)Cc1ccccc1O ZINC000778220963 1128451105 /nfs/dbraw/zinc/45/11/05/1128451105.db2.gz OFGYVNRKDXYAMP-UHFFFAOYSA-N 1 0 290.794 3.853 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](Cc2ccccn2)C(C)C)cc1C ZINC000917483617 1128501138 /nfs/dbraw/zinc/50/11/38/1128501138.db2.gz VSROMBRIHZHEEA-UHFFFAOYSA-N 1 0 284.403 3.815 20 10 CHCDRO C[C@@H]1CC[C@@]2(CC[N@H+](Cc3c(O)ccc4ccncc43)C2)C1 ZINC000781585507 1128568873 /nfs/dbraw/zinc/56/88/73/1128568873.db2.gz GOYDXGNFMNBJGY-AUUYWEPGSA-N 1 0 296.414 3.953 20 10 CHCDRO CCCC1CCC([NH2+]Cc2cc3c(cc2O)OCO3)CC1 ZINC000042880534 1128588730 /nfs/dbraw/zinc/58/87/30/1128588730.db2.gz RQPKURFWTPSWMX-UHFFFAOYSA-N 1 0 291.391 3.569 20 10 CHCDRO CCC[NH+](CCC)Cc1ccc2c(c1)CCCN2C ZINC001138354374 1128624553 /nfs/dbraw/zinc/62/45/53/1128624553.db2.gz HJQXJFWLAYGENF-UHFFFAOYSA-N 1 0 260.425 3.691 20 10 CHCDRO C[N@@H+](Cc1c2c(ccc1[O-])oc1c2CCCC1)CC1CC1 ZINC000919941937 1128652786 /nfs/dbraw/zinc/65/27/86/1128652786.db2.gz GRMMEDMRTBFHJU-UHFFFAOYSA-N 1 0 285.387 3.859 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CCC[C@H]1Cc1ccccc1 ZINC000778994782 1128674710 /nfs/dbraw/zinc/67/47/10/1128674710.db2.gz LCTIYQQKNCGNQM-KRWDZBQOSA-N 1 0 285.362 3.738 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CCC[C@@H]1c1ccsc1 ZINC000778996984 1128675692 /nfs/dbraw/zinc/67/56/92/1128675692.db2.gz YGFULWCOZSSSEY-CQSZACIVSA-N 1 0 277.364 3.930 20 10 CHCDRO C[C@H]1[C@H](Cc2ccccc2)CC[N@@H+]1Cc1ccccc1O ZINC000779023637 1128685898 /nfs/dbraw/zinc/68/58/98/1128685898.db2.gz VBNDPCGKZVPGRG-RDJZCZTQSA-N 1 0 281.399 3.845 20 10 CHCDRO Cc1cc(Br)cc([C@H](C)[NH2+]CCC2CC2)c1O ZINC000779036339 1128697954 /nfs/dbraw/zinc/69/79/54/1128697954.db2.gz MNSAWQOLPARDON-JTQLQIEISA-N 1 0 298.224 3.914 20 10 CHCDRO COc1ccc(C[NH2+][C@H]2[C@H](C)CCC[C@@H]2C)cc1C ZINC000921067175 1128699796 /nfs/dbraw/zinc/69/97/96/1128699796.db2.gz NPSONTRMSNYGEC-LAQFHYBYSA-N 1 0 261.409 3.918 20 10 CHCDRO COc1ccc(C[NH2+]C[C@@H]2CCO[C@H](C(C)C)C2)cc1C ZINC000779063916 1128716306 /nfs/dbraw/zinc/71/63/06/1128716306.db2.gz CTOJHLWECDCXCX-AEFFLSMTSA-N 1 0 291.435 3.544 20 10 CHCDRO COc1cc(C[NH2+][C@H](C)c2cc(F)ccc2O)ccc1C ZINC000185193679 1117780553 /nfs/dbraw/zinc/78/05/53/1117780553.db2.gz LOIJEHZSHQRQAP-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO Cc1cccc([C@@H](C)[N@H+](C)Cc2ccccc2O)c1 ZINC000072629619 1117782248 /nfs/dbraw/zinc/78/22/48/1117782248.db2.gz UMHSCKGLBIKFBV-CQSZACIVSA-N 1 0 255.361 3.894 20 10 CHCDRO CCCC(C)(C)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000733328075 1117840354 /nfs/dbraw/zinc/84/03/54/1117840354.db2.gz MDXKMQQRLDRSHG-UHFFFAOYSA-N 1 0 252.377 3.560 20 10 CHCDRO CCC1(C[NH2+][C@@H](C)c2cc(OC)ccc2O)CCC1 ZINC000185666221 1117866808 /nfs/dbraw/zinc/86/68/08/1117866808.db2.gz AYGQFNFTBSIZED-LBPRGKRZSA-N 1 0 263.381 3.632 20 10 CHCDRO Oc1cc2c(cc1C[N@@H+]1CCC[C@@H]1C1CCC1)CCC2 ZINC000728198738 1117870054 /nfs/dbraw/zinc/87/00/54/1117870054.db2.gz FHAHQDVLZRXTGS-QGZVFWFLSA-N 1 0 271.404 3.645 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCCS1)c1cc2c(cc1O)CCCC2 ZINC000185698112 1117872301 /nfs/dbraw/zinc/87/23/01/1117872301.db2.gz GHBZKINFURWIDN-DOMZBBRYSA-N 1 0 291.460 3.817 20 10 CHCDRO COc1ccc(C[NH2+][C@H]2CCC[C@@H]2c2ccccc2)c(O)c1 ZINC000111412946 1117879590 /nfs/dbraw/zinc/87/95/90/1117879590.db2.gz IJDFGDHSBDTDOR-MSOLQXFVSA-N 1 0 297.398 3.827 20 10 CHCDRO Oc1ccccc1C[N@H+]1CC=C(c2ccc(F)cc2)CC1 ZINC000179554512 1128747982 /nfs/dbraw/zinc/74/79/82/1128747982.db2.gz PLYBUXNUXIHSLY-UHFFFAOYSA-N 1 0 283.346 3.821 20 10 CHCDRO CC1([NH2+]Cc2cccc(Br)c2[O-])CCCC1 ZINC000042412615 1118034215 /nfs/dbraw/zinc/03/42/15/1118034215.db2.gz WESVXRUNVKNJEK-UHFFFAOYSA-N 1 0 284.197 3.577 20 10 CHCDRO Oc1cccc2c1C[N@H+](Cc1ccc(Cl)s1)CC2 ZINC001204443229 1118061962 /nfs/dbraw/zinc/06/19/62/1118061962.db2.gz VCISKEJAWUTVHK-UHFFFAOYSA-N 1 0 279.792 3.665 20 10 CHCDRO COc1ccc(O)c(C[N@H+](Cc2ccccc2)C2CC2)c1 ZINC000179662996 1128754236 /nfs/dbraw/zinc/75/42/36/1128754236.db2.gz DMKVACPBZGFLRY-UHFFFAOYSA-N 1 0 283.371 3.565 20 10 CHCDRO CC(C)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000764473660 1118094112 /nfs/dbraw/zinc/09/41/12/1118094112.db2.gz DSQXFIVYVHXUGA-HNNXBMFYSA-N 1 0 260.425 3.984 20 10 CHCDRO CC[N@H+](Cc1cccc(C)c1O)[C@@H](C)c1cccc(O)c1 ZINC000179770724 1128758330 /nfs/dbraw/zinc/75/83/30/1128758330.db2.gz SHEYTSOXCXPKRP-AWEZNQCLSA-N 1 0 285.387 3.989 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@@H](C)C2CC2)cc1 ZINC000765391392 1118147772 /nfs/dbraw/zinc/14/77/72/1118147772.db2.gz DXPADKYABKGDFH-ZIAGYGMSSA-N 1 0 260.425 3.839 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)COc1ccccc1)c1ccc(N(C)C)cc1 ZINC000765438997 1118151537 /nfs/dbraw/zinc/15/15/37/1118151537.db2.gz OLVNGNAMTBVDGN-JKSUJKDBSA-N 1 0 298.430 3.871 20 10 CHCDRO CO[C@H](C)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000188127916 1128760070 /nfs/dbraw/zinc/76/00/70/1128760070.db2.gz YGLUGWNKOJFBIY-KGLIPLIRSA-N 1 0 294.414 3.502 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2ccc3c(c2)CCCO3)s1 ZINC000921542854 1118176808 /nfs/dbraw/zinc/17/68/08/1118176808.db2.gz JDOCFQXJUKIHPX-UHFFFAOYSA-N 1 0 273.401 3.671 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cccnc1Cl ZINC000765609416 1118181976 /nfs/dbraw/zinc/18/19/76/1118181976.db2.gz NOZXGAKCPLVZNR-LLVKDONJSA-N 1 0 288.778 3.521 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cccnc1Cl ZINC000765609417 1118181993 /nfs/dbraw/zinc/18/19/93/1118181993.db2.gz NOZXGAKCPLVZNR-NSHDSACASA-N 1 0 288.778 3.521 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCCO3)c1 ZINC000921563578 1118200998 /nfs/dbraw/zinc/20/09/98/1118200998.db2.gz MPCRCZXJILSCAM-CQSZACIVSA-N 1 0 297.398 3.871 20 10 CHCDRO CCOC(C)(C)C[NH2+][C@H](C)c1ccc(N(C)CC)cc1 ZINC000188690608 1128763969 /nfs/dbraw/zinc/76/39/69/1128763969.db2.gz XSPRAVLCTJOOAP-CQSZACIVSA-N 1 0 278.440 3.608 20 10 CHCDRO COc1ccc(C[NH2+]Cc2cc(C)cc(Cl)n2)cc1C ZINC000282179872 1118276185 /nfs/dbraw/zinc/27/61/85/1118276185.db2.gz ZIHPSWBYQRTCAH-UHFFFAOYSA-N 1 0 290.794 3.650 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]C2C[C@@H](C)C[C@H](C)C2)c1 ZINC000084973066 1118277039 /nfs/dbraw/zinc/27/70/39/1118277039.db2.gz FHQXVHWXLGQFDE-AVGNSLFASA-N 1 0 277.408 3.876 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+][C@H](C)c2ccccc2)c1O ZINC000076274242 1118284517 /nfs/dbraw/zinc/28/45/17/1118284517.db2.gz FEHLZEMNIAOXHD-LLVKDONJSA-N 1 0 291.778 3.905 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H](C)CCc2ccccc2)c1O ZINC000083515067 1118355426 /nfs/dbraw/zinc/35/54/26/1118355426.db2.gz FNECNFCDZBBXLY-HNNXBMFYSA-N 1 0 269.388 3.812 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]CCCc1ccccc1 ZINC000083551229 1118356316 /nfs/dbraw/zinc/35/63/16/1118356316.db2.gz NCMZDBDEGJIXRY-UHFFFAOYSA-N 1 0 275.779 3.768 20 10 CHCDRO C[C@H]1CC([NH2+]Cc2ccc3c(c2)CCO3)C[C@H](C)C1 ZINC000084461597 1118359853 /nfs/dbraw/zinc/35/98/53/1118359853.db2.gz GJEFQHRUAAZIJL-CHWSQXEVSA-N 1 0 259.393 3.536 20 10 CHCDRO Cc1cc(C)cc(C[NH2+][C@@H]2CCc3cccc(O)c32)c1 ZINC000693192803 1118368023 /nfs/dbraw/zinc/36/80/23/1118368023.db2.gz KJOWMDATNNUODE-MRXNPFEDSA-N 1 0 267.372 3.786 20 10 CHCDRO Oc1c(C[NH2+][C@H]2CCCC23CC3)ccc2ccccc21 ZINC001207066790 1118400610 /nfs/dbraw/zinc/40/06/10/1118400610.db2.gz JKKGOJCTNQJFFJ-INIZCTEOSA-N 1 0 267.372 3.968 20 10 CHCDRO Cc1cc(C)cc(C[NH2+][C@@H](C)c2cc(F)ccc2O)c1 ZINC000693217516 1118421300 /nfs/dbraw/zinc/42/13/00/1118421300.db2.gz ZXNCCTKLLYMTSS-ZDUSSCGKSA-N 1 0 273.351 3.999 20 10 CHCDRO COc1ccc([C@H](C)[NH2+]Cc2ccc(OC)c(C)c2)cc1 ZINC000088218641 1118511186 /nfs/dbraw/zinc/51/11/86/1118511186.db2.gz ONXSAULWLBCOAS-AWEZNQCLSA-N 1 0 285.387 3.863 20 10 CHCDRO CCC[C@H](C[NH2+][C@H](C)c1cc(Cl)ccc1O)OC ZINC000834841762 1118580103 /nfs/dbraw/zinc/58/01/03/1118580103.db2.gz ZVCAVGAIRICZDC-ZYHUDNBSSA-N 1 0 271.788 3.511 20 10 CHCDRO Cc1noc(C)c1[C@H](C)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000092326524 1118583268 /nfs/dbraw/zinc/58/32/68/1118583268.db2.gz BSWCWBDLNCUZCB-RYUDHWBXSA-N 1 0 287.407 3.769 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cnccc1C)c1cc(Cl)ccc1O ZINC000834887871 1118611713 /nfs/dbraw/zinc/61/17/13/1118611713.db2.gz XVMFKFJPVJEVHC-OAHLLOKOSA-N 1 0 290.794 3.990 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)[C@H](OC)C1CC1)c1cc(Cl)ccc1O ZINC000834901878 1118621617 /nfs/dbraw/zinc/62/16/17/1118621617.db2.gz AGKXPCDEXUYZRW-OOVXXXAESA-N 1 0 297.826 3.900 20 10 CHCDRO C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1c(O)cccc1Br ZINC000707147319 1118648300 /nfs/dbraw/zinc/64/83/00/1118648300.db2.gz YHBHIUDHHFLRGD-WDEREUQCSA-N 1 0 298.224 3.775 20 10 CHCDRO Cc1cccc(C[N@H+]2C[C@H](C)OC[C@@H]2c2ccccc2)c1O ZINC000180443344 1128793691 /nfs/dbraw/zinc/79/36/91/1128793691.db2.gz OKPFWYRNUGWYSC-MAUKXSAKSA-N 1 0 297.398 3.663 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2C[C@@H](C)[C@H]2c2ccccc2)c1 ZINC000180653691 1128800181 /nfs/dbraw/zinc/80/01/81/1128800181.db2.gz JLWOCYYTUWMFIG-ACJLOTCBSA-N 1 0 283.371 3.594 20 10 CHCDRO COc1cccc(C[N@H+](C)[C@@H]2CCc3ccccc32)c1O ZINC000131996848 1118787267 /nfs/dbraw/zinc/78/72/67/1118787267.db2.gz DLCXNBXZOKFSJD-MRXNPFEDSA-N 1 0 283.371 3.520 20 10 CHCDRO Cc1ccc(NCc2ccc(N3CCCCC3)cc2)nc1 ZINC000121604801 1118809851 /nfs/dbraw/zinc/80/98/51/1118809851.db2.gz MAKLHQIFHWDPDF-UHFFFAOYSA-N 1 0 281.403 3.992 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)CCSC)c1ccccc1O ZINC000129684197 1118880892 /nfs/dbraw/zinc/88/08/92/1118880892.db2.gz DMEUGFPGKAJMBB-DGCLKSJQSA-N 1 0 253.411 3.575 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]C1CC(c2ccccc2)C1 ZINC000690730576 1118912625 /nfs/dbraw/zinc/91/26/25/1118912625.db2.gz IVVVXMYJYOHKFQ-UHFFFAOYSA-N 1 0 271.335 3.567 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@@H](C)c2ccc(C)s2)c1 ZINC000049159273 1119087599 /nfs/dbraw/zinc/08/75/99/1119087599.db2.gz UNZIEFJWPDJKLZ-NSHDSACASA-N 1 0 277.389 3.622 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2cc(F)ccc2O)s1 ZINC000226586211 1119213564 /nfs/dbraw/zinc/21/35/64/1119213564.db2.gz ZYPWYPDRGMGRQY-JTQLQIEISA-N 1 0 265.353 3.752 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C[C@@H]2CCO[C@H]2c2ccccc2)c1 ZINC000192375542 1119333947 /nfs/dbraw/zinc/33/39/47/1119333947.db2.gz NVIWWEILQZUEFK-LPHOPBHVSA-N 1 0 297.398 3.568 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)[C@@H]1CCOC1)c1ccc2ccccc2c1O ZINC000168800802 1119479153 /nfs/dbraw/zinc/47/91/53/1119479153.db2.gz SJFWPODATBDRFA-KCQAQPDRSA-N 1 0 285.387 3.621 20 10 CHCDRO CCOc1cccc(C[N@H+](C)Cc2ccc(C)cc2)c1O ZINC000179602121 1119752755 /nfs/dbraw/zinc/75/27/55/1119752755.db2.gz PEEAQGSWWQQTSK-UHFFFAOYSA-N 1 0 285.387 3.731 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]Cc1ccc2ccccc2n1 ZINC000725847563 1119833680 /nfs/dbraw/zinc/83/36/80/1119833680.db2.gz DHKPPTKUJUDPHS-UHFFFAOYSA-N 1 0 298.773 3.884 20 10 CHCDRO C[C@H]([NH2+]CC1CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000177834314 1119867759 /nfs/dbraw/zinc/86/77/59/1119867759.db2.gz RXEUPCMXJHASLT-ZDUSSCGKSA-N 1 0 276.399 3.877 20 10 CHCDRO CC(=O)c1cc(F)cc(C[NH2+][C@H](C)c2ccccc2)c1O ZINC000181377492 1128875900 /nfs/dbraw/zinc/87/59/00/1128875900.db2.gz ULROWBWDWCJRBQ-LLVKDONJSA-N 1 0 287.334 3.585 20 10 CHCDRO C[C@H]([NH2+]CC1SCCS1)c1cc(Cl)ccc1O ZINC000850560216 1119981149 /nfs/dbraw/zinc/98/11/49/1119981149.db2.gz JQNZOQJAORAPGT-QMMMGPOBSA-N 1 0 289.853 3.502 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+][C@H]1CCCC(F)(F)C1 ZINC000695097684 1120105062 /nfs/dbraw/zinc/10/50/62/1120105062.db2.gz QDMGMNKNYDGVIJ-NSHDSACASA-N 1 0 275.726 3.713 20 10 CHCDRO CC(C)Cc1ccc(C[NH2+]Cc2ccc3c(c2)CCO3)cn1 ZINC000892791902 1120142750 /nfs/dbraw/zinc/14/27/50/1120142750.db2.gz ANAPHHZPMLKDNH-UHFFFAOYSA-N 1 0 296.414 3.505 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCOC1(C)C)c1ccc2ccccc2c1O ZINC000328416161 1120174979 /nfs/dbraw/zinc/17/49/79/1120174979.db2.gz IKSCIWPHERUZHG-LRDDRELGSA-N 1 0 285.387 3.764 20 10 CHCDRO CCCC[C@@H](C)[N@H+](C)Cc1cccc(OCC)c1O ZINC000311996825 1120210707 /nfs/dbraw/zinc/21/07/07/1120210707.db2.gz QXDYEXSGASYBRF-CYBMUJFWSA-N 1 0 265.397 3.801 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1)c1cn[nH]c1 ZINC000271461004 1120253416 /nfs/dbraw/zinc/25/34/16/1120253416.db2.gz HJKONTUCBAHXAP-LSDHHAIUSA-N 1 0 298.434 3.812 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCc2ccccc21)c1ccccc1O ZINC000182791001 1120328025 /nfs/dbraw/zinc/32/80/25/1120328025.db2.gz XZCCCKDIQWNOPN-DZGCQCFKSA-N 1 0 267.372 3.773 20 10 CHCDRO Cc1ccc(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)cn1 ZINC000756421540 1120337049 /nfs/dbraw/zinc/33/70/49/1120337049.db2.gz ZISFGMWLPLHCPG-YGRLFVJLSA-N 1 0 286.350 3.573 20 10 CHCDRO CC(C)(C)c1cccc(C[N@@H+]2CCC3(CC3)C2)c1O ZINC001143103503 1120347663 /nfs/dbraw/zinc/34/76/63/1120347663.db2.gz DUUHWSJFIQGADF-UHFFFAOYSA-N 1 0 259.393 3.676 20 10 CHCDRO Cc1c2ccccc2n(C)c1CNc1cc(N(C)C)cc[nH+]1 ZINC000672811982 1120355441 /nfs/dbraw/zinc/35/54/41/1120355441.db2.gz PXDACHIJMOKQFS-UHFFFAOYSA-N 1 0 294.402 3.560 20 10 CHCDRO CCC[N@H+](Cc1ccc(C#N)cc1C)Cc1ccccc1O ZINC000186246011 1120393947 /nfs/dbraw/zinc/39/39/47/1120393947.db2.gz SDZNQZRZFKCRHR-UHFFFAOYSA-N 1 0 294.398 3.985 20 10 CHCDRO FC1(F)CCC[C@H]1C[NH2+]Cc1ccc2c(c1)CCCO2 ZINC000922159421 1120396592 /nfs/dbraw/zinc/39/65/92/1120396592.db2.gz SBXFENZHLUOWAU-AWEZNQCLSA-N 1 0 281.346 3.537 20 10 CHCDRO CC[N@H+](Cc1c[nH]c2ccccc12)Cc1ccccc1O ZINC000191189318 1120517470 /nfs/dbraw/zinc/51/74/70/1120517470.db2.gz NMCOEMHLTVLQBV-UHFFFAOYSA-N 1 0 280.371 3.896 20 10 CHCDRO COc1ccc(C[NH2+][C@H](c2ccccn2)C2CC2)cc1C ZINC000922586039 1120558709 /nfs/dbraw/zinc/55/87/09/1120558709.db2.gz JPFJHLZROHCOTC-SFHVURJKSA-N 1 0 282.387 3.640 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]C[C@@H]2C[C@H]2C(F)(F)F)cc1 ZINC000922728337 1120590399 /nfs/dbraw/zinc/59/03/99/1120590399.db2.gz IJYFZXABXYKQNV-MXKYZYEVSA-N 1 0 298.352 3.554 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]Cc2cccc(F)c2)cc1 ZINC000020473309 1120603462 /nfs/dbraw/zinc/60/34/62/1120603462.db2.gz JSSOVOZTOUIPNZ-UHFFFAOYSA-N 1 0 286.394 3.962 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2CCSC3(CCC3)C2)cc1 ZINC000922843163 1120609908 /nfs/dbraw/zinc/60/99/08/1120609908.db2.gz SBGSKLFGOHCDCO-OAHLLOKOSA-N 1 0 290.476 3.661 20 10 CHCDRO C[N@H+](Cc1ccccc1O)[C@@H]1Cc2cccc(Cl)c2C1 ZINC001168739271 1120651930 /nfs/dbraw/zinc/65/19/30/1120651930.db2.gz NMQCZCJLPGDKHX-CQSZACIVSA-N 1 0 287.790 3.645 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)CC1CCC1 ZINC000766028277 1120669750 /nfs/dbraw/zinc/66/97/50/1120669750.db2.gz DKIFBDQIMNEKPF-CQSZACIVSA-N 1 0 260.425 3.729 20 10 CHCDRO COc1ccc(C)cc1C[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000756672844 1120685583 /nfs/dbraw/zinc/68/55/83/1120685583.db2.gz UODODUQPFUHBSQ-AWEZNQCLSA-N 1 0 285.387 3.868 20 10 CHCDRO C[C@H]([NH2+]CCSC(F)(F)F)c1ccc(N(C)C)cc1 ZINC000178417959 1120763751 /nfs/dbraw/zinc/76/37/51/1120763751.db2.gz LYUGCHZMTXPZSB-JTQLQIEISA-N 1 0 292.370 3.656 20 10 CHCDRO COc1cccc(C[N@@H+]2[C@H](C)C[C@@H]3CCCC[C@@H]32)c1O ZINC000093383563 1120796830 /nfs/dbraw/zinc/79/68/30/1120796830.db2.gz GHZOTOPTAGAWBR-IPYPFGDCSA-N 1 0 275.392 3.554 20 10 CHCDRO C[C@@H]1CC[C@@H]([NH2+]Cc2ccc3c(c2)CCO3)[C@H](C)C1 ZINC000070112593 1128941393 /nfs/dbraw/zinc/94/13/93/1128941393.db2.gz OPIGJTGXGYEGKP-XJKCOSOUSA-N 1 0 259.393 3.536 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC(C)(C)[C@H]2CCCCO2)c(O)c1 ZINC000756759820 1120806782 /nfs/dbraw/zinc/80/67/82/1120806782.db2.gz ZQBICHHTJIECHV-RHSMWYFYSA-N 1 0 291.435 3.947 20 10 CHCDRO CCc1ccc([C@@H]2C[N@H+](Cc3ccccc3O)CCO2)cc1 ZINC000191665414 1128950248 /nfs/dbraw/zinc/95/02/48/1128950248.db2.gz YNYLWWBSHCNXRL-IBGZPJMESA-N 1 0 297.398 3.528 20 10 CHCDRO COc1cccc(C[NH2+]Cc2ccc(C3CC3)cc2)c1O ZINC000191681741 1128950900 /nfs/dbraw/zinc/95/09/00/1128950900.db2.gz SRSSQRPDJQGDKB-UHFFFAOYSA-N 1 0 283.371 3.568 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)Cc2ccccc2C)c1 ZINC000314478019 1120953303 /nfs/dbraw/zinc/95/33/03/1120953303.db2.gz OUHRJOACTFEUMT-HUUCEWRRSA-N 1 0 299.414 3.991 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCc2ccccc2C)c1 ZINC000094182628 1120979646 /nfs/dbraw/zinc/97/96/46/1120979646.db2.gz CUWLGWIQSBLBAX-OAHLLOKOSA-N 1 0 269.388 3.902 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](O)CC(C)(C)C)c1ccc(N(C)C)cc1 ZINC000766057786 1121064554 /nfs/dbraw/zinc/06/45/54/1121064554.db2.gz AYCXQINJIPNBLK-DLBZAZTESA-N 1 0 292.467 3.590 20 10 CHCDRO C[C@@H]([NH2+]CCOC1CCCCC1)c1cc(F)ccc1O ZINC000094618228 1121085890 /nfs/dbraw/zinc/08/58/90/1121085890.db2.gz BQXCQDDDOUQMKN-GFCCVEGCSA-N 1 0 281.371 3.531 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(Cl)o1)c1cc(F)ccc1O ZINC000700570088 1121107800 /nfs/dbraw/zinc/10/78/00/1121107800.db2.gz VCXNPKBDAIDAME-MRVPVSSYSA-N 1 0 269.703 3.629 20 10 CHCDRO Cc1c[nH+]ccc1NCc1ccc(N2CCSCC2)cc1 ZINC000191979220 1128963611 /nfs/dbraw/zinc/96/36/11/1128963611.db2.gz TUIHGNSEHXDRHQ-UHFFFAOYSA-N 1 0 299.443 3.555 20 10 CHCDRO CC1(C)CC(C[NH2+]Cc2cc(Cl)ccc2O)C1 ZINC000701692669 1121164483 /nfs/dbraw/zinc/16/44/83/1121164483.db2.gz JBUFEZBYDPGURT-UHFFFAOYSA-N 1 0 253.773 3.571 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCC2(F)CCC2)c(O)c1 ZINC000702433190 1121199311 /nfs/dbraw/zinc/19/93/11/1121199311.db2.gz UNJYZOREHUXEQC-LBPRGKRZSA-N 1 0 251.345 3.634 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+]CCSC(C)C)c1O ZINC000809722325 1121206372 /nfs/dbraw/zinc/20/63/72/1121206372.db2.gz SQGASAZSYKIDHU-UHFFFAOYSA-N 1 0 273.829 3.585 20 10 CHCDRO C[C@H]([NH2+]CCC1SCCS1)c1ccc(N(C)C)cc1 ZINC000703313410 1121246346 /nfs/dbraw/zinc/24/63/46/1121246346.db2.gz SCBJHPDJIROVQI-LBPRGKRZSA-N 1 0 296.505 3.599 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2c(C)cccc2C)c1 ZINC000182465750 1128973513 /nfs/dbraw/zinc/97/35/13/1128973513.db2.gz PSWNYSHDMLWINM-AWEZNQCLSA-N 1 0 285.387 3.868 20 10 CHCDRO CC[C@H]([NH2+]CCCCCC[NH3+])c1cccc(Cl)c1[O-] ZINC000843342696 1121323916 /nfs/dbraw/zinc/32/39/16/1121323916.db2.gz SGCOAXMFWIMOKL-AWEZNQCLSA-N 1 0 284.831 3.605 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[NH2+][C@@H]1CCCC12CC2 ZINC000706941705 1121446158 /nfs/dbraw/zinc/44/61/58/1121446158.db2.gz KMLQVRMJYDUSPK-QGZVFWFLSA-N 1 0 270.420 3.709 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CCC[C@@H](C(C)(C)C)C2)c1 ZINC000708454217 1121464888 /nfs/dbraw/zinc/46/48/88/1121464888.db2.gz NCRVNHQZFBMRLF-CQSZACIVSA-N 1 0 277.408 3.659 20 10 CHCDRO COc1cccc(C[NH2+][C@H]2C[C@H](C)CC(C)(C)C2)c1O ZINC000708233270 1121465198 /nfs/dbraw/zinc/46/51/98/1121465198.db2.gz KNFSFYIUZZQPST-JSGCOSHPSA-N 1 0 277.408 3.705 20 10 CHCDRO CCc1cccc(C[N@@H+]2CCC[C@@H](C(F)(F)F)C2)c1O ZINC000709328238 1121470487 /nfs/dbraw/zinc/47/04/87/1121470487.db2.gz AFVPFRSLBVDULO-CYBMUJFWSA-N 1 0 287.325 3.729 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H](C)CC(C)(C)OC)cc1 ZINC000236908765 1121475419 /nfs/dbraw/zinc/47/54/19/1121475419.db2.gz UZGUHLPJBLRCCQ-OAHLLOKOSA-N 1 0 292.467 3.826 20 10 CHCDRO Cc1ccc(Nc2[nH]cc[nH+]2)c(C(=O)c2ccccc2)c1 ZINC001176085010 1121534864 /nfs/dbraw/zinc/53/48/64/1121534864.db2.gz BGSUMPVURQXYTG-UHFFFAOYSA-N 1 0 277.327 3.693 20 10 CHCDRO CC[N@@H+](Cc1ccc(N(C)C)cc1)CC1OC=CC1=S ZINC001237180727 1128997059 /nfs/dbraw/zinc/99/70/59/1128997059.db2.gz BECJZKVWBJQVMB-UHFFFAOYSA-N 1 0 290.432 3.656 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](CC(F)(F)F)C(C)C)c(O)c1 ZINC000877462123 1121633084 /nfs/dbraw/zinc/63/30/84/1121633084.db2.gz KSOHMVPPJMZQED-LBPRGKRZSA-N 1 0 275.314 3.767 20 10 CHCDRO COc1cc(C)cc(C[NH2+][C@H](C)c2ccccc2C)c1O ZINC000894150721 1121671102 /nfs/dbraw/zinc/67/11/02/1121671102.db2.gz PPKHPCOZCKRIFX-CQSZACIVSA-N 1 0 285.387 3.868 20 10 CHCDRO CCCN(CCC)c1ccc(C[NH2+]C(C)(C)COC)cc1 ZINC000727471757 1121718958 /nfs/dbraw/zinc/71/89/58/1121718958.db2.gz KVCFIVQYEKHVBI-UHFFFAOYSA-N 1 0 292.467 3.828 20 10 CHCDRO CN(C)c1ccc(C[NH2+]Cc2ccc3cccnc3c2)cc1 ZINC000727464487 1121720971 /nfs/dbraw/zinc/72/09/71/1121720971.db2.gz ROXJQCDOZAWDNK-UHFFFAOYSA-N 1 0 291.398 3.591 20 10 CHCDRO COc1ccc(C[NH2+]Cc2ccc3cccnc3c2)cc1C ZINC000727470874 1121722136 /nfs/dbraw/zinc/72/21/36/1121722136.db2.gz QCSPXESXTSUACN-UHFFFAOYSA-N 1 0 292.382 3.842 20 10 CHCDRO COc1cc(C)cc(C[NH2+][C@@H](C)c2ccc(C)cc2)c1O ZINC000894192401 1121728792 /nfs/dbraw/zinc/72/87/92/1121728792.db2.gz BVYLUYIHIMVJNN-AWEZNQCLSA-N 1 0 285.387 3.868 20 10 CHCDRO COc1cc(C)cc(C[NH2+][C@H]2CCc3cc(C)ccc32)c1O ZINC000894205392 1121738376 /nfs/dbraw/zinc/73/83/76/1121738376.db2.gz YKLGUVOPHCVJHW-KRWDZBQOSA-N 1 0 297.398 3.795 20 10 CHCDRO CCC[N@H+](Cc1ccc(OC)cc1)Cc1ccccc1O ZINC000727830935 1121749254 /nfs/dbraw/zinc/74/92/54/1121749254.db2.gz WNWPQUULMLHQMS-UHFFFAOYSA-N 1 0 285.387 3.813 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H]2CC[C@@H](C)C2)cc1F ZINC001177795467 1121751058 /nfs/dbraw/zinc/75/10/58/1121751058.db2.gz TWTYXUDSQLRBLS-HIFRSBDPSA-N 1 0 278.415 3.950 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H]1CC[C@H](C)C1 ZINC001206321142 1121771234 /nfs/dbraw/zinc/77/12/34/1121771234.db2.gz PROKIQJTGGHKDX-QRTARXTBSA-N 1 0 274.452 3.770 20 10 CHCDRO CCCOc1ccc(C[NH2+][C@@H]2C[C@@H](C)O[C@@H](C)C2)cc1C ZINC001178398323 1121783850 /nfs/dbraw/zinc/78/38/50/1121783850.db2.gz MPRPALIDCWAWRF-SCAQPMJSSA-N 1 0 291.435 3.829 20 10 CHCDRO CCCOc1ccc(C[NH2+]C2C[C@H](C)O[C@@H](C)C2)cc1C ZINC001178398321 1121783896 /nfs/dbraw/zinc/78/38/96/1121783896.db2.gz MPRPALIDCWAWRF-GJZGRUSLSA-N 1 0 291.435 3.829 20 10 CHCDRO CCCc1ncc(C[NH2+]Cc2c(C)c3ccccc3n2C)o1 ZINC001178713480 1121808936 /nfs/dbraw/zinc/80/89/36/1121808936.db2.gz RCMWCZGMRFMTEV-UHFFFAOYSA-N 1 0 297.402 3.717 20 10 CHCDRO CCN(C)c1ccc(C[N@H+](CC)Cc2ccccn2)cc1 ZINC000773764735 1121809930 /nfs/dbraw/zinc/80/99/30/1121809930.db2.gz CQQWDMKTDJLDJZ-UHFFFAOYSA-N 1 0 283.419 3.560 20 10 CHCDRO c1cc2c(cc1C[NH2+]C[C@@H]1CC[C@@H]3C[C@@H]3C1)CCCO2 ZINC001179228018 1121861427 /nfs/dbraw/zinc/86/14/27/1121861427.db2.gz BKGKQGKBFDIMLG-UNEWFSDZSA-N 1 0 271.404 3.537 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CC=CC[C@H]2C)cc1 ZINC001179771630 1121906084 /nfs/dbraw/zinc/90/60/84/1121906084.db2.gz JGJVEQWUPSISCC-CRAIPNDOSA-N 1 0 272.436 3.977 20 10 CHCDRO COc1ccc(C[NH2+]CC[C@@H]2CCC(F)(F)C2)cc1C ZINC001179758150 1121909860 /nfs/dbraw/zinc/90/98/60/1121909860.db2.gz BMBYYDQBRKRNRA-ZDUSSCGKSA-N 1 0 283.362 3.919 20 10 CHCDRO CC[C@@H]1C[N@H+](Cc2cc(C(C)C)c(C)cc2O)C[C@@H](C)O1 ZINC000732184544 1121909739 /nfs/dbraw/zinc/90/97/39/1121909739.db2.gz CLZUIKMRSMHBPQ-GDBMZVCRSA-N 1 0 291.435 3.823 20 10 CHCDRO CCOCc1cc(C[NH2+]C(C)(C)C(C)C)ccc1OC ZINC000732229555 1121911663 /nfs/dbraw/zinc/91/16/63/1121911663.db2.gz HZUDOKRLXMJXON-UHFFFAOYSA-N 1 0 279.424 3.756 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CC2=CCCC2)cc1F ZINC001203187670 1121943523 /nfs/dbraw/zinc/94/35/23/1121943523.db2.gz MLNUTBZFLITKGK-UHFFFAOYSA-N 1 0 276.399 3.872 20 10 CHCDRO COc1ccc(O)c(C[N@H+](C)[C@H](C)Cc2cccs2)c1 ZINC001180057431 1121944561 /nfs/dbraw/zinc/94/45/61/1121944561.db2.gz DERLEDZESWQZJU-GFCCVEGCSA-N 1 0 291.416 3.525 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2ccc([C@H]3C[C@@H]3C)o2)c1 ZINC000733325034 1121976467 /nfs/dbraw/zinc/97/64/67/1121976467.db2.gz SUDMBULWKYJXMY-WFASDCNBSA-N 1 0 271.360 3.707 20 10 CHCDRO C[C@H]1CCCC[C@@H]1OCC[NH2+]Cc1c(O)cccc1Cl ZINC000733324783 1121976801 /nfs/dbraw/zinc/97/68/01/1121976801.db2.gz CGHKRUMFHXLDFJ-LRDDRELGSA-N 1 0 297.826 3.731 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]CCc2ccc3ccccc3n2)c1 ZINC000733326371 1121977953 /nfs/dbraw/zinc/97/79/53/1121977953.db2.gz ZHDRWAYEIXBGBX-UHFFFAOYSA-N 1 0 292.382 3.581 20 10 CHCDRO CCCC[N@H+](CC)Cc1c(O)cc(C)cc1Cl ZINC001180437458 1121987820 /nfs/dbraw/zinc/98/78/20/1121987820.db2.gz IBZPVJFMRKOFOC-UHFFFAOYSA-N 1 0 255.789 3.976 20 10 CHCDRO CC(C)[C@@H](C)[N@H+](C)Cc1cc(Cl)c(F)cc1[O-] ZINC000816485534 1122025168 /nfs/dbraw/zinc/02/51/68/1122025168.db2.gz QJUJZRMCKBXCRK-SECBINFHSA-N 1 0 259.752 3.661 20 10 CHCDRO CC[C@@H]1[C@@H](C)CC[N@@H+]1Cc1ccc(N(C)C)cc1C ZINC001181102714 1122033666 /nfs/dbraw/zinc/03/36/66/1122033666.db2.gz RYWXQRCVCSWNNA-SUMWQHHRSA-N 1 0 260.425 3.681 20 10 CHCDRO CCOC[C@@H]([NH2+]Cc1cc(Cl)c(C)cc1O)C(C)C ZINC001181391284 1122054164 /nfs/dbraw/zinc/05/41/64/1122054164.db2.gz WMXAIBSOMFNTEZ-CQSZACIVSA-N 1 0 285.815 3.505 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H]1CC[C@H]1C1CCC1 ZINC001181446293 1122055219 /nfs/dbraw/zinc/05/52/19/1122055219.db2.gz XDHSVXFIKDRWMD-ZWKOTPCHSA-N 1 0 272.436 3.940 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCC[C@@H]2C(C)C)c1 ZINC001181544819 1122061827 /nfs/dbraw/zinc/06/18/27/1122061827.db2.gz ZTQIRMUAAVETIN-JGGQBBKZSA-N 1 0 277.408 3.876 20 10 CHCDRO CN(C)c1ccc(/C=C/C[N@@H+]2CCC[C@H](C3CC3)C2)cc1 ZINC001182184892 1122116910 /nfs/dbraw/zinc/11/69/10/1122116910.db2.gz USSRUMHXALVURL-YZTRRJNXSA-N 1 0 284.447 3.888 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1ccc2c(c1)OCO2)c1ccccc1O ZINC000192750289 1129033872 /nfs/dbraw/zinc/03/38/72/1129033872.db2.gz CECMRCFHFWYCPS-WFASDCNBSA-N 1 0 299.370 3.923 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H]1CCC12CCC2 ZINC001182424422 1122151947 /nfs/dbraw/zinc/15/19/47/1122151947.db2.gz UGAYYQFZCUZQFF-MAUKXSAKSA-N 1 0 286.463 3.914 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H]1CCC12CCC2 ZINC001182424424 1122152589 /nfs/dbraw/zinc/15/25/89/1122152589.db2.gz UGAYYQFZCUZQFF-YJBOKZPZSA-N 1 0 286.463 3.914 20 10 CHCDRO CC(C)c1ccc(O)c(C[N@@H+]2C[C@H](C)[C@@H](C)[C@H]2C)c1 ZINC001182450838 1122160299 /nfs/dbraw/zinc/16/02/99/1122160299.db2.gz AFRZTEZZALITFH-BFHYXJOUSA-N 1 0 261.409 3.992 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2C[C@H](C)[C@H](C)[C@@H]2C)c(Cl)c1 ZINC001182453749 1122161509 /nfs/dbraw/zinc/16/15/09/1122161509.db2.gz VREIVDASYNLTSK-SRVKXCTJSA-N 1 0 267.800 3.830 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cccc3cc[nH]c32)c1 ZINC000774428177 1122163182 /nfs/dbraw/zinc/16/31/82/1122163182.db2.gz BBZLHNOBVWVNOH-GFCCVEGCSA-N 1 0 296.370 3.733 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+][C@H]2CCOC3(CCC3)C2)c1O ZINC000271876961 1122180588 /nfs/dbraw/zinc/18/05/88/1122180588.db2.gz ZPCKNULJECZIPA-AWEZNQCLSA-N 1 0 295.810 3.545 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+][C@H]1CC[C@H]1C1CCC1 ZINC001182684096 1122182748 /nfs/dbraw/zinc/18/27/48/1122182748.db2.gz JQSHMMCAZGMGIM-KBPBESRZSA-N 1 0 265.784 3.714 20 10 CHCDRO CC1(C)CCC[C@H]1CC[NH2+]Cc1cc(F)ccc1O ZINC001183010440 1122199584 /nfs/dbraw/zinc/19/95/84/1122199584.db2.gz HNKJVJDDHXJFHJ-ZDUSSCGKSA-N 1 0 265.372 3.837 20 10 CHCDRO Cc1ncccc1C[NH2+]Cc1cc(C(C)C)ccc1O ZINC001183208199 1122213448 /nfs/dbraw/zinc/21/34/48/1122213448.db2.gz XTXXPZWQTUKXIJ-UHFFFAOYSA-N 1 0 270.376 3.509 20 10 CHCDRO Cc1cc(C[NH+](C)C)cc(N[C@H](C)c2ccccc2O)c1 ZINC000272815102 1122213426 /nfs/dbraw/zinc/21/34/26/1122213426.db2.gz DXKYQXQISJGKBP-CQSZACIVSA-N 1 0 284.403 3.935 20 10 CHCDRO COCC[C@@H]([NH2+][C@H](C)c1ccccc1O)c1ccc(C)o1 ZINC000272812073 1122213442 /nfs/dbraw/zinc/21/34/42/1122213442.db2.gz DGYZMDKKFMGFAW-UKRRQHHQSA-N 1 0 289.375 3.722 20 10 CHCDRO Cc1cc(C[NH2+][C@@H]2CCO[C@H]2C)c(C)n1-c1cccc(C)c1 ZINC001183268618 1122216563 /nfs/dbraw/zinc/21/65/63/1122216563.db2.gz HUMXOHJWYVCFGV-QFBILLFUSA-N 1 0 298.430 3.670 20 10 CHCDRO CC1=CCC[C@@H](C)[C@@H]1C[N@@H+]1Cc2cccc(O)c2C1 ZINC001183454574 1122223307 /nfs/dbraw/zinc/22/33/07/1122223307.db2.gz MHLFGBRQEDGYBA-UKRRQHHQSA-N 1 0 257.377 3.700 20 10 CHCDRO COC1(C)CC[NH+](Cc2cc(C(C)C)c(C)cc2O)CC1 ZINC000774642499 1122227202 /nfs/dbraw/zinc/22/72/02/1122227202.db2.gz CLQNDBZUSTZBAO-UHFFFAOYSA-N 1 0 291.435 3.825 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC2([C@@H](C)CCO)CCC2)c(O)c1 ZINC000273347161 1122228921 /nfs/dbraw/zinc/22/89/21/1122228921.db2.gz AZWJHQLDCYWWAX-LSDHHAIUSA-N 1 0 291.435 3.540 20 10 CHCDRO C[C@@H]([NH2+]CC1(C)CCOCC1)c1cc(Cl)ccc1O ZINC000273349425 1122229327 /nfs/dbraw/zinc/22/93/27/1122229327.db2.gz BIVAZKIILASBRS-LLVKDONJSA-N 1 0 283.799 3.513 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC2([C@H](C)CCO)CCC2)c(O)c1 ZINC000273347159 1122229570 /nfs/dbraw/zinc/22/95/70/1122229570.db2.gz AZWJHQLDCYWWAX-HUUCEWRRSA-N 1 0 291.435 3.540 20 10 CHCDRO CCOc1ccc(C[NH2+][C@@H](C)c2cc(F)ccc2O)cc1 ZINC000273441271 1122232370 /nfs/dbraw/zinc/23/23/70/1122232370.db2.gz YMEJTUOYASMZRK-LBPRGKRZSA-N 1 0 289.350 3.781 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccccn2)c(O)c1C ZINC000273427572 1122233326 /nfs/dbraw/zinc/23/33/26/1122233326.db2.gz UREUJQODVBPUCE-ZIAGYGMSSA-N 1 0 270.376 3.816 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCc2ccncc2C)c(O)c1C ZINC000273499781 1122236352 /nfs/dbraw/zinc/23/63/52/1122236352.db2.gz PYPGREVEPIYZJJ-HNNXBMFYSA-N 1 0 284.403 3.606 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCO[C@@H](C(C)C)C2)c(O)c1C ZINC000273538277 1122237342 /nfs/dbraw/zinc/23/73/42/1122237342.db2.gz XSXXRYZFIDFKOK-ZMSDIMECSA-N 1 0 291.435 3.863 20 10 CHCDRO Cc1ccn2cc(C[NH2+][C@@H](C)c3ccc(C)cc3O)nc2c1 ZINC000273550394 1122239283 /nfs/dbraw/zinc/23/92/83/1122239283.db2.gz FTFXIPHWOJWOFN-AWEZNQCLSA-N 1 0 295.386 3.508 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCc3c2cccc3O)c(O)c1 ZINC000273606060 1122240334 /nfs/dbraw/zinc/24/03/34/1122240334.db2.gz UEQZSGKFPWCZSL-MLGOLLRUSA-N 1 0 283.371 3.744 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCCNc2ccccn2)c(O)c1C ZINC000273608513 1122240500 /nfs/dbraw/zinc/24/05/00/1122240500.db2.gz UYIIVZJSDXQION-OAHLLOKOSA-N 1 0 299.418 3.557 20 10 CHCDRO COc1cc(C)cc(C[N@@H+]2CC[C@@H](C)C[C@@H](C)C2)c1O ZINC001183874806 1122243421 /nfs/dbraw/zinc/24/34/21/1122243421.db2.gz BYWOKBIACYEDLU-TZMCWYRMSA-N 1 0 277.408 3.577 20 10 CHCDRO [O-]c1cccc(F)c1C[NH2+]CCc1ccc(Cl)cc1 ZINC001183919200 1122248151 /nfs/dbraw/zinc/24/81/51/1122248151.db2.gz GUVRJAJQKRMMLY-UHFFFAOYSA-N 1 0 279.742 3.517 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2ccc3ncccc3c2)c1 ZINC000192982049 1129049361 /nfs/dbraw/zinc/04/93/61/1129049361.db2.gz QJHXJHCJQHPKCE-UHFFFAOYSA-N 1 0 278.355 3.539 20 10 CHCDRO CC[C@@H](c1ccccc1)[N@H+](C)Cc1ccc(OC)cc1O ZINC001203628493 1122363725 /nfs/dbraw/zinc/36/37/25/1122363725.db2.gz AXDAIRWWBYAUCN-KRWDZBQOSA-N 1 0 285.387 3.984 20 10 CHCDRO Cc1cc(C[NH2+][C@H](C)c2ccccc2O)ccc1F ZINC000183393284 1129051824 /nfs/dbraw/zinc/05/18/24/1129051824.db2.gz DAVBINMQSVKEEL-GFCCVEGCSA-N 1 0 259.324 3.691 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H](C1CCCCC1)N(C)C)c1ccccc1O ZINC000183425831 1129054500 /nfs/dbraw/zinc/05/45/00/1129054500.db2.gz JCOARAKJLAEOFD-PBHICJAKSA-N 1 0 290.451 3.553 20 10 CHCDRO C[C@@H]([NH2+]CCOc1ccccc1Cl)c1ccccc1O ZINC000775135077 1122437264 /nfs/dbraw/zinc/43/72/64/1122437264.db2.gz CWDAZWLZDGGYDQ-GFCCVEGCSA-N 1 0 291.778 3.775 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@H]1CCO[C@H](C(C)C)C1 ZINC000775140241 1122439277 /nfs/dbraw/zinc/43/92/77/1122439277.db2.gz LGPXMZXNXAPMCH-ROUUACIJSA-N 1 0 290.451 3.565 20 10 CHCDRO C[C@H]([NH2+]CCCCN(C)c1ccccc1)c1ccccc1O ZINC000183438810 1129055012 /nfs/dbraw/zinc/05/50/12/1129055012.db2.gz QVOGXFMPADHTGH-INIZCTEOSA-N 1 0 298.430 3.959 20 10 CHCDRO COc1ccc(O)c(C[N@H+](C)Cc2cc(C)cc(C)c2)c1 ZINC000775151974 1122446461 /nfs/dbraw/zinc/44/64/61/1122446461.db2.gz PEHZSMWXXQVUDC-UHFFFAOYSA-N 1 0 285.387 3.650 20 10 CHCDRO COc1cccc(O)c1C[N@H+](C)[C@@H](C)Cc1ccccc1C ZINC000775203902 1122478699 /nfs/dbraw/zinc/47/86/99/1122478699.db2.gz KGOMTGIHBULVFG-HNNXBMFYSA-N 1 0 299.414 3.772 20 10 CHCDRO C[C@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1ccccc1O ZINC000183480999 1129057806 /nfs/dbraw/zinc/05/78/06/1129057806.db2.gz PGKBCLWVLUHGIT-ZDUSSCGKSA-N 1 0 294.354 3.898 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H]2CCCO[C@H]2CC(C)C)cc1C ZINC000775372107 1122531279 /nfs/dbraw/zinc/53/12/79/1122531279.db2.gz RRGULRZBUDOIJA-WMZOPIPTSA-N 1 0 291.435 3.692 20 10 CHCDRO Cc1cccc(O[C@@H](C)C[NH2+][C@@H](C)c2ccccc2O)c1 ZINC000183533698 1129060748 /nfs/dbraw/zinc/06/07/48/1129060748.db2.gz YNMMOZNNJXCJAT-GJZGRUSLSA-N 1 0 285.387 3.819 20 10 CHCDRO CC[C@H]([NH2+]Cc1c(C)nc2ccccn21)c1ccccc1O ZINC000775414946 1122557228 /nfs/dbraw/zinc/55/72/28/1122557228.db2.gz MDBXZSMGQARPTQ-HNNXBMFYSA-N 1 0 295.386 3.589 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H](C)c2c(F)cccc2F)c1 ZINC000071408074 1129062425 /nfs/dbraw/zinc/06/24/25/1129062425.db2.gz MDMIWHAUTGBQHY-NSHDSACASA-N 1 0 277.314 3.830 20 10 CHCDRO Cc1cc(C[NH+]2CCC(C(C)C)CC2)ccc1N(C)C ZINC001191013852 1122564836 /nfs/dbraw/zinc/56/48/36/1122564836.db2.gz PRJGHBVTZZTJJZ-UHFFFAOYSA-N 1 0 274.452 3.929 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](C)N(C)c1ccccc1)c1ccccc1O ZINC000775487020 1122616399 /nfs/dbraw/zinc/61/63/99/1122616399.db2.gz GAQORXMILILJDU-MAUKXSAKSA-N 1 0 298.430 3.958 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCCCO1)c1cc(Cl)ccc1O ZINC000775490809 1122619282 /nfs/dbraw/zinc/61/92/82/1122619282.db2.gz XHWIBMKHWXYHGP-JSGCOSHPSA-N 1 0 283.799 3.655 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CCCc2nc(C)ncc21)c1ccccc1O ZINC000775508738 1122629896 /nfs/dbraw/zinc/62/98/96/1122629896.db2.gz WSAUITUDUMSDJS-WBVHZDCISA-N 1 0 297.402 3.609 20 10 CHCDRO CC[C@H]([NH2+]CC[C@H](C)OC)c1cc(Cl)ccc1O ZINC000775502529 1122630874 /nfs/dbraw/zinc/63/08/74/1122630874.db2.gz XGOQMAQCLLBVEV-GWCFXTLKSA-N 1 0 271.788 3.511 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCC[C@@H](O)C1)c1cc(Cl)ccc1O ZINC000775508370 1122631533 /nfs/dbraw/zinc/63/15/33/1122631533.db2.gz BOTLXBFAWXZTFF-LNSITVRQSA-N 1 0 297.826 3.637 20 10 CHCDRO CC[C@H]([NH2+]CCc1cc(F)ccc1F)c1ccccc1O ZINC000775513645 1122632643 /nfs/dbraw/zinc/63/26/43/1122632643.db2.gz QZFIFQXVFJBRSK-INIZCTEOSA-N 1 0 291.341 3.954 20 10 CHCDRO CC[C@H]([NH2+][C@H]1C[C@](C)(OC)C1(C)C)c1ccccc1O ZINC000775513168 1122633597 /nfs/dbraw/zinc/63/35/97/1122633597.db2.gz OONHHJIOUSRLHJ-QRTARXTBSA-N 1 0 277.408 3.637 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCO[C@H](C)C1)c1cc(Cl)ccc1O ZINC000775520201 1122638324 /nfs/dbraw/zinc/63/83/24/1122638324.db2.gz QPTMGIICLCGWGA-XUJVJEKNSA-N 1 0 297.826 3.901 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](C)SC)c1cc(Cl)ccc1O ZINC000775524661 1122641560 /nfs/dbraw/zinc/64/15/60/1122641560.db2.gz VRWNVBNHMLDKGY-BXKDBHETSA-N 1 0 273.829 3.838 20 10 CHCDRO C1=CC[C@@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000080123301 1129068313 /nfs/dbraw/zinc/06/83/13/1129068313.db2.gz UFSZURZIPRVTHZ-QGZVFWFLSA-N 1 0 270.420 3.875 20 10 CHCDRO CC[C@H]([NH2+]CCCCCCO)c1cc(Cl)ccc1O ZINC000775531411 1122649876 /nfs/dbraw/zinc/64/98/76/1122649876.db2.gz BYWVHUKVJCJFLA-AWEZNQCLSA-N 1 0 285.815 3.639 20 10 CHCDRO CC[C@H]1CC[C@@H](C)[N@@H+]1Cc1ccc(N(C)C)c(C)c1 ZINC001192645511 1122655080 /nfs/dbraw/zinc/65/50/80/1122655080.db2.gz NRIOPXPZMKGLTH-ZBFHGGJFSA-N 1 0 260.425 3.824 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)[C@H]1CCCOC1)c1cc(Cl)ccc1O ZINC000775548488 1122659241 /nfs/dbraw/zinc/65/92/41/1122659241.db2.gz SZETVYNIHMMDIJ-XUJVJEKNSA-N 1 0 297.826 3.901 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1cncs1)c1ccc(N(C)C)cc1 ZINC000775580918 1122681104 /nfs/dbraw/zinc/68/11/04/1122681104.db2.gz DOMOUONRXNMYET-NEPJUHHUSA-N 1 0 275.421 3.621 20 10 CHCDRO Cc1cc(C[N@@H+]2CCC(C)=C(C)C2)ccc1N(C)C ZINC001193913031 1122728706 /nfs/dbraw/zinc/72/87/06/1122728706.db2.gz CAYQODHEGXEXMT-UHFFFAOYSA-N 1 0 258.409 3.603 20 10 CHCDRO COc1cc(C)cc(C[NH2+]CCCCCCSC)c1O ZINC000894445262 1122853558 /nfs/dbraw/zinc/85/35/58/1122853558.db2.gz PKJLCURKEQLAMJ-UHFFFAOYSA-N 1 0 297.464 3.722 20 10 CHCDRO COc1ccc(O)c(C[N@H+](C2CC2)C2CCC(C)CC2)c1 ZINC000775648220 1122856757 /nfs/dbraw/zinc/85/67/57/1122856757.db2.gz ALIORIPPIKSTKM-UHFFFAOYSA-N 1 0 289.419 3.944 20 10 CHCDRO CCC(CC)[N@H+](Cc1cc(OC)ccc1O)C1CC1 ZINC000775649451 1122862603 /nfs/dbraw/zinc/86/26/03/1122862603.db2.gz RMXYVVMVBGSPAO-UHFFFAOYSA-N 1 0 263.381 3.554 20 10 CHCDRO COc1ccc(CCC[N@H+](C)Cc2cccc(C)c2O)cc1 ZINC000775659102 1122872790 /nfs/dbraw/zinc/87/27/90/1122872790.db2.gz WVJTXCBPTSMRHF-UHFFFAOYSA-N 1 0 299.414 3.774 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+](C)Cc2ccoc2)c1O ZINC000775662882 1122876586 /nfs/dbraw/zinc/87/65/86/1122876586.db2.gz HOLUBMTZIRSPFN-UHFFFAOYSA-N 1 0 265.740 3.579 20 10 CHCDRO CC[N@@H+](Cc1cc(Cl)cc(C)c1O)CC1CC1 ZINC000775700152 1122911693 /nfs/dbraw/zinc/91/16/93/1122911693.db2.gz CLDVPFSSNAUQNP-UHFFFAOYSA-N 1 0 253.773 3.586 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CC[C@H](c3ccccc3)[C@H]2C)c1 ZINC000775723017 1122924700 /nfs/dbraw/zinc/92/47/00/1122924700.db2.gz BNKFRYHACYFYLN-KDOFPFPSSA-N 1 0 297.398 3.779 20 10 CHCDRO CSC[C@H]1CCC[N@@H+]1Cc1cc(Cl)cc(C)c1O ZINC000775724826 1122925921 /nfs/dbraw/zinc/92/59/21/1122925921.db2.gz RDAOTVLLRSWCQW-CYBMUJFWSA-N 1 0 285.840 3.681 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2CC[C@H](C3CC3)C2)c1O ZINC000775726361 1122926539 /nfs/dbraw/zinc/92/65/39/1122926539.db2.gz QVXBVPBCXDHBJT-LBPRGKRZSA-N 1 0 265.784 3.586 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CC1(Cl)Cl)c1ccc(N(C)C)cc1 ZINC000775834053 1122986809 /nfs/dbraw/zinc/98/68/09/1122986809.db2.gz JPQGYNFYBFLFIX-PWSUYJOCSA-N 1 0 287.234 3.597 20 10 CHCDRO CN(C)c1ccc(C[NH+]2CC(C)(CC(F)(F)F)C2)cc1 ZINC000839142063 1122999862 /nfs/dbraw/zinc/99/98/62/1122999862.db2.gz AHAPFEXLPBKFSS-UHFFFAOYSA-N 1 0 286.341 3.527 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2cc(Cl)cc(C)c2O)nc1C ZINC000839163331 1123008466 /nfs/dbraw/zinc/00/84/66/1123008466.db2.gz IAGRWGVARRKPBW-UHFFFAOYSA-N 1 0 290.794 3.656 20 10 CHCDRO Cc1cccc(C[N@H+]2CCC[C@@H](C(F)(F)F)[C@H]2C)c1O ZINC000776013185 1123035495 /nfs/dbraw/zinc/03/54/95/1123035495.db2.gz LFDDVBTVWZOCBI-DGCLKSJQSA-N 1 0 287.325 3.863 20 10 CHCDRO C[C@H](Cc1cccc(F)c1)[NH2+]Cc1cc(Cl)ccc1O ZINC000776207913 1123146188 /nfs/dbraw/zinc/14/61/88/1123146188.db2.gz RIBCIGCHSSDZND-LLVKDONJSA-N 1 0 293.769 3.906 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+]CCC2=CCCC2)c1O ZINC000776252178 1123179621 /nfs/dbraw/zinc/17/96/21/1123179621.db2.gz OSCDUVKHMLTCEK-UHFFFAOYSA-N 1 0 265.784 3.944 20 10 CHCDRO Cc1cc(C[N@@H+]2CCCO[C@H](C)C2)c(C)n1-c1ccccc1 ZINC001137854065 1123214212 /nfs/dbraw/zinc/21/42/12/1123214212.db2.gz HBRHKEAAIHVXIK-MRXNPFEDSA-N 1 0 298.430 3.705 20 10 CHCDRO COc1cc(C[NH2+]Cc2ccco2)c(O)c(C(C)(C)C)c1 ZINC000850008229 1123237021 /nfs/dbraw/zinc/23/70/21/1123237021.db2.gz SGCUOOGXWLTXHL-UHFFFAOYSA-N 1 0 289.375 3.581 20 10 CHCDRO COc1cc(C[NH2+]C2CC=CC2)c(O)c(C(C)(C)C)c1 ZINC000850188380 1123245215 /nfs/dbraw/zinc/24/52/15/1123245215.db2.gz VQEILEVKEBQDJS-UHFFFAOYSA-N 1 0 275.392 3.507 20 10 CHCDRO CC[C@H](C)CC[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC000850355048 1123255720 /nfs/dbraw/zinc/25/57/20/1123255720.db2.gz BXGNYLOHITZGHP-HNNXBMFYSA-N 1 0 290.451 3.690 20 10 CHCDRO CCOc1ccc(O)c(CNc2[nH+]ccc(C)c2C2CC2)c1 ZINC000850362419 1123257550 /nfs/dbraw/zinc/25/75/50/1123257550.db2.gz NQNBSCWONIQDEK-UHFFFAOYSA-N 1 0 298.386 3.984 20 10 CHCDRO CC[C@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)C1CC1 ZINC000850382625 1123261269 /nfs/dbraw/zinc/26/12/69/1123261269.db2.gz ZGXNFPPPGGEYDH-OSJSJHBBSA-N 1 0 258.409 3.544 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@H]2C(C)(C)C2(F)F)c(Cl)c1 ZINC000850394524 1123261928 /nfs/dbraw/zinc/26/19/28/1123261928.db2.gz VMNQOIVCYYSYDI-LBPRGKRZSA-N 1 0 289.753 3.735 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C2CCC3(CC3(F)F)CC2)c1 ZINC000850391003 1123262170 /nfs/dbraw/zinc/26/21/70/1123262170.db2.gz AOUNCCRKJJPWQT-UHFFFAOYSA-N 1 0 281.346 3.758 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H]2COC(C)(C)C2)c1O ZINC000850482596 1123273111 /nfs/dbraw/zinc/27/31/11/1123273111.db2.gz PZWRACBAHWLHEM-ZYHUDNBSSA-N 1 0 283.799 3.572 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H]2COC(C)(C)C2)c1O ZINC000850482594 1123273271 /nfs/dbraw/zinc/27/32/71/1123273271.db2.gz PZWRACBAHWLHEM-PWSUYJOCSA-N 1 0 283.799 3.572 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCN1C(C)(C)C)c1ccc(C)cc1O ZINC000850483548 1123274275 /nfs/dbraw/zinc/27/42/75/1123274275.db2.gz ZTXFDMOUZGJNTM-HOCLYGCPSA-N 1 0 290.451 3.614 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](C)c1ccccn1)c1ccc(N(C)C)cc1 ZINC000850482905 1123274619 /nfs/dbraw/zinc/27/46/19/1123274619.db2.gz SIBVLBGLDDYTEM-MAUKXSAKSA-N 1 0 297.446 3.992 20 10 CHCDRO CC[C@@H](COCC1CC1)[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000850493859 1123275237 /nfs/dbraw/zinc/27/52/37/1123275237.db2.gz LOKYKDATOSLIPR-ZFWWWQNUSA-N 1 0 277.408 3.556 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]CCC2(CSC)CC2)c1 ZINC000850507093 1123277011 /nfs/dbraw/zinc/27/70/11/1123277011.db2.gz MNSGBJKSOARXHE-LBPRGKRZSA-N 1 0 295.448 3.585 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2C=CCC2)c1O ZINC000850506966 1123277291 /nfs/dbraw/zinc/27/72/91/1123277291.db2.gz HCBSXVSUEPAWLJ-JQWIXIFHSA-N 1 0 251.757 3.723 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2cscn2)c(O)c1C ZINC000850511500 1123278301 /nfs/dbraw/zinc/27/83/01/1123278301.db2.gz GTUZBSLCDNCBRM-NWDGAFQWSA-N 1 0 276.405 3.877 20 10 CHCDRO CC[C@H]([NH2+][C@H]1COC2(CCC2)C1)c1ccc(N(C)C)cc1 ZINC000850524300 1123281320 /nfs/dbraw/zinc/28/13/20/1123281320.db2.gz GCKYPRPWEDKZEC-WBVHZDCISA-N 1 0 288.435 3.505 20 10 CHCDRO C[C@H]([NH2+]CC[C@@]1(C)CC1(F)F)c1ccc(N(C)C)cc1 ZINC000850536201 1123286682 /nfs/dbraw/zinc/28/66/82/1123286682.db2.gz IHERMYBWGKMFNN-WFASDCNBSA-N 1 0 282.378 3.839 20 10 CHCDRO CCSC1(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)CC1 ZINC000850552341 1123290202 /nfs/dbraw/zinc/29/02/02/1123290202.db2.gz MLZORWOVNDGKNC-PWSUYJOCSA-N 1 0 295.423 3.955 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2C(C)(C)C2(F)F)c(O)c1C ZINC000850553649 1123290218 /nfs/dbraw/zinc/29/02/18/1123290218.db2.gz ZXVTWRPJMSVAST-DGCLKSJQSA-N 1 0 283.362 3.951 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1nccn1C)c1cc(Cl)ccc1O ZINC000850572745 1123295514 /nfs/dbraw/zinc/29/55/14/1123295514.db2.gz OZPINMUYRXDPMP-MFKMUULPSA-N 1 0 293.798 3.581 20 10 CHCDRO COc1cccc(C[NH2+][C@@H](C)c2ccccc2O)c1C ZINC000850579183 1123296311 /nfs/dbraw/zinc/29/63/11/1123296311.db2.gz SZZKFYJISHNITC-ZDUSSCGKSA-N 1 0 271.360 3.560 20 10 CHCDRO COc1cccc(C[NH2+][C@@H](C)c2cc(F)ccc2O)c1C ZINC000850579749 1123296584 /nfs/dbraw/zinc/29/65/84/1123296584.db2.gz ZGEBADWUAODLAP-LBPRGKRZSA-N 1 0 289.350 3.699 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)CCC(C)(C)C)c(O)c1 ZINC000237244428 1123318558 /nfs/dbraw/zinc/31/85/58/1123318558.db2.gz XJRSWDORYTWZOM-LBPRGKRZSA-N 1 0 265.397 3.705 20 10 CHCDRO C[N@H+](Cc1ccc(Cl)s1)Cc1ccccc1O ZINC000109772632 1123326749 /nfs/dbraw/zinc/32/67/49/1123326749.db2.gz NLCDVRYXAOQRKX-UHFFFAOYSA-N 1 0 267.781 3.739 20 10 CHCDRO CC[C@@H](C[NH2+][C@@H](C)c1cc(OC)ccc1O)CC(F)F ZINC000851900116 1123387851 /nfs/dbraw/zinc/38/78/51/1123387851.db2.gz PIQBJLYXZYCOLF-WDEREUQCSA-N 1 0 287.350 3.733 20 10 CHCDRO CC(C)n1cc([C@H](C)[NH2+][C@H](C)c2ccccc2O)cn1 ZINC000783511468 1123407190 /nfs/dbraw/zinc/40/71/90/1123407190.db2.gz ZPCQXKSGOXYMSD-QWHCGFSZSA-N 1 0 273.380 3.581 20 10 CHCDRO C[N@H+](CC1=CCSC1)Cc1c(O)ccc2ccccc21 ZINC000853618428 1123445107 /nfs/dbraw/zinc/44/51/07/1123445107.db2.gz DKROUQMEVMLJDN-UHFFFAOYSA-N 1 0 285.412 3.650 20 10 CHCDRO COc1ccc(C2CC2)cc1C[NH2+]Cc1c(C)cccc1O ZINC000895536557 1123489035 /nfs/dbraw/zinc/48/90/35/1123489035.db2.gz KXVMMIDMMGDZAX-UHFFFAOYSA-N 1 0 297.398 3.876 20 10 CHCDRO C[C@@H]([NH2+]C1(c2ccc(F)cc2)CC1)c1ccccc1O ZINC000783524554 1123489258 /nfs/dbraw/zinc/48/92/58/1123489258.db2.gz OUFAVTLIXIZHSY-GFCCVEGCSA-N 1 0 271.335 3.871 20 10 CHCDRO CCc1cnccc1[C@@H](C)[NH2+][C@H](C)c1ccccc1O ZINC000783526221 1123493472 /nfs/dbraw/zinc/49/34/72/1123493472.db2.gz UQKDSLNOPYZTCO-CHWSQXEVSA-N 1 0 270.376 3.761 20 10 CHCDRO Oc1c(C[NH2+]C[C@@H]2CCC3(CCC3)O2)ccc2ccccc21 ZINC000895676888 1123503149 /nfs/dbraw/zinc/50/31/49/1123503149.db2.gz DMPZSBZVNCLWMW-INIZCTEOSA-N 1 0 297.398 3.737 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C[C@@H]2C[C@H]2c2ccccc2)c1 ZINC000113341233 1123521936 /nfs/dbraw/zinc/52/19/36/1123521936.db2.gz PJBMICLWAHVKGR-RDJZCZTQSA-N 1 0 267.372 3.594 20 10 CHCDRO [O-]c1c(Cl)cccc1C[NH2+][C@H]1CCc2c1cccc2F ZINC000895855352 1123522233 /nfs/dbraw/zinc/52/22/33/1123522233.db2.gz QNYNOVHFTIWSBD-HNNXBMFYSA-N 1 0 291.753 3.962 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H](C)C2(C)CC2)cc1 ZINC000776882972 1123558667 /nfs/dbraw/zinc/55/86/67/1123558667.db2.gz LJBILOKLEJJSST-UONOGXRCSA-N 1 0 260.425 3.982 20 10 CHCDRO CCC[N@H+](Cc1cncc(Cl)c1)Cc1ccccc1O ZINC000856726887 1123565538 /nfs/dbraw/zinc/56/55/38/1123565538.db2.gz FRLJUFFPJNJLMK-UHFFFAOYSA-N 1 0 290.794 3.853 20 10 CHCDRO CCCc1ccc(C[NH2+]Cc2cc(OC)ccc2O)s1 ZINC000856770849 1123567664 /nfs/dbraw/zinc/56/76/64/1123567664.db2.gz OYUARWOOEJYHAU-UHFFFAOYSA-N 1 0 291.416 3.705 20 10 CHCDRO CCc1cccc(C[NH2+]Cc2nccc3c2CCCC3)c1O ZINC000896281451 1123568710 /nfs/dbraw/zinc/56/87/10/1123568710.db2.gz QBKOOSLAPJFQFL-UHFFFAOYSA-N 1 0 296.414 3.518 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CC[C@H]2CC2(F)F)c(O)c1 ZINC000857081919 1123586110 /nfs/dbraw/zinc/58/61/10/1123586110.db2.gz RKWDCHRBOIBUKJ-NEPJUHHUSA-N 1 0 269.335 3.705 20 10 CHCDRO COc1ccc(C[NH2+][C@H]2CCO[C@H](CC(C)C)C2)cc1C ZINC000776949107 1123608898 /nfs/dbraw/zinc/60/88/98/1123608898.db2.gz JYPGFKAZWSTAHR-DLBZAZTESA-N 1 0 291.435 3.687 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1ccc(F)cc1F ZINC000115629397 1123619980 /nfs/dbraw/zinc/61/99/80/1123619980.db2.gz XAMDOWZXSHRDNC-UHFFFAOYSA-N 1 0 290.357 3.629 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1ccc2cc[nH]c2c1 ZINC000858139167 1123634181 /nfs/dbraw/zinc/63/41/81/1123634181.db2.gz PVNQOFVFULHKPP-UHFFFAOYSA-N 1 0 293.414 3.832 20 10 CHCDRO CCc1cccc(F)c1C[NH2+]Cc1cc(C)ccc1O ZINC000858239876 1123639092 /nfs/dbraw/zinc/63/90/92/1123639092.db2.gz VMMAEIMOUFIOIH-UHFFFAOYSA-N 1 0 273.351 3.692 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2cnc(C(C)C)s2)c1 ZINC000858236976 1123639408 /nfs/dbraw/zinc/63/94/08/1123639408.db2.gz CCMGBLRHHVZDFZ-UHFFFAOYSA-N 1 0 276.405 3.570 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)ccc1O)c1ccns1 ZINC000858577895 1123664633 /nfs/dbraw/zinc/66/46/33/1123664633.db2.gz SEIHRKBYSSUFOR-DTWKUNHWSA-N 1 0 282.796 3.914 20 10 CHCDRO CCOc1cccc(C[NH2+]C[C@@H]2CCCC(F)(F)C2)c1O ZINC000281924015 1123750483 /nfs/dbraw/zinc/75/04/83/1123750483.db2.gz GZPPYZBMCMXGOS-GFCCVEGCSA-N 1 0 299.361 3.706 20 10 CHCDRO Cc1c[nH]c(C[N@H+](Cc2ccccc2O)C2CCCCC2)n1 ZINC000862212975 1123792801 /nfs/dbraw/zinc/79/28/01/1123792801.db2.gz ZFODLSIRNXOGDI-UHFFFAOYSA-N 1 0 299.418 3.759 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H]2CCC(F)(F)C2)cc1 ZINC000777240907 1123796589 /nfs/dbraw/zinc/79/65/89/1123796589.db2.gz FERBNARPYRHRIH-TZMCWYRMSA-N 1 0 282.378 3.981 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCC(F)(F)C1)c1ccc(N(C)C)cc1 ZINC000777243733 1123797427 /nfs/dbraw/zinc/79/74/27/1123797427.db2.gz XWXUVJQSIKJDKK-ZFWWWQNUSA-N 1 0 282.378 3.981 20 10 CHCDRO CC[C@@H]([NH2+]C1CCC(OC)CC1)c1ccc(C)cc1O ZINC000840791703 1123806509 /nfs/dbraw/zinc/80/65/09/1123806509.db2.gz BZEJBECBMCVXAH-ZBCRRDGASA-N 1 0 277.408 3.699 20 10 CHCDRO COC1CCC([NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)CC1 ZINC000840792429 1123809110 /nfs/dbraw/zinc/80/91/10/1123809110.db2.gz LFOPTAPQHXQZPU-XGNXJENSSA-N 1 0 297.826 3.962 20 10 CHCDRO CCc1cccc(C[NH2+][C@@H]2CCCc3cccnc32)c1O ZINC000897070863 1123809742 /nfs/dbraw/zinc/80/97/42/1123809742.db2.gz PAXQNSYRCVEMMH-MRXNPFEDSA-N 1 0 282.387 3.517 20 10 CHCDRO CC[C@@H]1OCC[C@H]1[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000840822401 1123827513 /nfs/dbraw/zinc/82/75/13/1123827513.db2.gz UKAXRZNVARJEBJ-JLZZUVOBSA-N 1 0 285.387 3.764 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCC[C@@H]2C[C@@H]21)c1ccc(C)cc1O ZINC000840819128 1123827952 /nfs/dbraw/zinc/82/79/52/1123827952.db2.gz FDJPVAWDBGYCRH-SYAUCNOPSA-N 1 0 259.393 3.930 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)CS1 ZINC000840860658 1123860868 /nfs/dbraw/zinc/86/08/68/1123860868.db2.gz VIIDBWXKGOGSER-MIZYBKAJSA-N 1 0 281.396 3.563 20 10 CHCDRO CO[C@@](C)([C@@H](C)[NH2+][C@@H](C)c1cc(C)ccc1O)C1CC1 ZINC000840859981 1123861441 /nfs/dbraw/zinc/86/14/41/1123861441.db2.gz RAKRLUGBLSIOSL-AHIWAGSCSA-N 1 0 277.408 3.555 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@H]2C[C@H](C)O[C@@H]2C)c1O ZINC000840872996 1123870264 /nfs/dbraw/zinc/87/02/64/1123870264.db2.gz OTNKXXFAVLSNPF-RVMXOQNASA-N 1 0 297.826 3.818 20 10 CHCDRO CC[C@H]([NH2+]CC(C)(C)OCC1CC1)c1ccc(C)cc1O ZINC000840876497 1123900476 /nfs/dbraw/zinc/90/04/76/1123900476.db2.gz NOANBCBFNNPEPT-INIZCTEOSA-N 1 0 291.435 3.947 20 10 CHCDRO CC(C)(C)c1cc(O)c(O)c(C[NH+]2CCC(F)(F)CC2)c1 ZINC000794685526 1123927764 /nfs/dbraw/zinc/92/77/64/1123927764.db2.gz JDHANKQADALDSH-UHFFFAOYSA-N 1 0 299.361 3.626 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccccc1OC)c1ccc(C)cc1O ZINC000794796937 1123949920 /nfs/dbraw/zinc/94/99/20/1123949920.db2.gz WBLFWSHTOQTVBK-KRWDZBQOSA-N 1 0 299.414 3.993 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccco1)c1ccc(C)cc1O ZINC000794794315 1123951368 /nfs/dbraw/zinc/95/13/68/1123951368.db2.gz LOIZWCOAKZDNMU-HNNXBMFYSA-N 1 0 259.349 3.577 20 10 CHCDRO CC[C@@H]([NH2+]CCN1CCCC[C@@H]1C)c1ccc(C)cc1O ZINC000794794548 1123951741 /nfs/dbraw/zinc/95/17/41/1123951741.db2.gz FCBMHVSCCRMIHL-DOTOQJQBSA-N 1 0 290.451 3.616 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)CCSC)c1ccc(C)cc1O ZINC000794803729 1123952883 /nfs/dbraw/zinc/95/28/83/1123952883.db2.gz SOMGHMNDNNJYJS-TZMCWYRMSA-N 1 0 267.438 3.883 20 10 CHCDRO CC[C@H]([NH2+]CCOC1CCCC1)c1ccc(C)cc1O ZINC000794807289 1123954088 /nfs/dbraw/zinc/95/40/88/1123954088.db2.gz XMAVQVFHSFSCSK-INIZCTEOSA-N 1 0 277.408 3.701 20 10 CHCDRO C[C@@H]1CC2(CCC2)C[N@@H+]1Cc1c(O)cccc1Cl ZINC000763646850 1129155577 /nfs/dbraw/zinc/15/55/77/1129155577.db2.gz KVQUSRQEDAUHMV-LLVKDONJSA-N 1 0 265.784 3.810 20 10 CHCDRO CC[C@@H]([NH2+]CCNc1cccc(C)n1)c1ccc(C)cc1O ZINC000794813001 1123957500 /nfs/dbraw/zinc/95/75/00/1123957500.db2.gz AKSJBWQMTHOTMA-MRXNPFEDSA-N 1 0 299.418 3.557 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](O)c1cccc(C)c1)c1ccc(C)cc1O ZINC000794817033 1123959547 /nfs/dbraw/zinc/95/95/47/1123959547.db2.gz OHRLIJIPGMQYFX-PKOBYXMFSA-N 1 0 299.414 3.783 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1CCC(C)(C)O1)c1ccc(C)cc1O ZINC000794818973 1123960428 /nfs/dbraw/zinc/96/04/28/1123960428.db2.gz ZWSOTYIGKUXIIK-UKRRQHHQSA-N 1 0 277.408 3.699 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCC(C)(C)O1)c1ccc(C)cc1O ZINC000794818974 1123960855 /nfs/dbraw/zinc/96/08/55/1123960855.db2.gz ZWSOTYIGKUXIIK-ZFWWWQNUSA-N 1 0 277.408 3.699 20 10 CHCDRO COC1(C[NH2+][C@@H](C)c2cc(F)ccc2O)CCC(C)CC1 ZINC000794836545 1123971854 /nfs/dbraw/zinc/97/18/54/1123971854.db2.gz UAHNAWPDOACYFL-JZLYGMAVSA-N 1 0 295.398 3.777 20 10 CHCDRO COC1([C@H](C)[NH2+][C@H](C)c2ccc(C)c(C)c2O)CCC1 ZINC000840884663 1123994769 /nfs/dbraw/zinc/99/47/69/1123994769.db2.gz ONEABDYFJSHKQR-KGLIPLIRSA-N 1 0 277.408 3.617 20 10 CHCDRO CCC(CC)(C[NH2+]Cc1ccccc1O)C(F)(F)F ZINC000865757206 1124011941 /nfs/dbraw/zinc/01/19/41/1124011941.db2.gz MRAUSWCJKZEABU-UHFFFAOYSA-N 1 0 275.314 3.851 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H]2CC=CC[C@H]2C(F)(F)F)cc1C ZINC000865831871 1124018977 /nfs/dbraw/zinc/01/89/77/1124018977.db2.gz BBHSHHKTQNCSTO-ZIAGYGMSSA-N 1 0 299.336 3.996 20 10 CHCDRO COCC1(C)CC[NH+](Cc2c(O)cc(C)cc2Cl)CC1 ZINC000840935855 1124030176 /nfs/dbraw/zinc/03/01/76/1124030176.db2.gz AUPXHHBKQWWTNB-UHFFFAOYSA-N 1 0 297.826 3.603 20 10 CHCDRO Cc1ccoc1C[N@@H+](C)Cc1ccc(N(C)C)cc1C ZINC000840950493 1124035839 /nfs/dbraw/zinc/03/58/39/1124035839.db2.gz OEVVZCRMPYKNQG-UHFFFAOYSA-N 1 0 272.392 3.594 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccc(C)o2)cc1 ZINC000866478551 1124069853 /nfs/dbraw/zinc/06/98/53/1124069853.db2.gz JOWIAIXWKNDEHC-CQSZACIVSA-N 1 0 272.392 3.895 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)c1ccc2ccccc2c1O)c1ccnn1C ZINC000866614999 1124089658 /nfs/dbraw/zinc/08/96/58/1124089658.db2.gz RYWUIUFYHIWDFW-CHWSQXEVSA-N 1 0 295.386 3.691 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)c1ccc2ccccc2c1O)c1ccnn1C ZINC000866615002 1124089733 /nfs/dbraw/zinc/08/97/33/1124089733.db2.gz RYWUIUFYHIWDFW-STQMWFEESA-N 1 0 295.386 3.691 20 10 CHCDRO C[C@H]([NH2+]C1([C@H]2CCCCO2)CCC1)c1cc(F)ccc1O ZINC000866622539 1124091510 /nfs/dbraw/zinc/09/15/10/1124091510.db2.gz GEWGYLKUBMUYKH-BLLLJJGKSA-N 1 0 293.382 3.674 20 10 CHCDRO c1csc(SCCC[NH2+]C[C@@H]2CC=CCC2)n1 ZINC000123363558 1124589593 /nfs/dbraw/zinc/58/95/93/1124589593.db2.gz QJDJLITUALOKAG-GFCCVEGCSA-N 1 0 268.451 3.571 20 10 CHCDRO C/C(Cl)=C/C[N@@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000528419749 1124658487 /nfs/dbraw/zinc/65/84/87/1124658487.db2.gz PGNBAEAHRIIZQO-JEMSNHSXSA-N 1 0 295.810 3.516 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1ccc(C)cc1O)[C@@H](O)c1ccccc1 ZINC000872133304 1124692512 /nfs/dbraw/zinc/69/25/12/1124692512.db2.gz PGJZOZJANRPQFF-FNHZYXHNSA-N 1 0 299.414 3.863 20 10 CHCDRO CCCOc1ccc(C[NH2+]Cc2ccoc2)cc1C ZINC000873020145 1124734362 /nfs/dbraw/zinc/73/43/62/1124734362.db2.gz GZNLLIZDSNPERQ-UHFFFAOYSA-N 1 0 259.349 3.667 20 10 CHCDRO CC1([NH2+]Cc2ccc(N3CCCCC3)cc2)CC(F)(F)C1 ZINC000873198213 1124751364 /nfs/dbraw/zinc/75/13/64/1124751364.db2.gz YRUQSYWGOKDBRR-UHFFFAOYSA-N 1 0 294.389 3.954 20 10 CHCDRO CCCCCC[NH2+][C@@H](C)c1cc(OC)ccc1O ZINC000020143619 1124808410 /nfs/dbraw/zinc/80/84/10/1124808410.db2.gz PGVLRWSRBMQCSN-LBPRGKRZSA-N 1 0 251.370 3.632 20 10 CHCDRO CCCCCC[NH2+][C@H](C)c1cc(OC)ccc1O ZINC000020143621 1124809033 /nfs/dbraw/zinc/80/90/33/1124809033.db2.gz PGVLRWSRBMQCSN-GFCCVEGCSA-N 1 0 251.370 3.632 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@H]1CCCSCC1 ZINC000825710640 1124813787 /nfs/dbraw/zinc/81/37/87/1124813787.db2.gz WDYHNAZJPDNEMN-HNNXBMFYSA-N 1 0 278.465 3.647 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCc2cccc(F)c2C1)c1ccccc1O ZINC001170956513 1131313635 /nfs/dbraw/zinc/31/36/35/1131313635.db2.gz XEZQHNPLHODIAC-OCCSQVGLSA-N 1 0 285.362 3.739 20 10 CHCDRO CCC(CC)[C@@H](C[NH2+][C@@H](C)c1ccc(C)cc1O)N(C)C ZINC000021521144 1124932670 /nfs/dbraw/zinc/93/26/70/1124932670.db2.gz XHCKRADYTMRTNU-WMLDXEAASA-N 1 0 292.467 3.718 20 10 CHCDRO Oc1ccccc1C[N@H+](CCC[C@@H]1CCO1)C1CCCC1 ZINC000876720759 1124972494 /nfs/dbraw/zinc/97/24/94/1124972494.db2.gz CGIBWYGSSRZMQX-QGZVFWFLSA-N 1 0 289.419 3.706 20 10 CHCDRO CCOc1ccc([C@@H](C)[NH2+]Cc2ccc(C)cc2O)cc1 ZINC000876908089 1124989897 /nfs/dbraw/zinc/98/98/97/1124989897.db2.gz ZGAJFDIGPMTPPP-CQSZACIVSA-N 1 0 285.387 3.950 20 10 CHCDRO CC(=O)Nc1cccc([C@@H](C)[NH2+]Cc2ccc(C)cc2O)c1 ZINC000876911903 1124989921 /nfs/dbraw/zinc/98/99/21/1124989921.db2.gz AGRKMPXJSHSJOZ-CYBMUJFWSA-N 1 0 298.386 3.510 20 10 CHCDRO CCCOc1ccc(C[NH2+]Cc2ccc(C)cc2O)cc1 ZINC000876941146 1124991300 /nfs/dbraw/zinc/99/13/00/1124991300.db2.gz IOSFKYWXKRSFFO-UHFFFAOYSA-N 1 0 285.387 3.779 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2c(C)cccc2O)c(C)c1 ZINC000876943106 1124991705 /nfs/dbraw/zinc/99/17/05/1124991705.db2.gz BXYIFAOGGUGVKK-UHFFFAOYSA-N 1 0 255.361 3.607 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2ccccc2OC2CCC2)c(O)c1 ZINC000877035415 1124999596 /nfs/dbraw/zinc/99/95/96/1124999596.db2.gz HBOWADJPWKICJN-UHFFFAOYSA-N 1 0 297.398 3.922 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]C[C@H]1CCCO[C@@H]1C(C)(C)C ZINC000877038840 1125001345 /nfs/dbraw/zinc/00/13/45/1125001345.db2.gz ZGROBPVXOFXJOQ-PBHICJAKSA-N 1 0 291.435 3.632 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H](C)c1cnc(C)nc1C ZINC000877478304 1125033280 /nfs/dbraw/zinc/03/32/80/1125033280.db2.gz NDCSWZHQWMQXML-AWEZNQCLSA-N 1 0 298.434 3.530 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]C[C@H]1CC[C@H](c2ccccc2)O1 ZINC000877537987 1125040040 /nfs/dbraw/zinc/04/00/40/1125040040.db2.gz RXLXVWOPBWUCHE-VQIMIIECSA-N 1 0 297.398 3.711 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H](C)[C@@H]1CC1(F)F ZINC000877592651 1125049879 /nfs/dbraw/zinc/04/98/79/1125049879.db2.gz RIZDJRARIHCSNT-ZENOOKHLSA-N 1 0 296.405 3.625 20 10 CHCDRO CSC1CC[NH+](C/C=C\c2ccc(N(C)C)cc2)CC1 ZINC000877663185 1125060400 /nfs/dbraw/zinc/06/04/00/1125060400.db2.gz JYXXXQCMTGRDFR-PLNGDYQASA-N 1 0 290.476 3.593 20 10 CHCDRO CCc1cccc(C[NH2+][C@@H](C)c2cnc(C)s2)c1O ZINC000877685267 1125063481 /nfs/dbraw/zinc/06/34/81/1125063481.db2.gz SENPZNYFNHATHX-JTQLQIEISA-N 1 0 276.405 3.570 20 10 CHCDRO Cc1cc(C[N@@H+]2Cc3cccc(O)c3C2)c(C)s1 ZINC000877703159 1125066354 /nfs/dbraw/zinc/06/63/54/1125066354.db2.gz UCKRQSLSLVUBEY-UHFFFAOYSA-N 1 0 259.374 3.586 20 10 CHCDRO C[C@@H]([NH2+]Cc1ncc(C(C)(C)C)s1)c1ccccc1O ZINC000877755541 1125072523 /nfs/dbraw/zinc/07/25/23/1125072523.db2.gz DNBPNQWNKTWJRR-LLVKDONJSA-N 1 0 290.432 3.997 20 10 CHCDRO CCO[P@](C)(=O)CC[C@H](C)[NH2+][C@H](C)c1ccccc1O ZINC000877755921 1125073321 /nfs/dbraw/zinc/07/33/21/1125073321.db2.gz SVSVRXSGVQCLMY-RDXCRGQUSA-N 1 0 299.351 3.766 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H](C)c2ccccc2O)c(Cl)c1 ZINC000877758311 1125074439 /nfs/dbraw/zinc/07/44/39/1125074439.db2.gz SFXHYJWMCGGSIK-NSHDSACASA-N 1 0 291.778 3.910 20 10 CHCDRO COc1cccc(C)c1C[NH2+][C@@H](C)c1ccccc1O ZINC000877758094 1125074549 /nfs/dbraw/zinc/07/45/49/1125074549.db2.gz INSIUQSANBNDHY-ZDUSSCGKSA-N 1 0 271.360 3.560 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1O)C1CCSCC1 ZINC000877758151 1125075654 /nfs/dbraw/zinc/07/56/54/1125075654.db2.gz KWPAHUYBZNFWQH-NEPJUHHUSA-N 1 0 265.422 3.575 20 10 CHCDRO Cc1cc(C)c(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)c(C)n1 ZINC000878455354 1125155239 /nfs/dbraw/zinc/15/52/39/1125155239.db2.gz XAKHQKIHDCFVGT-HNNXBMFYSA-N 1 0 297.446 3.924 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CC[C@H](c2ccccc2)O1)c1ccccc1O ZINC000879650145 1125222463 /nfs/dbraw/zinc/22/24/63/1125222463.db2.gz LQAOJSDYFQZANJ-SIXWZSSISA-N 1 0 297.398 3.963 20 10 CHCDRO COc1cncc(/C=C\CC[NH2+][C@@H](C)c2ccccc2O)c1 ZINC000879649758 1125223069 /nfs/dbraw/zinc/22/30/69/1125223069.db2.gz GBZMMWAWEBULFB-VSKVDJIOSA-N 1 0 298.386 3.550 20 10 CHCDRO COCC1CCC([NH2+]Cc2cc(Cl)c(C)cc2O)CC1 ZINC000826121399 1125228251 /nfs/dbraw/zinc/22/82/51/1125228251.db2.gz POODNWNQSRJWFK-UHFFFAOYSA-N 1 0 297.826 3.649 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CCC[C@@H](C)[C@@H]2C)cc1C ZINC000035052351 1125234472 /nfs/dbraw/zinc/23/44/72/1125234472.db2.gz VBMMRQLUASPYOH-IVMMDQJWSA-N 1 0 261.409 3.918 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2C[C@@H](C)CC[C@@H]2C)c1O ZINC000228667678 1125250970 /nfs/dbraw/zinc/25/09/70/1125250970.db2.gz DBHQOHCKZFQTJF-QWRGUYRKSA-N 1 0 283.799 3.675 20 10 CHCDRO CC(C)[C@H]1CCC[N@@H+]1Cc1c(O)cccc1Cl ZINC000211658934 1125314963 /nfs/dbraw/zinc/31/49/63/1125314963.db2.gz QNONFJSMKQDRCY-CYBMUJFWSA-N 1 0 253.773 3.666 20 10 CHCDRO CC[C@H](C)[NH2+][C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000130081898 1125356209 /nfs/dbraw/zinc/35/62/09/1125356209.db2.gz NVJUVSPSEQLDGU-QWHCGFSZSA-N 1 0 298.377 3.645 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CC(C)(C)CC(F)F)cc1C ZINC000883252191 1125385110 /nfs/dbraw/zinc/38/51/10/1125385110.db2.gz WREARDOEYHZEAW-UHFFFAOYSA-N 1 0 271.351 3.780 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H]2CCc3cccc(O)c32)c(Cl)n1 ZINC000883301488 1125391988 /nfs/dbraw/zinc/39/19/88/1125391988.db2.gz BCRBFGOSYYHDCE-CYBMUJFWSA-N 1 0 288.778 3.526 20 10 CHCDRO COc1ccc(C[NH2+]Cc2ccc(C)nc2Cl)cc1C ZINC000883291918 1125392283 /nfs/dbraw/zinc/39/22/83/1125392283.db2.gz XLKKTPFRAKZIEU-UHFFFAOYSA-N 1 0 290.794 3.650 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCC[C@]12CCCO2)c1ccc(N(C)C)cc1 ZINC000883364469 1125402027 /nfs/dbraw/zinc/40/20/27/1125402027.db2.gz GZXZDVWPRCWMBB-QGTPRVQTSA-N 1 0 288.435 3.505 20 10 CHCDRO C[C@H]([NH2+]C1CCC2(COC2)CC1)c1cc(Cl)ccc1O ZINC000883382048 1125406982 /nfs/dbraw/zinc/40/69/82/1125406982.db2.gz YUCSYQLPFQTVAR-NSHDSACASA-N 1 0 295.810 3.655 20 10 CHCDRO C[C@@H](N[C@@H](C)c1cccc(C(F)(F)F)c1O)C(F)F ZINC000883400746 1125409161 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C[C@H]([NH2+][C@@H]1CC[C@@H](C)CC1)c1cc(F)ccc1O ZINC000252814283 1129597812 /nfs/dbraw/zinc/59/78/12/1129597812.db2.gz SUQZTVGAAMNWOX-GVXVVHGQSA-N 1 0 251.345 3.761 20 10 CHCDRO CC(C)O[C@@H]1C[C@@H]([NH2+][C@@H](C)c2ccccc2O)C1(C)C ZINC000766331754 1129604720 /nfs/dbraw/zinc/60/47/20/1129604720.db2.gz UKWXERANPLTFBU-APHBMKBZSA-N 1 0 277.408 3.635 20 10 CHCDRO CCO[C@@H](CC[NH2+]Cc1c(O)cccc1Cl)C(C)C ZINC000746053443 1129624419 /nfs/dbraw/zinc/62/44/19/1129624419.db2.gz PXZFMSFMTFCCDW-HNNXBMFYSA-N 1 0 285.815 3.586 20 10 CHCDRO CCCN(CC)CC[NH2+][C@H](C)c1ccc(N(C)CC)cc1 ZINC000766402858 1129662990 /nfs/dbraw/zinc/66/29/90/1129662990.db2.gz YSXFBJMOHQMIRI-MRXNPFEDSA-N 1 0 291.483 3.525 20 10 CHCDRO C[C@H]([NH2+]C[C@]1(C)CC1(Cl)Cl)c1ccccc1O ZINC000828655693 1131395154 /nfs/dbraw/zinc/39/51/54/1131395154.db2.gz GJTYXPGTSYWAQQ-CABZTGNLSA-N 1 0 274.191 3.627 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](O)[C@@H](C)c1ccccc1)c1ccccc1O ZINC000828687177 1131395684 /nfs/dbraw/zinc/39/56/84/1131395684.db2.gz GCAQSEAIYRPXCC-FNHZYXHNSA-N 1 0 299.414 3.598 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](O)[C@H](C)c1ccccc1)c1ccccc1O ZINC000828687176 1131395733 /nfs/dbraw/zinc/39/57/33/1131395733.db2.gz GCAQSEAIYRPXCC-DKSSEZFCSA-N 1 0 299.414 3.598 20 10 CHCDRO CC/C=C/CC[N@@H+]1CCCN(c2ccc(OC)cc2)CC1 ZINC000767307146 1129784516 /nfs/dbraw/zinc/78/45/16/1129784516.db2.gz VYBJULBJPGIGJS-SNAWJCMRSA-N 1 0 288.435 3.564 20 10 CHCDRO CCCOc1ccc(C[N@H+](C)Cc2ccccc2O)cc1 ZINC000767425679 1129793614 /nfs/dbraw/zinc/79/36/14/1129793614.db2.gz LWBVPEFAVNKZLM-UHFFFAOYSA-N 1 0 285.387 3.813 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CCC2CC2)cc1F ZINC000742383067 1129817651 /nfs/dbraw/zinc/81/76/51/1129817651.db2.gz SHLNGQIFVNRCCF-UHFFFAOYSA-N 1 0 264.388 3.562 20 10 CHCDRO C[C@@H]1[C@@H](C)CC[N@@H+]1Cc1c(O)ccc2ccccc21 ZINC000380743042 1129832471 /nfs/dbraw/zinc/83/24/71/1129832471.db2.gz ULFUALDIZOPRGY-QWHCGFSZSA-N 1 0 255.361 3.776 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](C)Cc2ccccc2C)c1 ZINC000768159408 1129836392 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C[C@H]([NH2+]Cc1ccccc1O)[C@@H]1CC2CCC1CC2 ZINC000381987304 1129853539 /nfs/dbraw/zinc/85/35/39/1129853539.db2.gz XBLKXEAFJJSWKV-USPMSXPRSA-N 1 0 259.393 3.697 20 10 CHCDRO CC(C)[N@H+](Cc1cc2c(cc1O)CCCC2)C1CC1 ZINC000768440017 1129855953 /nfs/dbraw/zinc/85/59/53/1129855953.db2.gz CDHGDOSAGUXGML-UHFFFAOYSA-N 1 0 259.393 3.644 20 10 CHCDRO COc1cc(C[N@H+](C)Cc2cccc(C)c2)c(O)cc1C ZINC000768440893 1129856055 /nfs/dbraw/zinc/85/60/55/1129856055.db2.gz AMYQXRWTOWUFFY-UHFFFAOYSA-N 1 0 285.387 3.650 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)COC(C)C)cc1F ZINC000800234979 1129856450 /nfs/dbraw/zinc/85/64/50/1129856450.db2.gz GVBXBWJRHHTLHA-AWEZNQCLSA-N 1 0 296.430 3.575 20 10 CHCDRO COc1cc(C[N@H+](C)CCCc2ccccc2)c(O)cc1C ZINC000768440101 1129856551 /nfs/dbraw/zinc/85/65/51/1129856551.db2.gz SEZMYTCGNJMOHY-UHFFFAOYSA-N 1 0 299.414 3.774 20 10 CHCDRO COc1cccc(O)c1C[N@H+](C)[C@@H](C)c1cccs1 ZINC000768417317 1129858164 /nfs/dbraw/zinc/85/81/64/1129858164.db2.gz MWBHRLACPRAUDI-NSHDSACASA-N 1 0 277.389 3.655 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CC2CCC(F)(F)CC2)cc1C ZINC000800293811 1129864724 /nfs/dbraw/zinc/86/47/24/1129864724.db2.gz LVCNKLZHZBYPEM-UHFFFAOYSA-N 1 0 283.362 3.924 20 10 CHCDRO COCC1(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)CCC1 ZINC000800492778 1129880615 /nfs/dbraw/zinc/88/06/15/1129880615.db2.gz OQSPZGRECYAQRO-NSHDSACASA-N 1 0 283.799 3.513 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCOc3ccccc3[C@@H]2C)cc1C ZINC000768931934 1129882724 /nfs/dbraw/zinc/88/27/24/1129882724.db2.gz WRJIQKGHFSQCIY-HNNXBMFYSA-N 1 0 297.398 3.965 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCC[C@H]2c2ccc(O)cc2)c1 ZINC000769106800 1129891544 /nfs/dbraw/zinc/89/15/44/1129891544.db2.gz ODZHSDNZVZDGJS-KRWDZBQOSA-N 1 0 283.371 3.743 20 10 CHCDRO CCC[N@@H+](Cc1ccccc1O)C[C@@H]1CC=CCC1 ZINC000769201099 1129896292 /nfs/dbraw/zinc/89/62/92/1129896292.db2.gz QQTIZYHKEXXJLJ-OAHLLOKOSA-N 1 0 259.393 3.961 20 10 CHCDRO FCCC[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc2c(c1)CCO2 ZINC000800969099 1129900711 /nfs/dbraw/zinc/90/07/11/1129900711.db2.gz HACXFFULLMNLIN-HOCLYGCPSA-N 1 0 277.383 3.630 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H](O)c2cc(C)cc(C)c2)c1 ZINC000800992885 1129902750 /nfs/dbraw/zinc/90/27/50/1129902750.db2.gz UUUAMNOHZURSEE-HNAYVOBHSA-N 1 0 299.414 3.702 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCc3ccccc3OC2)c(O)c1 ZINC000800986222 1129903015 /nfs/dbraw/zinc/90/30/15/1129903015.db2.gz CBIDWXXGRVLDHA-ZBFHGGJFSA-N 1 0 297.398 3.745 20 10 CHCDRO CCC[N@@H+](Cc1cc(Cl)ccc1O)C[C@H]1CCCCO1 ZINC000769339530 1129903914 /nfs/dbraw/zinc/90/39/14/1129903914.db2.gz RDBWBKXKZBPKIS-OAHLLOKOSA-N 1 0 297.826 3.827 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CC[C@@H](c2ccco2)C1 ZINC000769388796 1129905446 /nfs/dbraw/zinc/90/54/46/1129905446.db2.gz HUJCVRZQUFLFMU-LLVKDONJSA-N 1 0 277.751 3.628 20 10 CHCDRO CC[N@@H+](Cc1ccc(N2CCCCC2)cc1)CC1CC1 ZINC000769403581 1129906942 /nfs/dbraw/zinc/90/69/42/1129906942.db2.gz DOYYPVHIZKVKPS-UHFFFAOYSA-N 1 0 272.436 3.909 20 10 CHCDRO C[C@H]1CSCC[N@@H+]1Cc1cc(-c2ccccc2)ccc1O ZINC000769428277 1129907970 /nfs/dbraw/zinc/90/79/70/1129907970.db2.gz PNOFHKFNPMALDG-AWEZNQCLSA-N 1 0 299.439 3.997 20 10 CHCDRO CC[C@H](Cc1ccccc1)[N@H+](C)Cc1cccc(OC)c1O ZINC000769487073 1129909530 /nfs/dbraw/zinc/90/95/30/1129909530.db2.gz HELYITFFVDCLHM-QGZVFWFLSA-N 1 0 299.414 3.854 20 10 CHCDRO COc1cccc(O)c1C[N@@H+]1CCC2(C1)CCCCC2 ZINC000769486542 1129909681 /nfs/dbraw/zinc/90/96/81/1129909681.db2.gz BTLWCNMPROICTI-UHFFFAOYSA-N 1 0 275.392 3.557 20 10 CHCDRO COc1cccc(O)c1C[N@@H+]1C[C@@H](c2ccccc2)C[C@@H]1C ZINC000769445517 1129910176 /nfs/dbraw/zinc/91/01/76/1129910176.db2.gz JZAOPGGSILOFLB-HOCLYGCPSA-N 1 0 297.398 3.779 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCS[C@H]3CCCC[C@H]32)cc1 ZINC000769497908 1129913913 /nfs/dbraw/zinc/91/39/13/1129913913.db2.gz HKFRSBXKSDUNBY-SJORKVTESA-N 1 0 290.476 3.613 20 10 CHCDRO CC(C)[C@H]1C[N@H+](Cc2cc(Cl)ccc2O)CCS1 ZINC000769547220 1129917124 /nfs/dbraw/zinc/91/71/24/1129917124.db2.gz BPLANXWSTXNJHE-CQSZACIVSA-N 1 0 285.840 3.619 20 10 CHCDRO CCOc1ccc(C[N@H+](C)[C@@H](C)CCSCC)c(O)c1 ZINC000769548548 1129917372 /nfs/dbraw/zinc/91/73/72/1129917372.db2.gz HTBRDBQSCQIGHL-ZDUSSCGKSA-N 1 0 297.464 3.754 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1CCC2(CCCC2)O1)c1ccccc1O ZINC000801527375 1129924285 /nfs/dbraw/zinc/92/42/85/1129924285.db2.gz AFYHNNHDZZRAMS-GOEBONIOSA-N 1 0 289.419 3.925 20 10 CHCDRO CCc1ccccc1CC[NH2+][C@H](C)c1cc(OC)ccc1O ZINC000769785970 1129924957 /nfs/dbraw/zinc/92/49/57/1129924957.db2.gz HVJUXVZJEIQAHV-CQSZACIVSA-N 1 0 299.414 3.857 20 10 CHCDRO CCSc1cccc(C[NH2+]Cc2ccccc2O)c1 ZINC000769912051 1129929420 /nfs/dbraw/zinc/92/94/20/1129929420.db2.gz SIQIHXWTMYMXFF-UHFFFAOYSA-N 1 0 273.401 3.794 20 10 CHCDRO CCCC[N@H+](Cc1ccccc1O)Cc1cnccc1C ZINC000801595293 1129931410 /nfs/dbraw/zinc/93/14/10/1129931410.db2.gz KYFRFEIAZQLHST-UHFFFAOYSA-N 1 0 284.403 3.898 20 10 CHCDRO Oc1ccccc1C[N@H+](CCc1ccc(F)cc1)C1CC1 ZINC000770510082 1129948004 /nfs/dbraw/zinc/94/80/04/1129948004.db2.gz ITPLTLBLMHOAHF-UHFFFAOYSA-N 1 0 285.362 3.738 20 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/nfs/dbraw/zinc/02/77/46/1130027746.db2.gz ZNDFHPPFOADCAL-UHFFFAOYSA-N 1 0 279.424 3.667 20 10 CHCDRO C[C@H](C1CCCCC1)[N@H+](C)Cc1cc2c(cc1O)OCO2 ZINC000802659023 1130028029 /nfs/dbraw/zinc/02/80/29/1130028029.db2.gz MIDOSQAOPOCTQN-GFCCVEGCSA-N 1 0 291.391 3.522 20 10 CHCDRO COc1ccc(O)c(C[NH2+]CC2CC(c3ccccc3)C2)c1 ZINC000802659535 1130028429 /nfs/dbraw/zinc/02/84/29/1130028429.db2.gz JDSATHMDXACFLC-UHFFFAOYSA-N 1 0 297.398 3.684 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+][C@@H]2CCCC(C)(C)C2)c1 ZINC000785548532 1130038922 /nfs/dbraw/zinc/03/89/22/1130038922.db2.gz MQXROKQFHNYVPU-CQSZACIVSA-N 1 0 277.408 3.849 20 10 CHCDRO C[C@H](CC1CCCCC1)[NH2+]Cc1cc2c(cc1O)OCO2 ZINC000785544226 1130039458 /nfs/dbraw/zinc/03/94/58/1130039458.db2.gz JVQZHMGTBTUEBO-GFCCVEGCSA-N 1 0 291.391 3.569 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)[C@@H](C)OC)c1cc(Cl)ccc1O ZINC000786576310 1130108247 /nfs/dbraw/zinc/10/82/47/1130108247.db2.gz SPHMAHKYWDHOEG-OPQQBVKSSA-N 1 0 271.788 3.510 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)C[C@@H]2CCSC2)cc1 ZINC000787063216 1130130452 /nfs/dbraw/zinc/13/04/52/1130130452.db2.gz AJCGNJKFCJKSPC-INIZCTEOSA-N 1 0 292.492 3.718 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@H]2CCCC3(CC3)C2)c1O ZINC000903279635 1130144424 /nfs/dbraw/zinc/14/44/24/1130144424.db2.gz OFJUEKZNEREKLW-OLZOCXBDSA-N 1 0 275.392 3.774 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H]2CCCC3(CC3)C2)c1O ZINC000903279637 1130144484 /nfs/dbraw/zinc/14/44/84/1130144484.db2.gz OFJUEKZNEREKLW-STQMWFEESA-N 1 0 275.392 3.774 20 10 CHCDRO C[C@H]([NH2+]C1CC2(C1)CO[C@@H](C)C2)c1cc(Cl)ccc1O ZINC000903281278 1130144766 /nfs/dbraw/zinc/14/47/66/1130144766.db2.gz GJORIWNVYHIFFW-BSROQFBASA-N 1 0 295.810 3.654 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCSC(C)(C)C1)c1ccccc1O ZINC000903285403 1130146428 /nfs/dbraw/zinc/14/64/28/1130146428.db2.gz ZILPDGBUEHMVCV-NWDGAFQWSA-N 1 0 265.422 3.717 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2cncs2)c1 ZINC000903312761 1130151534 /nfs/dbraw/zinc/15/15/34/1130151534.db2.gz YOBWFOSZOPBKEN-MNOVXSKESA-N 1 0 262.378 3.569 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1cncs1)c1ccc(C)cc1O ZINC000903312724 1130151838 /nfs/dbraw/zinc/15/18/38/1130151838.db2.gz XXROKCJCXJDKMK-WCQYABFASA-N 1 0 276.405 3.959 20 10 CHCDRO COC(C)(C)[C@@H](C)[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000903329672 1130157287 /nfs/dbraw/zinc/15/72/87/1130157287.db2.gz CPTUIMZLLHAOGY-VHSXEESVSA-N 1 0 271.788 3.510 20 10 CHCDRO C[C@H]([NH2+][C@H](c1ccccn1)C1CC1)c1cc(F)ccc1O ZINC000903335407 1130160293 /nfs/dbraw/zinc/16/02/93/1130160293.db2.gz OTKCLGUPCIYOIV-GTNSWQLSSA-N 1 0 286.350 3.728 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CCCOCC(C)C)c(O)c1 ZINC000788507981 1130192127 /nfs/dbraw/zinc/19/21/27/1130192127.db2.gz SXCQGZGHPOFCGR-OAHLLOKOSA-N 1 0 279.424 3.722 20 10 CHCDRO COc1ccccc1CC[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000788507351 1130192208 /nfs/dbraw/zinc/19/22/08/1130192208.db2.gz ZZCCMZSDCDVJDB-OAHLLOKOSA-N 1 0 299.414 3.911 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CCSC(C)(C)CC2)c1 ZINC000789763613 1130275840 /nfs/dbraw/zinc/27/58/40/1130275840.db2.gz MWAFKOIPNDJEKI-UHFFFAOYSA-N 1 0 295.448 3.508 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@@H](C)c2ccccn2)cc1Cl ZINC000826803165 1130283463 /nfs/dbraw/zinc/28/34/63/1130283463.db2.gz MXZFTTSKOPSJNV-GFCCVEGCSA-N 1 0 290.794 3.642 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+]C[C@H](C)c2ccccn2)c1O ZINC000826803613 1130283563 /nfs/dbraw/zinc/28/35/63/1130283563.db2.gz PHYIMDFTFCICCA-LBPRGKRZSA-N 1 0 290.794 3.642 20 10 CHCDRO COCC[N@H+](Cc1cc(C)c(C)cc1O)[C@H]1CC[C@@H](C)C1 ZINC000790475513 1130315963 /nfs/dbraw/zinc/31/59/63/1130315963.db2.gz AQSRXNKESWAGQX-DYVFJYSZSA-N 1 0 291.435 3.646 20 10 CHCDRO CCC[C@H](C)[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756340662 1130418528 /nfs/dbraw/zinc/41/85/28/1130418528.db2.gz KNUPHUBPIWGSQF-JFGNBEQYSA-N 1 0 251.345 3.858 20 10 CHCDRO Cc1cccc(C[NH2+]C[C@@H]2CCC3(CCCCC3)O2)c1O ZINC000792193173 1130438312 /nfs/dbraw/zinc/43/83/12/1130438312.db2.gz TWBBWUQSGGBMFC-INIZCTEOSA-N 1 0 289.419 3.672 20 10 CHCDRO CC(C)[C@@H]1CC[C@@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000796697116 1130447275 /nfs/dbraw/zinc/44/72/75/1130447275.db2.gz WKYNIRNZAYNADT-ROUUACIJSA-N 1 0 272.436 3.811 20 10 CHCDRO COc1ccc([C@@H](C)[C@@H](C)[NH2+]Cc2ccccc2O)cc1 ZINC000747100307 1130517295 /nfs/dbraw/zinc/51/72/95/1130517295.db2.gz VOLYREUNBJAAIZ-UONOGXRCSA-N 1 0 285.387 3.683 20 10 CHCDRO C[C@@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1cc(Cl)ccc1O ZINC000793230935 1130532888 /nfs/dbraw/zinc/53/28/88/1130532888.db2.gz IVFFFVKFNKBJFA-LDYMZIIASA-N 1 0 293.716 3.818 20 10 CHCDRO CCC[C@@H]([NH2+]Cc1cccc(C)c1O)[C@@H](O)c1ccccc1 ZINC000793237938 1130534407 /nfs/dbraw/zinc/53/44/07/1130534407.db2.gz HFIGVNGLPBENJM-MJGOQNOKSA-N 1 0 299.414 3.693 20 10 CHCDRO CCC[C@H]([NH2+]Cc1cc(C)ccc1O)[C@@H](O)c1ccccc1 ZINC000793245512 1130535826 /nfs/dbraw/zinc/53/58/26/1130535826.db2.gz YBZPLFWXNFNTPD-HKUYNNGSSA-N 1 0 299.414 3.693 20 10 CHCDRO C[N@H+](Cc1ccc(C(C)(C)C)[nH]1)Cc1ccccc1O ZINC001137377671 1130539522 /nfs/dbraw/zinc/53/95/22/1130539522.db2.gz FRKYGVYLTGHGRD-UHFFFAOYSA-N 1 0 272.392 3.650 20 10 CHCDRO COc1cccc(O)c1C[N@@H+]1CCC[C@@H](C(C)(C)C)C1 ZINC000793371784 1130547302 /nfs/dbraw/zinc/54/73/02/1130547302.db2.gz YQPXOZXIWXXMPA-CYBMUJFWSA-N 1 0 277.408 3.659 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)CCc2cccc(C)c2)c(O)c1 ZINC000793387499 1130551411 /nfs/dbraw/zinc/55/14/11/1130551411.db2.gz FQPKPSVNEIJFJE-OAHLLOKOSA-N 1 0 299.414 3.820 20 10 CHCDRO CCCC[C@H](C)[N@H+](C)Cc1cc(OCC)ccc1O ZINC000811521054 1130615625 /nfs/dbraw/zinc/61/56/25/1130615625.db2.gz YDSQUJMFYVNZKD-ZDUSSCGKSA-N 1 0 265.397 3.801 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2c(O)cccc2Cl)CCC1(F)F ZINC000811511542 1130618524 /nfs/dbraw/zinc/61/85/24/1130618524.db2.gz MNBJWCIBSQMTBG-SECBINFHSA-N 1 0 275.726 3.523 20 10 CHCDRO Cc1cccc(C[NH+]2CCC(C)(C3CC3)CC2)c1O ZINC000811514463 1130619060 /nfs/dbraw/zinc/61/90/60/1130619060.db2.gz LFQRXVNTMWKQKZ-UHFFFAOYSA-N 1 0 259.393 3.713 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CC3(CCC3)[C@H]2C2CC2)c(O)c1 ZINC000811514011 1130619626 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ZINC000812795002 1130718414 /nfs/dbraw/zinc/71/84/14/1130718414.db2.gz TXTFBYFJPRCZOX-UHFFFAOYSA-N 1 0 265.397 3.659 20 10 CHCDRO COc1ccc2c(c1)C[C@@H](C)[N@@H+](Cc1ccccc1O)[C@@H]2C ZINC000781925940 1130748867 /nfs/dbraw/zinc/74/88/67/1130748867.db2.gz CJTVZJDFYBRCEK-ZIAGYGMSSA-N 1 0 297.398 3.909 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)CSC(C)(C)C)c1 ZINC000813330912 1130760165 /nfs/dbraw/zinc/76/01/65/1130760165.db2.gz IYEBCFUWPRURAO-RYUDHWBXSA-N 1 0 297.464 3.972 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]C[C@@H](C)Cc2ccccc2)c1 ZINC000813330615 1130760275 /nfs/dbraw/zinc/76/02/75/1130760275.db2.gz BAXZZHBDXORZKR-LSDHHAIUSA-N 1 0 299.414 3.930 20 10 CHCDRO Nc1ccc(C[N@@H+]2CCC[C@@H](c3ccccc3)C2)cc1 ZINC001235667422 1130764772 /nfs/dbraw/zinc/76/47/72/1130764772.db2.gz YHNHJLLNMSWBEL-QGZVFWFLSA-N 1 0 266.388 3.648 20 10 CHCDRO CC(C)(C)c1ccc(C[N@@H+]2CC[C@](C)(F)[C@@H](F)C2)c(O)c1 ZINC001235673846 1130765982 /nfs/dbraw/zinc/76/59/82/1130765982.db2.gz AJIOQVFEGCBEHZ-RDJZCZTQSA-N 1 0 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CC[C@@H]([NH2+]CCC1(OC)CCC1)c1ccc(N(C)C)cc1 ZINC000815641920 1131015081 /nfs/dbraw/zinc/01/50/81/1131015081.db2.gz LVEIEXQWXKOUFL-QGZVFWFLSA-N 1 0 290.451 3.753 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](CO)C1CCCCC1)c1ccccc1O ZINC000815648118 1131016351 /nfs/dbraw/zinc/01/63/51/1131016351.db2.gz FDCQXESLDYQXHA-NVXWUHKLSA-N 1 0 291.435 3.622 20 10 CHCDRO COC(C)(C)[C@H]1CCC[N@@H+]1Cc1cc2ccccc2cc1O ZINC001236830903 1131016713 /nfs/dbraw/zinc/01/67/13/1131016713.db2.gz DLGKYEWAUUXMRU-GOSISDBHSA-N 1 0 299.414 3.935 20 10 CHCDRO CC(C)C1([NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)CC1 ZINC000815647600 1131017165 /nfs/dbraw/zinc/01/71/65/1131017165.db2.gz PGUDZWBDTYDRFV-JQWIXIFHSA-N 1 0 263.356 3.858 20 10 CHCDRO Oc1cc2ccccc2cc1C[NH+]1CC2(CCC2)C1 ZINC001236826707 1131017293 /nfs/dbraw/zinc/01/72/93/1131017293.db2.gz LXOGFYDPRCCIKU-UHFFFAOYSA-N 1 0 253.345 3.531 20 10 CHCDRO Oc1cc2ccccc2cc1C[NH+]1CC2(C1)CCCC2 ZINC001236827201 1131017617 /nfs/dbraw/zinc/01/76/17/1131017617.db2.gz RARNUWNKKOOQNE-UHFFFAOYSA-N 1 0 267.372 3.921 20 10 CHCDRO Oc1cc2ccccc2cc1C[NH+]1CCC2(CCCO2)CC1 ZINC001236832629 1131019908 /nfs/dbraw/zinc/01/99/08/1131019908.db2.gz JIWZGEFNJUYLAY-UHFFFAOYSA-N 1 0 297.398 3.690 20 10 CHCDRO COCCC1CC[NH+](Cc2cc3ccccc3cc2O)CC1 ZINC001236840031 1131020239 /nfs/dbraw/zinc/02/02/39/1131020239.db2.gz HGZUKKLWZDIQQF-UHFFFAOYSA-N 1 0 299.414 3.794 20 10 CHCDRO CC[C@H]([NH3+])CN(C)Cc1cc(Cl)c(C(C)(C)C)cc1O ZINC001236884139 1131027123 /nfs/dbraw/zinc/02/71/23/1131027123.db2.gz MQZQMZSMYWOPFI-LBPRGKRZSA-N 1 0 298.858 3.512 20 10 CHCDRO COC1(C)CC[NH+](Cc2ccc(C(C)C)cc2O)CC1 ZINC001237044356 1131038808 /nfs/dbraw/zinc/03/88/08/1131038808.db2.gz CDLNVIURQUKIPN-UHFFFAOYSA-N 1 0 277.408 3.517 20 10 CHCDRO CCOCc1cc(C[NH2+]C[C@H]2CCC[C@@H]2C)ccc1OC ZINC000798503886 1131040032 /nfs/dbraw/zinc/04/00/32/1131040032.db2.gz UZVLXQOWBAGTSM-GOEBONIOSA-N 1 0 291.435 3.758 20 10 CHCDRO CCOCc1cc(C[NH2+]C[C@@H]2CCC[C@@H]2C)ccc1OC ZINC000798503888 1131040499 /nfs/dbraw/zinc/04/04/99/1131040499.db2.gz UZVLXQOWBAGTSM-HOCLYGCPSA-N 1 0 291.435 3.758 20 10 CHCDRO CC(C)c1ccc(C[N@@H+]2CCCC[C@H](F)C2)c(O)c1 ZINC001237045001 1131041834 /nfs/dbraw/zinc/04/18/34/1131041834.db2.gz GZIPMQKDAIMAPE-HNNXBMFYSA-N 1 0 265.372 3.840 20 10 CHCDRO CC(C)c1ccc(C[N@@H+]2CCn3cccc3[C@H]2C)c(O)c1 ZINC001237049507 1131041906 /nfs/dbraw/zinc/04/19/06/1131041906.db2.gz QHNSHZYEWZQBJE-CQSZACIVSA-N 1 0 284.403 3.894 20 10 CHCDRO CC1(F)CC[NH+](Cc2cc(C(F)(F)F)ccc2O)CC1 ZINC001237137938 1131054498 /nfs/dbraw/zinc/05/44/98/1131054498.db2.gz SIPKTLXPGOSHNX-UHFFFAOYSA-N 1 0 291.288 3.735 20 10 CHCDRO C[N@H+](Cc1cc(C(F)(F)F)ccc1O)C1CCCC1 ZINC001237139800 1131057946 /nfs/dbraw/zinc/05/79/46/1131057946.db2.gz OYPFPDYRQOFSJR-UHFFFAOYSA-N 1 0 273.298 3.785 20 10 CHCDRO C[N@@H+](Cc1cc(C(F)(F)F)ccc1O)CC1CCC1 ZINC001237140106 1131059095 /nfs/dbraw/zinc/05/90/95/1131059095.db2.gz UYKZFBZUIVJFCE-UHFFFAOYSA-N 1 0 273.298 3.643 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](CO)CC1CCCC1)c1ccccc1O ZINC000798938299 1131062624 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ZINC000816550222 1131106972 /nfs/dbraw/zinc/10/69/72/1131106972.db2.gz LOMFMCCSAPTWHS-KRWDZBQOSA-N 1 0 298.430 3.509 20 10 CHCDRO Oc1c(C[NH2+]C[C@@H]2Cc3ccccc32)ccc2ccccc21 ZINC000816548778 1131107020 /nfs/dbraw/zinc/10/70/20/1131107020.db2.gz SBFLMLAYWLIHJQ-KRWDZBQOSA-N 1 0 289.378 3.975 20 10 CHCDRO CC(C)c1cc(C[NH2+]Cc2ccc3ccccc3c2O)on1 ZINC000816549654 1131107478 /nfs/dbraw/zinc/10/74/78/1131107478.db2.gz VAOPAWPZHNSVDV-UHFFFAOYSA-N 1 0 296.370 3.947 20 10 CHCDRO OCCC1(C[NH2+]Cc2ccc3ccccc3c2O)CCCC1 ZINC000816553900 1131110230 /nfs/dbraw/zinc/11/02/30/1131110230.db2.gz JPNIREPAANJZKK-UHFFFAOYSA-N 1 0 299.414 3.578 20 10 CHCDRO Oc1c(C[NH2+][C@@H]2CCOC3(CCC3)C2)ccc2ccccc21 ZINC000816556263 1131110382 /nfs/dbraw/zinc/11/03/82/1131110382.db2.gz DUJNCKJSIRYNGJ-MRXNPFEDSA-N 1 0 297.398 3.737 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CC(C)(C)[C@H]2C(C)C)c1 ZINC000816624648 1131112526 /nfs/dbraw/zinc/11/25/26/1131112526.db2.gz BYRGKXNISTZLRZ-MRXNPFEDSA-N 1 0 277.408 3.657 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CCC[C@H](c3ccccc3)C2)c1 ZINC000816619566 1131115886 /nfs/dbraw/zinc/11/58/86/1131115886.db2.gz MKTCYSHNHIMOQU-INIZCTEOSA-N 1 0 297.398 3.780 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2ccc(N(C)C)cc2C(F)(F)F)[C@H]1C ZINC000816647951 1131120412 /nfs/dbraw/zinc/12/04/12/1131120412.db2.gz BEFTYIXJOBLPFP-MNOVXSKESA-N 1 0 286.341 3.612 20 10 CHCDRO CC1C[NH+](Cc2cc(-c3ccc(F)cc3)ccc2O)C1 ZINC001237641651 1131123242 /nfs/dbraw/zinc/12/32/42/1131123242.db2.gz UXHSTOFYWXYOHY-UHFFFAOYSA-N 1 0 271.335 3.650 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2CC[C@@](C)(CF)C2)c1O ZINC001237682077 1131126196 /nfs/dbraw/zinc/12/61/96/1131126196.db2.gz XIZYAZCLNPDMNR-AWEZNQCLSA-N 1 0 271.763 3.536 20 10 CHCDRO COc1cc(C[NH+](CC(C)C)CC(C)C)c(O)c(OC)c1 ZINC001237674456 1131126999 /nfs/dbraw/zinc/12/69/99/1131126999.db2.gz ILNCFMYJBLMHFD-UHFFFAOYSA-N 1 0 295.423 3.523 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H](C(F)(F)F)C2)c1O ZINC001237685484 1131127146 /nfs/dbraw/zinc/12/71/46/1131127146.db2.gz DAYLICVPQPWCBO-SNVBAGLBSA-N 1 0 293.716 3.738 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+]2C[C@@H](C)CC23CC3)c1O ZINC001237689756 1131128729 /nfs/dbraw/zinc/12/87/29/1131128729.db2.gz PNIGVETUTKZOBB-JTQLQIEISA-N 1 0 265.784 3.728 20 10 CHCDRO C[C@H]1C[N@H+](Cc2cc(F)cc(Cl)c2[O-])C2(CC2)C1 ZINC001237807218 1131143221 /nfs/dbraw/zinc/14/32/21/1131143221.db2.gz ZICLBXMEPGYRPJ-SECBINFHSA-N 1 0 269.747 3.559 20 10 CHCDRO CCOc1ccc(C[NH2+][C@H](C)c2cc(C)oc2C)c(O)c1 ZINC001116487243 1131149767 /nfs/dbraw/zinc/14/97/67/1131149767.db2.gz CSVJEOJYEKXHRS-GFCCVEGCSA-N 1 0 289.375 3.852 20 10 CHCDRO Cc1cc(F)cc(C[NH+]2CCC(C(F)(F)F)CC2)c1O ZINC001238061031 1131167038 /nfs/dbraw/zinc/16/70/38/1131167038.db2.gz KEFCTNSQBALJOA-UHFFFAOYSA-N 1 0 291.288 3.614 20 10 CHCDRO Cc1cc(F)cc(CN(C)Cc2ccc(F)cc2F)c1O ZINC001238065846 1131167170 /nfs/dbraw/zinc/16/71/70/1131167170.db2.gz BUVDBYWWSYLTCS-UHFFFAOYSA-N 1 0 295.304 3.750 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cc(O)ccc1C ZINC001238108650 1131172607 /nfs/dbraw/zinc/17/26/07/1131172607.db2.gz DEIHRKSHSTUZMN-UHFFFAOYSA-N 1 0 298.430 3.789 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc(C)nc(C)c1)c1ccc(F)cc1[O-] ZINC000817588725 1131174177 /nfs/dbraw/zinc/17/41/77/1131174177.db2.gz JHPLKQPPDWRHTE-MRXNPFEDSA-N 1 0 288.366 3.784 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CC23CCSCC3)c(O)c1 ZINC000817589583 1131175294 /nfs/dbraw/zinc/17/52/94/1131175294.db2.gz OQAKKOIVPSPAOI-KBPBESRZSA-N 1 0 291.460 3.885 20 10 CHCDRO CC(C)[C@H]([NH2+]CCc1ccc(N)cc1)c1ccccc1 ZINC000817955502 1131190339 /nfs/dbraw/zinc/19/03/39/1131190339.db2.gz CKRVDGMQMFCJJD-SFHVURJKSA-N 1 0 268.404 3.798 20 10 CHCDRO Nc1ccc(CC[NH2+][C@H]2CC[C@H](c3ccccc3)C2)cc1 ZINC000817958768 1131191230 /nfs/dbraw/zinc/19/12/30/1131191230.db2.gz YDCGOZYLOCROPV-HKUYNNGSSA-N 1 0 280.415 3.737 20 10 CHCDRO Cc1cccc2c1[C@@H](C)C[C@H]2[NH2+]CCc1ccc(N)cc1 ZINC000817958169 1131191277 /nfs/dbraw/zinc/19/12/77/1131191277.db2.gz SQRNGPVLPYJPCX-KBXCAEBGSA-N 1 0 280.415 3.958 20 10 CHCDRO Oc1c(C[NH2+]C/C=C\C2CC2)ccc2ccccc21 ZINC001117722383 1131194010 /nfs/dbraw/zinc/19/40/10/1131194010.db2.gz VATQOOUHPCZUBD-ARJAWSKDSA-N 1 0 253.345 3.601 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H](CN)C2CCCC2)c1O ZINC000817981432 1131195026 /nfs/dbraw/zinc/19/50/26/1131195026.db2.gz JHMWOXYRISLVQX-NHYWBVRUSA-N 1 0 296.842 3.522 20 10 CHCDRO Cc1cc(N)cc(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)c1 ZINC000817980024 1131195094 /nfs/dbraw/zinc/19/50/94/1131195094.db2.gz HRTXTNFXDBPBMN-AWEZNQCLSA-N 1 0 284.403 3.750 20 10 CHCDRO CCC[C@H](C)C[NH2+]C[C@@H]1CCN(c2ccc(OC)cc2)C1 ZINC000818221059 1131205186 /nfs/dbraw/zinc/20/51/86/1131205186.db2.gz KVZDKGMHQCVOAB-HOTGVXAUSA-N 1 0 290.451 3.547 20 10 CHCDRO COc1ccc(N2CC[C@@H](C[NH2+]CCCC(C)C)C2)cc1 ZINC000818222860 1131205760 /nfs/dbraw/zinc/20/57/60/1131205760.db2.gz XJUHOOCOYDBPHN-INIZCTEOSA-N 1 0 290.451 3.547 20 10 CHCDRO CCC[C@H](C)C[NH2+]C[C@H]1CCN(c2ccc(OC)cc2)C1 ZINC000818221063 1131205856 /nfs/dbraw/zinc/20/58/56/1131205856.db2.gz KVZDKGMHQCVOAB-JKSUJKDBSA-N 1 0 290.451 3.547 20 10 CHCDRO CC[C@H](C)[C@H](C)[NH2+]C[C@H]1CCN(c2ccc(OC)cc2)C1 ZINC000818344616 1131209897 /nfs/dbraw/zinc/20/98/97/1131209897.db2.gz OYNAXAZSLUXKRO-HRCADAONSA-N 1 0 290.451 3.546 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1C[C@H]1C1CCC1)c1ccc(N(C)C)cc1 ZINC000818355882 1131210284 /nfs/dbraw/zinc/21/02/84/1131210284.db2.gz KRRHKDCAJJFZAJ-OAUYIBNBSA-N 1 0 258.409 3.592 20 10 CHCDRO Cc1cc(Br)cc([C@H](C)[NH2+][C@@H]2CC23CC3)c1O ZINC000818355369 1131210294 /nfs/dbraw/zinc/21/02/94/1131210294.db2.gz DORZBRTWZYHRAG-JOYOIKCWSA-N 1 0 296.208 3.666 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H]2C[C@H]3C[C@H]3C2)c1O ZINC000818360194 1131211864 /nfs/dbraw/zinc/21/18/64/1131211864.db2.gz OBEPEEFRTUQLJW-HNCHTBHHSA-N 1 0 265.784 3.803 20 10 CHCDRO C[C@H]([NH2+][C@@H]1C[C@H]2C[C@H]2C1)c1cc2c(cc1O)CCCC2 ZINC000818361111 1131211914 /nfs/dbraw/zinc/21/19/14/1131211914.db2.gz ULXKKERULBWWNI-KSYCFECVSA-N 1 0 271.404 3.720 20 10 CHCDRO Cc1cc(C[NH+]2CC3(CSC3)C2)c(C)n1-c1ccccc1 ZINC001137859454 1131425022 /nfs/dbraw/zinc/42/50/22/1131425022.db2.gz ZRYFTSHYBUZKRC-UHFFFAOYSA-N 1 0 298.455 3.643 20 10 CHCDRO C[C@@H](CF)[NH2+]Cc1ccc(N(C)Cc2cccs2)cc1 ZINC000824432739 1131468166 /nfs/dbraw/zinc/46/81/66/1131468166.db2.gz APDIUDLXYDZHEG-ZDUSSCGKSA-N 1 0 292.423 3.832 20 10 CHCDRO Fc1cccc2c1CCC[C@@H]2[NH2+]Cc1ccc2c(c1)CCO2 ZINC000824468199 1131471513 /nfs/dbraw/zinc/47/15/13/1131471513.db2.gz FZEWRULTVASGJR-SFHVURJKSA-N 1 0 297.373 3.928 20 10 CHCDRO CCOc1ccc(C[NH2+]C2(CC)CCCC2)c(O)c1 ZINC000824651020 1131478187 /nfs/dbraw/zinc/47/81/87/1131478187.db2.gz SKORGRKXKOGHGC-UHFFFAOYSA-N 1 0 263.381 3.603 20 10 CHCDRO Cc1ccc(O)c(C[N@H+]2CC[C@H](C(F)(F)F)C[C@H]2C)c1 ZINC000824714794 1131480945 /nfs/dbraw/zinc/48/09/45/1131480945.db2.gz GIWFOCNJRMTSAU-YPMHNXCESA-N 1 0 287.325 3.863 20 10 CHCDRO Cc1c(C[N@H+](C)CC(C)(C)C)c2ccccc2n1C ZINC001138256791 1131483145 /nfs/dbraw/zinc/48/31/45/1131483145.db2.gz KYCUVRRFQGXFJD-UHFFFAOYSA-N 1 0 258.409 3.965 20 10 CHCDRO COC1CCC([N@H+](C)Cc2cc(Cl)c(C)cc2O)CC1 ZINC000824812984 1131486203 /nfs/dbraw/zinc/48/62/03/1131486203.db2.gz AFZGKNDEQYYFBX-UHFFFAOYSA-N 1 0 297.826 3.743 20 10 CHCDRO CN1CCCc2cc(C[N@@H+]3CC[C@H]4CCC[C@@H]4C3)ccc21 ZINC001138355358 1131493780 /nfs/dbraw/zinc/49/37/80/1131493780.db2.gz OVESZQKVIPWFQF-SJLPKXTDSA-N 1 0 284.447 3.691 20 10 CHCDRO Oc1ccccc1C[NH+]1CC(c2cccc(Cl)c2)C1 ZINC000824988289 1131493919 /nfs/dbraw/zinc/49/39/19/1131493919.db2.gz ISIXWAVZCFJQDC-UHFFFAOYSA-N 1 0 273.763 3.645 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+]Cc2ccc3ccccc3c2O)c2nccn21 ZINC000825016895 1131494497 /nfs/dbraw/zinc/49/44/97/1131494497.db2.gz ITYNWAIGYWEBLK-WBMJQRKESA-N 1 0 293.370 3.538 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](CC)C(C)C)c(OC)c1 ZINC001138387587 1131497055 /nfs/dbraw/zinc/49/70/55/1131497055.db2.gz IJXNPEMOKJHOPD-UHFFFAOYSA-N 1 0 278.440 3.772 20 10 CHCDRO CCN(CC)c1ccc(C[NH+]2CCCCC2)c(OC)c1 ZINC001138388167 1131497405 /nfs/dbraw/zinc/49/74/05/1131497405.db2.gz RHEAHTYYUNURQY-UHFFFAOYSA-N 1 0 276.424 3.527 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCC3(CC3)C2)c(OC)c1 ZINC001138386055 1131497484 /nfs/dbraw/zinc/49/74/84/1131497484.db2.gz GAUAANOUGMEPJN-UHFFFAOYSA-N 1 0 288.435 3.527 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@H]3C[C@H]32)c(OC)c1 ZINC001138391559 1131497966 /nfs/dbraw/zinc/49/79/66/1131497966.db2.gz FYDSYSPDGFDKDS-WMLDXEAASA-N 1 0 288.435 3.526 20 10 CHCDRO COc1cccc([C@H]2C[C@H]([NH2+]Cc3cccc(C)c3O)C2)c1 ZINC000825090789 1131498793 /nfs/dbraw/zinc/49/87/93/1131498793.db2.gz HXXJQKAHEPSSPR-QAQDUYKDSA-N 1 0 297.398 3.745 20 10 CHCDRO COc1cc(C[NH2+]Cc2cc(C)ccc2O)ccc1Cl ZINC000825143069 1131499648 /nfs/dbraw/zinc/49/96/48/1131499648.db2.gz APASOZKDDVEPIX-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO Oc1ccc(Cl)cc1CNc1ccc2c([nH+]1)CCC2 ZINC000825124816 1131499859 /nfs/dbraw/zinc/49/98/59/1131499859.db2.gz YTYQSHDQRWQRJF-UHFFFAOYSA-N 1 0 274.751 3.541 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H](C)c2cccc(O)c2)cc1Cl ZINC000825246445 1131504517 /nfs/dbraw/zinc/50/45/17/1131504517.db2.gz ASKJGHXBEJCRQU-LLVKDONJSA-N 1 0 291.778 3.910 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H]2CCC(F)(F)C2)cc1Cl ZINC000825357477 1131508256 /nfs/dbraw/zinc/50/82/56/1131508256.db2.gz FXBKMSMAOVSUOZ-SNVBAGLBSA-N 1 0 275.726 3.631 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H]2CCO[C@H](C(C)C)C2)cc1Cl ZINC000825406792 1131511527 /nfs/dbraw/zinc/51/15/27/1131511527.db2.gz YZNRRCVCYWKMOB-BBRMVZONSA-N 1 0 297.826 3.647 20 10 CHCDRO CCC1(O)CCC([NH2+]Cc2cc(Cl)c(C)cc2O)CC1 ZINC000825406453 1131511539 /nfs/dbraw/zinc/51/15/39/1131511539.db2.gz SHCVMNCIFMHXNZ-UHFFFAOYSA-N 1 0 297.826 3.527 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cccc(O)c1C ZINC001144122137 1131588062 /nfs/dbraw/zinc/58/80/62/1131588062.db2.gz USSHAUBKTWKBIA-UHFFFAOYSA-N 1 0 298.430 3.789 20 10 CHCDRO Cc1cc(C)c(O)c(C[NH+]2CCC3(CC3(F)F)CC2)c1 ZINC000844726078 1131594330 /nfs/dbraw/zinc/59/43/30/1131594330.db2.gz WKWPTXKVIMOGBR-UHFFFAOYSA-N 1 0 281.346 3.630 20 10 CHCDRO Cn1c(C[N@H+](C)Cc2ccccc2O)cc2ccccc21 ZINC001139872727 1131643952 /nfs/dbraw/zinc/64/39/52/1131643952.db2.gz UZFWLRGQTRXRBI-UHFFFAOYSA-N 1 0 280.371 3.516 20 10 CHCDRO CC[N@H+](Cc1ccc(F)cc1)Cc1cc(F)ccc1O ZINC001140058737 1131660502 /nfs/dbraw/zinc/66/05/02/1131660502.db2.gz KITZANVZCGTCNU-UHFFFAOYSA-N 1 0 277.314 3.693 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCC[C@H]2c2ccccn2)c1O ZINC001140179502 1131673047 /nfs/dbraw/zinc/67/30/47/1131673047.db2.gz LEEVTNQHLDLRJD-KRWDZBQOSA-N 1 0 282.387 3.741 20 10 CHCDRO Cc1ccc(C)c(C[NH+]2C[C@@H]3CCCC[C@H]3C2)c1O ZINC001140178288 1131673117 /nfs/dbraw/zinc/67/31/17/1131673117.db2.gz HCCVGKJZBJLUGA-GJZGRUSLSA-N 1 0 259.393 3.631 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2CS[C@@H](C(C)C)C2)c1 ZINC000845972279 1131673610 /nfs/dbraw/zinc/67/36/10/1131673610.db2.gz QQWHYLLVCZGNPT-HWWQOWPSSA-N 1 0 295.448 3.582 20 10 CHCDRO Cc1cc(C[N@@H+](C)Cc2ccc(N(C)C)cc2)c(C)cc1O ZINC001140202501 1131676180 /nfs/dbraw/zinc/67/61/80/1131676180.db2.gz RLVOGTIEPBCYNP-UHFFFAOYSA-N 1 0 298.430 3.707 20 10 CHCDRO CC(C)O[C@H]1CCC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC000846014697 1131677899 /nfs/dbraw/zinc/67/78/99/1131677899.db2.gz UMAQKUARENTXCK-KRWDZBQOSA-N 1 0 299.414 3.935 20 10 CHCDRO CC[C@H]([NH2+][C@@H](COC)CC(C)(C)C)c1ccccc1O ZINC000845993346 1131679144 /nfs/dbraw/zinc/67/91/44/1131679144.db2.gz YGPOALJTIORNFW-HIFRSBDPSA-N 1 0 279.424 3.884 20 10 CHCDRO CC[N@H+](Cc1c[nH]c2cccc(O)c12)Cc1ccccc1O ZINC001140235271 1131679748 /nfs/dbraw/zinc/67/97/48/1131679748.db2.gz WQVZEVUEAAJZLX-UHFFFAOYSA-N 1 0 296.370 3.601 20 10 CHCDRO CC(C)Oc1cccc(C[NH2+][C@@H]2CCc3cccc(O)c32)c1 ZINC000834518633 1131680968 /nfs/dbraw/zinc/68/09/68/1131680968.db2.gz KYCVUJNFMCJNJN-QGZVFWFLSA-N 1 0 297.398 3.957 20 10 CHCDRO CSc1ccc(C[NH2+][C@@H]2CCc3cccc(O)c32)cc1 ZINC000834530115 1131681778 /nfs/dbraw/zinc/68/17/78/1131681778.db2.gz BXDQGMYOABMHNA-OAHLLOKOSA-N 1 0 285.412 3.891 20 10 CHCDRO COc1ccc(C[NH2+]CC[C@@]2(C)C[C@]2(F)Cl)cc1C ZINC000846039690 1131682461 /nfs/dbraw/zinc/68/24/61/1131682461.db2.gz VLBDPHCAMAAWGB-LSDHHAIUSA-N 1 0 285.790 3.798 20 10 CHCDRO CC(C)[C@@H]1C[C@@H]([NH2+]Cc2cc(Cl)ccc2O)CS1 ZINC000846054484 1131685630 /nfs/dbraw/zinc/68/56/30/1131685630.db2.gz BZEKFQFHSNGLNZ-OCCSQVGLSA-N 1 0 285.840 3.665 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]CCOC1CCCCCC1)CC2 ZINC000834595322 1131686289 /nfs/dbraw/zinc/68/62/89/1131686289.db2.gz XPZUVFLXRRPFMK-INIZCTEOSA-N 1 0 289.419 3.709 20 10 CHCDRO Oc1c(C[N@@H+]2CC[C@@]3(CC3(F)F)C2)ccc2ccccc21 ZINC000846115992 1131688618 /nfs/dbraw/zinc/68/86/18/1131688618.db2.gz CTHKDWYYYCDPQW-MRXNPFEDSA-N 1 0 289.325 3.777 20 10 CHCDRO CCC[C@H](CC)[NH2+][C@@H](C)c1cccc(OC)c1O ZINC000846149444 1131691076 /nfs/dbraw/zinc/69/10/76/1131691076.db2.gz NEEIZIUINBCMBE-RYUDHWBXSA-N 1 0 251.370 3.630 20 10 CHCDRO CCO[C@H](CC[NH2+][C@H](C)c1cccc(OC)c1O)C(C)C ZINC000846149191 1131691500 /nfs/dbraw/zinc/69/15/00/1131691500.db2.gz WXDQKIDUPITUKX-UKRRQHHQSA-N 1 0 295.423 3.503 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CC2(C3CC3)CCC2)c1O ZINC000846157952 1131692067 /nfs/dbraw/zinc/69/20/67/1131692067.db2.gz PZZQPCRCICTWBK-LBPRGKRZSA-N 1 0 275.392 3.632 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@H]2CC3CCC2CC3)c1O ZINC000846160092 1131692356 /nfs/dbraw/zinc/69/23/56/1131692356.db2.gz MROUAVXCCRWZJT-LPXQKFACSA-N 1 0 275.392 3.630 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@@H](C)CC(C)(C)C)c1O ZINC000846167803 1131692759 /nfs/dbraw/zinc/69/27/59/1131692759.db2.gz DWUCVZMSVUTYCT-NWDGAFQWSA-N 1 0 265.397 3.876 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CC2CCC(F)(F)CC2)c1O ZINC000846167430 1131692903 /nfs/dbraw/zinc/69/29/03/1131692903.db2.gz KBLMWLXCTGLUMK-LLVKDONJSA-N 1 0 299.361 3.877 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CC2=CCCCC2)c1O ZINC000846169054 1131693120 /nfs/dbraw/zinc/69/31/20/1131693120.db2.gz FLXKSDNINZHTKZ-LBPRGKRZSA-N 1 0 261.365 3.552 20 10 CHCDRO Cc1ccsc1CC[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000834696901 1131694138 /nfs/dbraw/zinc/69/41/38/1131694138.db2.gz ATLLIBXVLYTQHB-CYBMUJFWSA-N 1 0 273.401 3.582 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]C2CCCCCC2)c1O ZINC000846135479 1131694090 /nfs/dbraw/zinc/69/40/90/1131694090.db2.gz CXTXNDDIAIXOOC-GFCCVEGCSA-N 1 0 263.381 3.774 20 10 CHCDRO Cc1ccsc1CC[NH2+][C@H]1CCc2cccc(O)c21 ZINC000834696902 1131694326 /nfs/dbraw/zinc/69/43/26/1131694326.db2.gz ATLLIBXVLYTQHB-ZDUSSCGKSA-N 1 0 273.401 3.582 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H]2CCC[C@H](SC)C2)c1O ZINC000846145113 1131695188 /nfs/dbraw/zinc/69/51/88/1131695188.db2.gz MVZSQWKVKJTURR-XQQFMLRXSA-N 1 0 295.448 3.726 20 10 CHCDRO CCc1cnccc1[C@@H](C)[NH2+][C@H]1CCc2cccc(O)c21 ZINC000834698222 1131695583 /nfs/dbraw/zinc/69/55/83/1131695583.db2.gz WSQJRYYIHNFRAK-WBMJQRKESA-N 1 0 282.387 3.688 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@@H]2C[C@H]2c2ccccc2C)c1O ZINC000846188830 1131697452 /nfs/dbraw/zinc/69/74/52/1131697452.db2.gz KADKBFATNGFIEP-XOKHGSTOSA-N 1 0 297.398 3.916 20 10 CHCDRO C[C@H]([NH2+]CC[C@@]1(C)C[C@@]1(F)Cl)c1ccccc1O ZINC000846185850 1131697488 /nfs/dbraw/zinc/69/74/88/1131697488.db2.gz UDTRKNACVWEWIU-BPNCWPANSA-N 1 0 271.763 3.748 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C2CC2)C2CCOCC2)c(O)c1 ZINC000846185470 1131697678 /nfs/dbraw/zinc/69/76/78/1131697678.db2.gz AERNYZFWRFXFRN-ACJLOTCBSA-N 1 0 289.419 3.556 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2c(O)cccc2Cl)CCC1(F)F ZINC001140337956 1131702535 /nfs/dbraw/zinc/70/25/35/1131702535.db2.gz OQISEOIQKKZMPA-SNVBAGLBSA-N 1 0 289.753 3.913 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C2CC3(CCC3)C2)c(O)c1C ZINC000846211724 1131702884 /nfs/dbraw/zinc/70/28/84/1131702884.db2.gz IHPUQEFDOUEHCW-CYBMUJFWSA-N 1 0 259.393 3.992 20 10 CHCDRO COC1(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)CCCC1 ZINC000834814965 1131707678 /nfs/dbraw/zinc/70/76/78/1131707678.db2.gz RAJUXKPEDPZMJG-AWEZNQCLSA-N 1 0 277.408 3.619 20 10 CHCDRO CC(C)C[C@@H](CN1CCCC1)[NH2+][C@@H](C)c1ccccc1O ZINC000834843802 1131711889 /nfs/dbraw/zinc/71/18/89/1131711889.db2.gz MBQWWKBGWPMNGP-HOTGVXAUSA-N 1 0 290.451 3.553 20 10 CHCDRO Cc1cc(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)ccn1 ZINC000834859570 1131712880 /nfs/dbraw/zinc/71/28/80/1131712880.db2.gz DMHHRQTWROEUOU-AWEZNQCLSA-N 1 0 270.376 3.563 20 10 CHCDRO Cc1cc(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)ccn1 ZINC000834859566 1131712925 /nfs/dbraw/zinc/71/29/25/1131712925.db2.gz DJLUSZGUABJCJP-HZMBPMFUSA-N 1 0 286.350 3.573 20 10 CHCDRO CCC1([NH2+][C@H](C)c2cc(Cl)cc(C)c2O)CC1 ZINC000834874565 1131714759 /nfs/dbraw/zinc/71/47/59/1131714759.db2.gz FAIQOAVNZSHISH-SNVBAGLBSA-N 1 0 253.773 3.947 20 10 CHCDRO CC(C)[C@H]1C[C@@H](C[NH2+][C@@H](C)c2cc(F)ccc2O)CCO1 ZINC000834884621 1131717721 /nfs/dbraw/zinc/71/77/21/1131717721.db2.gz AAUOMQPHOTWHSC-GDZNZVCISA-N 1 0 295.398 3.633 20 10 CHCDRO CO[C@](C)(C[NH2+][C@@H](C)c1ccccc1O)c1ccccc1 ZINC000834885071 1131718283 /nfs/dbraw/zinc/71/82/83/1131718283.db2.gz SVWLEXSMWYOCGY-KBXCAEBGSA-N 1 0 285.387 3.605 20 10 CHCDRO CO[C@@](C)(C[NH2+][C@@H](C)c1ccc(C)cc1O)c1ccccc1 ZINC000834885017 1131718795 /nfs/dbraw/zinc/71/87/95/1131718795.db2.gz RTOFEVAQZBBSCR-KXBFYZLASA-N 1 0 299.414 3.913 20 10 CHCDRO CC(C)c1ccc(N(C)C(=O)c2ccccc2CC[NH3+])cc1 ZINC000846671411 1131719615 /nfs/dbraw/zinc/71/96/15/1131719615.db2.gz BNUOZDCEGNYIMR-UHFFFAOYSA-N 1 0 296.414 3.588 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2C[C@H](C)n3ccnc32)c(O)c1 ZINC000834892116 1131720331 /nfs/dbraw/zinc/72/03/31/1131720331.db2.gz BCFAZLBYYYYQMT-MELADBBJSA-N 1 0 285.391 3.562 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]C1(Cc3ccc(F)cc3)CC1)CC2 ZINC000834897888 1131724330 /nfs/dbraw/zinc/72/43/30/1131724330.db2.gz WSMGSRGHERWYII-INIZCTEOSA-N 1 0 297.373 3.884 20 10 CHCDRO CCCc1ncc(C[NH2+][C@@H](CC)c2ccc(C)cc2O)o1 ZINC000834900955 1131725611 /nfs/dbraw/zinc/72/56/11/1131725611.db2.gz USDWPEUOJBZHNM-HNNXBMFYSA-N 1 0 288.391 3.882 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)[C@@H](OC)C1CC1)c1ccc(C)cc1O ZINC000834901921 1131726802 /nfs/dbraw/zinc/72/68/02/1131726802.db2.gz BSFOUGOWXTXEIJ-ISTRZQFTSA-N 1 0 277.408 3.555 20 10 CHCDRO CC[C@H]([NH2+]Cc1cnc(C)cc1C)c1ccc(C)cc1O ZINC000834902104 1131726938 /nfs/dbraw/zinc/72/69/38/1131726938.db2.gz DURSLBFCLLBMMD-KRWDZBQOSA-N 1 0 284.403 3.953 20 10 CHCDRO C[C@H]([NH2+]CCC[C@@H]1CCOC1)c1cc(Cl)ccc1O ZINC000834906462 1131728729 /nfs/dbraw/zinc/72/87/29/1131728729.db2.gz WVTHKGQTZYJSEH-NWDGAFQWSA-N 1 0 283.799 3.513 20 10 CHCDRO CO[C@@H]([C@@H](C)[NH2+][C@H](C)c1cc(Cl)ccc1O)C1CC1 ZINC000834905361 1131729370 /nfs/dbraw/zinc/72/93/70/1131729370.db2.gz UDZGSNVBTNRHEK-FCHSOHFDSA-N 1 0 283.799 3.510 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@H]2CCOC(C)(C)C2)c(O)c1 ZINC000834908199 1131730216 /nfs/dbraw/zinc/73/02/16/1131730216.db2.gz BTUWYVZZPFIKEU-CABCVRRESA-N 1 0 291.435 3.865 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCOC(C)(C)C2)c(O)c1 ZINC000834909108 1131730390 /nfs/dbraw/zinc/73/03/90/1131730390.db2.gz JBPSHAPAQXDNIO-ZIAGYGMSSA-N 1 0 277.408 3.556 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1CCOC(C)(C)C1)c1ccccc1O ZINC000834911517 1131731927 /nfs/dbraw/zinc/73/19/27/1131731927.db2.gz TZZJOKHSOYTWCN-DZGCQCFKSA-N 1 0 277.408 3.638 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCOC(C)(C)C1)c1ccc(N(C)C)cc1 ZINC000834912140 1131732134 /nfs/dbraw/zinc/73/21/34/1131732134.db2.gz WHBMKKODEINOCR-HUUCEWRRSA-N 1 0 290.451 3.608 20 10 CHCDRO CCC[N@H+](Cc1c(C)nsc1C)Cc1ccccc1O ZINC000846809476 1131742515 /nfs/dbraw/zinc/74/25/15/1131742515.db2.gz PQFYXIOFZAIEPP-UHFFFAOYSA-N 1 0 290.432 3.878 20 10 CHCDRO CC[N@H+](C/C=C\c1ccc(N(C)C)cc1)C1CCC1 ZINC000835024797 1131759404 /nfs/dbraw/zinc/75/94/04/1131759404.db2.gz BTGPFUJFZBGVEJ-SREVYHEPSA-N 1 0 258.409 3.640 20 10 CHCDRO CN(C)c1ccc(/C=C/C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)cc1 ZINC000835025435 1131759452 /nfs/dbraw/zinc/75/94/52/1131759452.db2.gz VJSMIJQBRIRMEH-FHHGHWCOSA-N 1 0 295.430 3.931 20 10 CHCDRO COc1ccc(C[NH2+]C/C=C/c2ccc(N(C)C)cc2)cc1 ZINC000835033338 1131761133 /nfs/dbraw/zinc/76/11/33/1131761133.db2.gz SKJNAUPCXLQWOL-SNAWJCMRSA-N 1 0 296.414 3.564 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+][C@@H]2CCCC(F)(F)C2)cc1 ZINC000835043852 1131762320 /nfs/dbraw/zinc/76/23/20/1131762320.db2.gz UIDREHKXJJULQD-MBVDDHJVSA-N 1 0 294.389 3.933 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]C2CCC(F)(F)CC2)cc1 ZINC000835042253 1131762792 /nfs/dbraw/zinc/76/27/92/1131762792.db2.gz SHQUTJYMZLZJKA-ONEGZZNKSA-N 1 0 294.389 3.933 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]C[C@@H]2CCC(F)(F)C2)cc1 ZINC000835050907 1131765184 /nfs/dbraw/zinc/76/51/84/1131765184.db2.gz GEGOVZXKJHCUCK-ABCZVMIZSA-N 1 0 294.389 3.791 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]C[C@H]2CCC(F)(F)C2)cc1 ZINC000835050909 1131765531 /nfs/dbraw/zinc/76/55/31/1131765531.db2.gz GEGOVZXKJHCUCK-JZIMQPMSSA-N 1 0 294.389 3.791 20 10 CHCDRO CC(C)[N@H+]1[C@@H]2CC[C@H]1C[C@@H](Oc1ccc(N(C)C)cc1)C2 ZINC001227938679 1131771309 /nfs/dbraw/zinc/77/13/09/1131771309.db2.gz CICKHARORCLRCW-VQFNDLOPSA-N 1 0 288.435 3.535 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2c([O-])cc(F)cc2F)Cc2ccccc21 ZINC001140582805 1131807761 /nfs/dbraw/zinc/80/77/61/1131807761.db2.gz NDNAKBVBQIIBFX-LLVKDONJSA-N 1 0 289.325 3.790 20 10 CHCDRO CC[N@H+](CCc1ccc(OC)cc1)Cc1cc(C)ccc1O ZINC001140622889 1131831310 /nfs/dbraw/zinc/83/13/10/1131831310.db2.gz DHGPVTGRWFXRJW-UHFFFAOYSA-N 1 0 299.414 3.774 20 10 CHCDRO C[C@H](C[NH2+][C@@H](C)c1ccc(N(C)C)cc1)Oc1ccccc1 ZINC000772985521 1131836460 /nfs/dbraw/zinc/83/64/60/1131836460.db2.gz RZQIAHNQLFKERJ-CVEARBPZSA-N 1 0 298.430 3.871 20 10 CHCDRO Cc1c(O)ccc(C[NH+]2CCC3(CCCCC3)CC2)c1O ZINC001140742759 1131905594 /nfs/dbraw/zinc/90/55/94/1131905594.db2.gz XYYUYINEDGGZCC-UHFFFAOYSA-N 1 0 289.419 3.953 20 10 CHCDRO Cc1c(O)ccc(C[N@@H+]2CCC[C@H]2C2CCCCC2)c1O ZINC001140748320 1131906972 /nfs/dbraw/zinc/90/69/72/1131906972.db2.gz WCJSGIUQXVKLBJ-INIZCTEOSA-N 1 0 289.419 3.951 20 10 CHCDRO C[C@@H]([NH2+]CC1Cc2ccccc2C1)c1ccc(N(C)C)cc1 ZINC000773007966 1131917085 /nfs/dbraw/zinc/91/70/85/1131917085.db2.gz KABBNWDCZARAAU-OAHLLOKOSA-N 1 0 294.442 3.818 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cccc(F)n1)c1ccc(N(C)C)cc1 ZINC000773088198 1131941547 /nfs/dbraw/zinc/94/15/47/1131941547.db2.gz NWENEDURGDDZOY-MRXNPFEDSA-N 1 0 287.382 3.528 20 10 CHCDRO CCN(CC)c1ccc(C[NH+]2CC3(C2)CCCC3)c(O)c1 ZINC001140850376 1131945967 /nfs/dbraw/zinc/94/59/67/1131945967.db2.gz KCAQXGMDYOQLMZ-UHFFFAOYSA-N 1 0 288.435 3.614 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCCC2(C)C)c(O)c1 ZINC001140850347 1131946504 /nfs/dbraw/zinc/94/65/04/1131946504.db2.gz JEZRUPMBSQJYMR-UHFFFAOYSA-N 1 0 276.424 3.613 20 10 CHCDRO CCCCC[N@H+](C)Cc1ccc(N(CC)CC)cc1O ZINC001140851904 1131947733 /nfs/dbraw/zinc/94/77/33/1131947733.db2.gz TXTWCVHZGYGXPM-UHFFFAOYSA-N 1 0 278.440 3.860 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCCC[C@@H](C)C2)c(O)c1 ZINC001140850769 1131948087 /nfs/dbraw/zinc/94/80/87/1131948087.db2.gz TVMOFZRQPVMMCW-OAHLLOKOSA-N 1 0 290.451 3.860 20 10 CHCDRO C[C@H]1C[N@H+](Cc2ccc(N(C)C)cc2Cl)C2(CC2)C1 ZINC001140926688 1131965233 /nfs/dbraw/zinc/96/52/33/1131965233.db2.gz QIYRHHRIYKEBHK-GFCCVEGCSA-N 1 0 278.827 3.780 20 10 CHCDRO CN(C)c1ccc(C[NH+]2C3CCC2CC3)c(Cl)c1 ZINC001140925638 1131965645 /nfs/dbraw/zinc/96/56/45/1131965645.db2.gz UHAUQILGXWEBQA-UHFFFAOYSA-N 1 0 264.800 3.533 20 10 CHCDRO Oc1cc2ccccc2cc1CNc1[nH+]ccc2c1CCN2 ZINC001171399099 1131966025 /nfs/dbraw/zinc/96/60/25/1131966025.db2.gz CEDCAWOHKOVQBJ-UHFFFAOYSA-N 1 0 291.354 3.521 20 10 CHCDRO Cc1ccc(C[NH+]2CCC(Oc3ccccc3)CC2)c(O)c1 ZINC001140947831 1131969191 /nfs/dbraw/zinc/96/91/91/1131969191.db2.gz HOYBHJANOIKWLP-UHFFFAOYSA-N 1 0 297.398 3.744 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2cccc3cccnc32)c(O)c1 ZINC001140949855 1131970042 /nfs/dbraw/zinc/97/00/42/1131970042.db2.gz NNBIMRGICRMOFY-UHFFFAOYSA-N 1 0 292.382 3.881 20 10 CHCDRO CC[N@H+](Cc1ccc(C)cc1O)Cc1ccccc1F ZINC001140950954 1131971481 /nfs/dbraw/zinc/97/14/81/1131971481.db2.gz QLXXJHPUUWQORB-UHFFFAOYSA-N 1 0 273.351 3.862 20 10 CHCDRO Cc1ccc(C[N@@H+]2CC[C@@H](c3cccc(F)c3)C2)c(O)c1 ZINC001140950979 1131972438 /nfs/dbraw/zinc/97/24/38/1131972438.db2.gz RONZBACKZMTSFY-OAHLLOKOSA-N 1 0 285.362 3.829 20 10 CHCDRO [NH3+]CCc1ccccc1NCc1cc2ccccc2cc1O ZINC001171406798 1131974963 /nfs/dbraw/zinc/97/49/63/1131974963.db2.gz FWUGXJRTWNEUAE-UHFFFAOYSA-N 1 0 292.382 3.659 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H](C)Cc2ccco2)c1 ZINC000036994206 1131987553 /nfs/dbraw/zinc/98/75/53/1131987553.db2.gz ZKHAOBYBTYHTKW-CHWSQXEVSA-N 1 0 259.349 3.575 20 10 CHCDRO C[C@H]([NH2+]Cc1cc(Cl)ccc1O)c1cccc(O)c1 ZINC000037151537 1132003883 /nfs/dbraw/zinc/00/38/83/1132003883.db2.gz BDPNIRDQMIMVAU-JTQLQIEISA-N 1 0 277.751 3.602 20 10 CHCDRO C[C@@H]1CCCC[N@@H+]1Cc1cc2c3c(c1)CCCN3CCC2 ZINC001141074556 1132005327 /nfs/dbraw/zinc/00/53/27/1132005327.db2.gz LYOFXBJYXKNNHU-OAHLLOKOSA-N 1 0 284.447 3.760 20 10 CHCDRO C[C@H]1CCC[N@H+](Cc2cc3c4c(c2)CCCN4CCC3)C1 ZINC001141074602 1132005571 /nfs/dbraw/zinc/00/55/71/1132005571.db2.gz NTTWSKNANUYUTQ-HNNXBMFYSA-N 1 0 284.447 3.617 20 10 CHCDRO COCC1(C)CC[NH+](Cc2c(O)ccc3ccccc32)CC1 ZINC000773267153 1132016498 /nfs/dbraw/zinc/01/64/98/1132016498.db2.gz HPNBMACSXZTCNW-UHFFFAOYSA-N 1 0 299.414 3.794 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)[C@H]1CCc2c(F)cccc2C1 ZINC001171438579 1132018046 /nfs/dbraw/zinc/01/80/46/1132018046.db2.gz TYXZNHXIQAFLOZ-INIZCTEOSA-N 1 0 299.389 3.911 20 10 CHCDRO C[C@H]([NH2+]C1CC(OCc2ccccc2)C1)c1ccccc1O ZINC000716210940 1132022475 /nfs/dbraw/zinc/02/24/75/1132022475.db2.gz CQXWORACCANJTI-OOHWJJMZSA-N 1 0 297.398 3.791 20 10 CHCDRO C[C@H](Cc1ccco1)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000037291936 1132027780 /nfs/dbraw/zinc/02/77/80/1132027780.db2.gz FUNQDJWVAZLHRU-KGLIPLIRSA-N 1 0 272.392 3.627 20 10 CHCDRO Cc1ccc(CC[C@@H](C)[NH2+]Cc2ccc(O)cc2O)cc1 ZINC001171659424 1132070413 /nfs/dbraw/zinc/07/04/13/1132070413.db2.gz CAOFRXXUDFDTMS-CQSZACIVSA-N 1 0 285.387 3.517 20 10 CHCDRO Cc1csc(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)n1 ZINC000038090556 1132112446 /nfs/dbraw/zinc/11/24/46/1132112446.db2.gz OAFMBJHKTPYCLL-JQWIXIFHSA-N 1 0 288.416 3.804 20 10 CHCDRO FC1CC2(C1)C[NH+](Cc1ccc(N3CCCCC3)cc1)C2 ZINC000839141043 1132184820 /nfs/dbraw/zinc/18/48/20/1132184820.db2.gz XSFNTMIMHRTZCG-UHFFFAOYSA-N 1 0 288.410 3.611 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)nc1C ZINC000840783290 1132286895 /nfs/dbraw/zinc/28/68/95/1132286895.db2.gz IMLLVVWRQZFRDI-OAHLLOKOSA-N 1 0 284.403 3.872 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@@H]1C[C@H]1c1ccccc1F)CC2 ZINC000840788270 1132287749 /nfs/dbraw/zinc/28/77/49/1132287749.db2.gz XOLYWLRUCWVQNH-CWRNSKLLSA-N 1 0 283.346 3.664 20 10 CHCDRO CO[C@@](C)([C@H](C)[NH2+][C@@H](C)c1ccc(C)c(C)c1O)C1CC1 ZINC000840860566 1132295503 /nfs/dbraw/zinc/29/55/03/1132295503.db2.gz OHBRPUUEMLWHQU-DEYYWGMASA-N 1 0 291.435 3.863 20 10 CHCDRO COc1ccc(C[NH2+]Cc2c(O)cc(C)cc2Cl)cc1 ZINC000840874203 1132299485 /nfs/dbraw/zinc/29/94/85/1132299485.db2.gz XFNLWBUSMYHUKK-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO CC[C@H]([NH2+][C@@H](CC)[C@H](O)C(C)C)c1cccc(Cl)c1[O-] ZINC000840880775 1132301226 /nfs/dbraw/zinc/30/12/26/1132301226.db2.gz FACQXOBVIDULLS-SOUVJXGZSA-N 1 0 299.842 3.882 20 10 CHCDRO c1cn(C2CC2)c(NCc2ccc(N3CCCCC3)cc2)[nH+]1 ZINC000840887878 1132303956 /nfs/dbraw/zinc/30/39/56/1132303956.db2.gz YYPGYAAVIDNBQQ-UHFFFAOYSA-N 1 0 296.418 3.820 20 10 CHCDRO C[C@@H]([NH2+]CC(C)(C)c1cccnc1)c1ccc(N(C)C)cc1 ZINC000840892433 1132305232 /nfs/dbraw/zinc/30/52/32/1132305232.db2.gz SCXTXAUHPWAIHC-OAHLLOKOSA-N 1 0 297.446 3.776 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H](C)c1ccncc1 ZINC000840893349 1132305517 /nfs/dbraw/zinc/30/55/17/1132305517.db2.gz IUPYFOIHOQZYLD-HOTGVXAUSA-N 1 0 297.446 3.738 20 10 CHCDRO CCOCCC1(C[NH2+]Cc2c(O)cc(C)cc2Cl)CC1 ZINC000840908137 1132307016 /nfs/dbraw/zinc/30/70/16/1132307016.db2.gz UQSJDDJNSIERDD-UHFFFAOYSA-N 1 0 297.826 3.650 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H]2CCO[C@H](C(C)C)C2)c(Cl)c1 ZINC000840908861 1132309029 /nfs/dbraw/zinc/30/90/29/1132309029.db2.gz YLZDAPYLVGZNDS-WBMJQRKESA-N 1 0 297.826 3.647 20 10 CHCDRO Cc1cc(N(C)C)ccc1CNc1cccc(C[NH+](C)C)c1 ZINC000840922004 1132309941 /nfs/dbraw/zinc/30/99/41/1132309941.db2.gz DGZZEWKFUGDJCT-UHFFFAOYSA-N 1 0 297.446 3.735 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+](C)[C@@H](C)c1ccncc1 ZINC000840938336 1132310162 /nfs/dbraw/zinc/31/01/62/1132310162.db2.gz BUZLUEWECXVWEB-HNNXBMFYSA-N 1 0 283.419 3.649 20 10 CHCDRO COCC(C)(C)CCC[NH2+]Cc1ccc(N(C)C)cc1C ZINC000840945624 1132311184 /nfs/dbraw/zinc/31/11/84/1132311184.db2.gz RDRJUUNCZMXAKP-UHFFFAOYSA-N 1 0 292.467 3.603 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@H+](Cc1cccnc1)C1CC1 ZINC000840945226 1132312097 /nfs/dbraw/zinc/31/20/97/1132312097.db2.gz FDOUAGUXSBXHPE-UHFFFAOYSA-N 1 0 295.430 3.621 20 10 CHCDRO CC[N@H+](Cc1occc1C)Cc1cccc(C)c1O ZINC000840970647 1132315483 /nfs/dbraw/zinc/31/54/83/1132315483.db2.gz VGUQZVPVGIVRJC-UHFFFAOYSA-N 1 0 259.349 3.624 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](CC)Cc2occc2C)c1 ZINC000840970616 1132315664 /nfs/dbraw/zinc/31/56/64/1132315664.db2.gz UUAWLXCHGDZPHX-UHFFFAOYSA-N 1 0 289.375 3.714 20 10 CHCDRO CCCO[C@H]1CC[N@H+](Cc2c(O)ccc3ccccc32)C1 ZINC001231588990 1132317567 /nfs/dbraw/zinc/31/75/67/1132317567.db2.gz ULORAGHMBVQGIG-HNNXBMFYSA-N 1 0 285.387 3.546 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCC(F)(F)C(C)(C)C2)c1O ZINC001231591435 1132318504 /nfs/dbraw/zinc/31/85/04/1132318504.db2.gz CQXWNYYPFNNOLM-UHFFFAOYSA-N 1 0 269.335 3.568 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCCC3(CC(F)C3)CC2)c1O ZINC001231592276 1132320507 /nfs/dbraw/zinc/32/05/07/1132320507.db2.gz GLOWEKWELNOCCI-UHFFFAOYSA-N 1 0 277.383 3.805 20 10 CHCDRO CC[C@H](C[NH2+]CCc1ccc(N)cc1)c1ccccc1 ZINC000841035323 1132321825 /nfs/dbraw/zinc/32/18/25/1132321825.db2.gz MMPOYNUDYIYEFM-MRXNPFEDSA-N 1 0 268.404 3.595 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C[C@H](N)c2ccc(C(C)C)cc2)c1 ZINC000841037391 1132322759 /nfs/dbraw/zinc/32/27/59/1132322759.db2.gz PFFWWIWWJWLQQV-SFHVURJKSA-N 1 0 298.430 3.614 20 10 CHCDRO CC[NH2+]Cc1ccccc1NCc1cccc(Cl)c1O ZINC000841043812 1132324948 /nfs/dbraw/zinc/32/49/48/1132324948.db2.gz VHXCIQNHXYEFOK-UHFFFAOYSA-N 1 0 290.794 3.767 20 10 CHCDRO Cc1ccc2c(c1)C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)CC2 ZINC001172844698 1132335332 /nfs/dbraw/zinc/33/53/32/1132335332.db2.gz YFEASBDFRMCMKJ-LJQANCHMSA-N 1 0 294.442 3.708 20 10 CHCDRO Cc1cc(C)c(C[NH+]2C3CCCC2CCC3)c(O)c1 ZINC001231849590 1132377901 /nfs/dbraw/zinc/37/79/01/1132377901.db2.gz RZLKRLBYMFCYCO-UHFFFAOYSA-N 1 0 259.393 3.916 20 10 CHCDRO Cc1cc(C)c(C[N@H+](C)Cc2ccccc2F)c(O)c1 ZINC001231845943 1132379303 /nfs/dbraw/zinc/37/93/03/1132379303.db2.gz VWJBHBILGJAULJ-UHFFFAOYSA-N 1 0 273.351 3.780 20 10 CHCDRO CCCOC1CCC([NH2+]Cc2ccc(N(C)C)cc2)CC1 ZINC001173093707 1132385446 /nfs/dbraw/zinc/38/54/46/1132385446.db2.gz ZOQLJRVWBYTIFH-UHFFFAOYSA-N 1 0 290.451 3.580 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2ccc3ccccc3c2O)CC[C@@]1(C)O ZINC001231879353 1132389551 /nfs/dbraw/zinc/38/95/51/1132389551.db2.gz CJPHJIUJKVJYNF-AUUYWEPGSA-N 1 0 299.414 3.528 20 10 CHCDRO C[C@]1(CO)CCC[N@H+](Cc2ccc3ccccc3c2O)CC1 ZINC001231879586 1132389779 /nfs/dbraw/zinc/38/97/79/1132389779.db2.gz JCLRLWCMZGVFGS-IBGZPJMESA-N 1 0 299.414 3.530 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2ccc3ccccc3c2O)CC[C@]1(C)O ZINC001231879355 1132390240 /nfs/dbraw/zinc/39/02/40/1132390240.db2.gz CJPHJIUJKVJYNF-KUHUBIRLSA-N 1 0 299.414 3.528 20 10 CHCDRO CCCCOC1C[NH+](Cc2ccc3ccccc3c2O)C1 ZINC001231882625 1132391138 /nfs/dbraw/zinc/39/11/38/1132391138.db2.gz QLFNRFKQWBCYSN-UHFFFAOYSA-N 1 0 285.387 3.546 20 10 CHCDRO Oc1c(C[N@@H+]2CC[C@@H]3CCCO[C@H]3C2)ccc2ccccc21 ZINC001231879349 1132391391 /nfs/dbraw/zinc/39/13/91/1132391391.db2.gz CGPTXAFTCKNZNF-YJBOKZPZSA-N 1 0 297.398 3.546 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](CO)CC2CCCCC2)c1 ZINC000841762216 1132396793 /nfs/dbraw/zinc/39/67/93/1132396793.db2.gz NWQLRMNWHHMIHA-GOEBONIOSA-N 1 0 291.435 3.683 20 10 CHCDRO CCc1ccc(C[C@@H](C)[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC001173236445 1132412708 /nfs/dbraw/zinc/41/27/08/1132412708.db2.gz XGTDWVFPULGKSU-OAHLLOKOSA-N 1 0 295.426 3.905 20 10 CHCDRO Oc1cc(O)c(C[N@@H+]2CC[C@@H]2c2ccccc2)cc1Cl ZINC001232262857 1132443768 /nfs/dbraw/zinc/44/37/68/1132443768.db2.gz TXVQUHAOYJASKY-CQSZACIVSA-N 1 0 289.762 3.698 20 10 CHCDRO Oc1cc(O)c(C[N@@H+]2CC[C@H]3CCCC[C@@H]3C2)cc1Cl ZINC001232263214 1132444620 /nfs/dbraw/zinc/44/46/20/1132444620.db2.gz KEIYXHQQGLETGY-VXGBXAGGSA-N 1 0 295.810 3.763 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2c(O)ccc3ccccc32)CC2(CCC2)O1 ZINC000842642332 1132447556 /nfs/dbraw/zinc/44/75/56/1132447556.db2.gz JFNNHBSZIIRCMT-CQSZACIVSA-N 1 0 297.398 3.689 20 10 CHCDRO CCSC[C@H](C)[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001173305401 1132448596 /nfs/dbraw/zinc/44/85/96/1132448596.db2.gz OCRLARGLXCOFBA-HNNXBMFYSA-N 1 0 292.492 3.860 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CC[C@@H]2C[C@@H]2C1)c1ccc(C)cc1O ZINC000842931002 1132477353 /nfs/dbraw/zinc/47/73/53/1132477353.db2.gz ZXOUFUCMGAMBQF-KQTLUZQSSA-N 1 0 259.393 3.930 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCS[C@@H]2C)c(O)c1C ZINC000842927932 1132477712 /nfs/dbraw/zinc/47/77/12/1132477712.db2.gz HNNQPQWPSFHBJX-SCRDCRAPSA-N 1 0 265.422 3.554 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+][C@H]2CCS[C@@H]2C)c2c1c(F)ccc2O ZINC000842929960 1132478024 /nfs/dbraw/zinc/47/80/24/1132478024.db2.gz RAWMUMAXUZVUIW-LSKIRQOJSA-N 1 0 281.396 3.563 20 10 CHCDRO CS[C@H]1CC[N@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000840117661 1132485751 /nfs/dbraw/zinc/48/57/51/1132485751.db2.gz WCEMGJJYTRDPJN-AWEZNQCLSA-N 1 0 279.449 3.761 20 10 CHCDRO CC(C)(C)c1cccc(C[N@@H+]2CC[C@@](C)(F)[C@@H](F)C2)c1O ZINC001143104539 1132501410 /nfs/dbraw/zinc/50/14/10/1132501410.db2.gz UXSAGVYWKWBGDZ-WMLDXEAASA-N 1 0 297.389 3.962 20 10 CHCDRO CC(C)(C)c1cccc(CN2Cc3cccnc3C2)c1O ZINC001143103634 1132501747 /nfs/dbraw/zinc/50/17/47/1132501747.db2.gz ICUXKQSORWTOED-UHFFFAOYSA-N 1 0 282.387 3.601 20 10 CHCDRO C[N@H+](Cc1ccncc1)Cc1cccc(C(C)(C)C)c1O ZINC001143104183 1132501950 /nfs/dbraw/zinc/50/19/50/1132501950.db2.gz QJOHSGQSCWWWQD-UHFFFAOYSA-N 1 0 284.403 3.717 20 10 CHCDRO C[N@@H+](Cc1cccc(C(C)(C)C)c1O)CC1CCC1 ZINC001143110994 1132504944 /nfs/dbraw/zinc/50/49/44/1132504944.db2.gz ULGITTLHEICADV-UHFFFAOYSA-N 1 0 261.409 3.922 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccccc1NC ZINC001232674126 1132505027 /nfs/dbraw/zinc/50/50/27/1132505027.db2.gz RCSPKXXGXNIXAG-UHFFFAOYSA-N 1 0 297.446 3.816 20 10 CHCDRO Cc1ccc(C[N@@H+](Cc2cccc(C)c2O)CC2CC2)cn1 ZINC000843423647 1132532394 /nfs/dbraw/zinc/53/23/94/1132532394.db2.gz QGYKBWZNYBLBGE-UHFFFAOYSA-N 1 0 296.414 3.816 20 10 CHCDRO C[N@H+](Cc1cncs1)Cc1cc(C(C)(C)C)ccc1O ZINC001233286785 1132595264 /nfs/dbraw/zinc/59/52/64/1132595264.db2.gz IWOJVTPDCBYQJP-UHFFFAOYSA-N 1 0 290.432 3.778 20 10 CHCDRO C[N@H+](Cc1ccccn1)Cc1cc(C(C)(C)C)ccc1O ZINC001233283432 1132595504 /nfs/dbraw/zinc/59/55/04/1132595504.db2.gz GROFPHNINKACRM-UHFFFAOYSA-N 1 0 284.403 3.717 20 10 CHCDRO C[N@H+](CCC1CC1)Cc1ccc(C(F)(F)F)cc1O ZINC001233455110 1132624665 /nfs/dbraw/zinc/62/46/65/1132624665.db2.gz WWEWPGSANQFWSR-UHFFFAOYSA-N 1 0 273.298 3.643 20 10 CHCDRO Oc1cc(C(F)(F)F)ccc1C[N@@H+]1CCC[C@H](CF)C1 ZINC001233454396 1132626414 /nfs/dbraw/zinc/62/64/14/1132626414.db2.gz TVSAPSHVLCNQAJ-SNVBAGLBSA-N 1 0 291.288 3.593 20 10 CHCDRO CCC(CC)[N@H+](C)Cc1cccc(OC(F)(F)F)c1O ZINC001233768788 1132678014 /nfs/dbraw/zinc/67/80/14/1132678014.db2.gz ZDLRAHIPRODTMX-UHFFFAOYSA-N 1 0 291.313 3.911 20 10 CHCDRO CCC(CC)[C@@H](O)C[NH2+][C@H](C)c1cc(Cl)cc(C)c1O ZINC000808695214 1132765418 /nfs/dbraw/zinc/76/54/18/1132765418.db2.gz MAPBVCVAUIVJPE-ABAIWWIYSA-N 1 0 299.842 3.802 20 10 CHCDRO Cc1cccc2cc[nH+]c(NCc3ccc(N)cc3)c12 ZINC001162787391 1133112187 /nfs/dbraw/zinc/11/21/87/1133112187.db2.gz KAXBOUHDMFZBOR-UHFFFAOYSA-N 1 0 263.344 3.738 20 10 CHCDRO Cc1ccc(/C=C/c2ccc(N3CC[C@H]([NH3+])C3)cc2)cc1 ZINC001164286150 1133211990 /nfs/dbraw/zinc/21/19/90/1133211990.db2.gz HDAZBPJLWHROTM-DKFQHHCZSA-N 1 0 278.399 3.703 20 10 CHCDRO COc1ccccc1C1CC[NH+](Cc2ccccc2O)CC1 ZINC001203557062 1133339608 /nfs/dbraw/zinc/33/96/08/1133339608.db2.gz YNYGLQSWOMIQPJ-UHFFFAOYSA-N 1 0 297.398 3.780 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(OC)c(C)c1)[C@@H](O)c1ccccc1 ZINC001203582595 1133342406 /nfs/dbraw/zinc/34/24/06/1133342406.db2.gz HGNDKJZEXZBWCX-MJGOQNOKSA-N 1 0 299.414 3.605 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCC(F)(F)C(C)(C)C2)c1O ZINC001203603665 1133343825 /nfs/dbraw/zinc/34/38/25/1133343825.db2.gz VTJYRHMVPUVZEK-UHFFFAOYSA-N 1 0 299.361 3.658 20 10 CHCDRO COc1cccc(C[N@@H+]2CCCC3(CC(F)C3)CC2)c1O ZINC001203596884 1133343984 /nfs/dbraw/zinc/34/39/84/1133343984.db2.gz RMGRJZHSPDQMPP-UHFFFAOYSA-N 1 0 293.382 3.505 20 10 CHCDRO CCc1ccc(C[N@H+](C)Cc2ccc(OC)cc2O)cc1 ZINC001203628992 1133346687 /nfs/dbraw/zinc/34/66/87/1133346687.db2.gz MRKHYEWNOQPGFX-UHFFFAOYSA-N 1 0 285.387 3.595 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]C2(C3CC3)CCC2)cc1 ZINC001203665553 1133351129 /nfs/dbraw/zinc/35/11/29/1133351129.db2.gz OMFOPMWPFQROMP-HWKANZROSA-N 1 0 270.420 3.688 20 10 CHCDRO CC[C@H](c1ccccc1)[N@H+](C)Cc1ccc(O)c(O)c1 ZINC001203880582 1133377925 /nfs/dbraw/zinc/37/79/25/1133377925.db2.gz VRYXCPGDNWZTNC-OAHLLOKOSA-N 1 0 271.360 3.681 20 10 CHCDRO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2ccc(O)c(O)c2)c1 ZINC001203873289 1133378793 /nfs/dbraw/zinc/37/87/93/1133378793.db2.gz 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CCC1(CC)[C@@H]([NH2+][C@@H](C)c2ccccc2O)C[C@@H]1OC ZINC001207160049 1133773557 /nfs/dbraw/zinc/77/35/57/1133773557.db2.gz NKBBZSUPYLATIM-RCBQFDQVSA-N 1 0 277.408 3.637 20 10 CHCDRO Oc1cccc2c1C[N@H+](C/C=C\c1cccc(F)c1)C2 ZINC001207243759 1133782062 /nfs/dbraw/zinc/78/20/62/1133782062.db2.gz PIRBQSSWRMCTGF-HYXAFXHYSA-N 1 0 269.319 3.560 20 10 CHCDRO Oc1cccc2c1C[N@H+](C/C=C/c1ccc(F)c(F)c1)C2 ZINC001207242933 1133782390 /nfs/dbraw/zinc/78/23/90/1133782390.db2.gz GVBSPGWDZKEAAF-NSCUHMNNSA-N 1 0 287.309 3.699 20 10 CHCDRO CCc1cccc(C[NH2+]Cc2ccc3c(c2)C[C@@H](C)O3)c1O ZINC001207486342 1133806081 /nfs/dbraw/zinc/80/60/81/1133806081.db2.gz YTGKWJBRACGBMI-CYBMUJFWSA-N 1 0 297.398 3.568 20 10 CHCDRO CC[N@H+](CCc1ccc(F)cc1)Cc1ccccc1O ZINC001207517440 1133812169 /nfs/dbraw/zinc/81/21/69/1133812169.db2.gz QQDXJLSHCVGSLY-UHFFFAOYSA-N 1 0 273.351 3.596 20 10 CHCDRO Oc1cccc2c1C[N@H+](CCCc1cccc(F)c1)CC2 ZINC001207604656 1133827475 /nfs/dbraw/zinc/82/74/75/1133827475.db2.gz WACVHTVLFKNLKV-UHFFFAOYSA-N 1 0 285.362 3.522 20 10 CHCDRO C[C@H](C[N@@H+]1CCc2cccc(O)c2C1)c1ccccc1 ZINC001207911532 1133860582 /nfs/dbraw/zinc/86/05/82/1133860582.db2.gz DJYXSHFLPSSOJY-CQSZACIVSA-N 1 0 267.372 3.554 20 10 CHCDRO CC1(C[N@@H+]2CCCc3cc(O)c(O)cc3C2)CCCCC1 ZINC001208902094 1133959490 /nfs/dbraw/zinc/95/94/90/1133959490.db2.gz HQDBJKSYPVRDOM-UHFFFAOYSA-N 1 0 289.419 3.816 20 10 CHCDRO CC[N@H+](CCOc1ccccc1)Cc1ccc(N(C)C)cc1 ZINC001209300502 1134004404 /nfs/dbraw/zinc/00/44/04/1134004404.db2.gz WTWHJCUMVSGQNJ-UHFFFAOYSA-N 1 0 298.430 3.654 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(C[NH+]2CCSCC2)cc1 ZINC001209516971 1134033293 /nfs/dbraw/zinc/03/32/93/1134033293.db2.gz VAJQRGGWSUGBAU-UHFFFAOYSA-N 1 0 286.444 3.643 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(C[N@@H+]2CCCO[C@H](C)C2)cc1 ZINC001209519629 1134035021 /nfs/dbraw/zinc/03/50/21/1134035021.db2.gz YZCKUHFEENUZBZ-QGZVFWFLSA-N 1 0 298.430 3.705 20 10 CHCDRO CC[NH+](CC)Cc1ccc(N(C)c2ccc(N)cc2)cc1 ZINC001209824528 1134071301 /nfs/dbraw/zinc/07/13/01/1134071301.db2.gz MOUAYBHENKFXSF-UHFFFAOYSA-N 1 0 283.419 3.879 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@H](C(F)(F)F)C1 ZINC000179950745 1134561291 /nfs/dbraw/zinc/56/12/91/1134561291.db2.gz OPRRYPRMOYAZJV-JTQLQIEISA-N 1 0 293.716 3.820 20 10 CHCDRO COc1cccc(C[N@@H+]2CCc3ccccc3[C@H](C)C2)c1O ZINC000404870088 1134950563 /nfs/dbraw/zinc/95/05/63/1134950563.db2.gz XNPXRMZIPKYSSR-CQSZACIVSA-N 1 0 297.398 3.563 20 10 CHCDRO C[NH2+][C@H]1C[C@H](Oc2ccccc2NN=C2C=CC=CC2=O)C1 ZINC001217950069 1135030234 /nfs/dbraw/zinc/03/02/34/1135030234.db2.gz DDDMDZYYUKIXIG-FZEWNRSGSA-N 1 0 297.358 3.937 20 10 CHCDRO C[C@@H]1C[NH2+]C[C@@H]1Oc1ccc(NN=C2C=CC(=O)C=C2)cc1 ZINC001217969067 1135032994 /nfs/dbraw/zinc/03/29/94/1135032994.db2.gz UXQVRYBSSBAWLP-PXAZEXFGSA-N 1 0 297.358 3.794 20 10 CHCDRO c1ccc(/N=N/c2ccc(O[C@@H]3CC[NH2+]C3)cc2)cc1 ZINC001218038072 1135047843 /nfs/dbraw/zinc/04/78/43/1135047843.db2.gz DGYUWTUXBWITDO-VRTBNJGNSA-N 1 0 267.332 3.843 20 10 CHCDRO CC[C@@H](C)C[C@@H](CC)Oc1ccc(N2CC[NH2+]CC2)cc1 ZINC001218295537 1135081542 /nfs/dbraw/zinc/08/15/42/1135081542.db2.gz ODCDGIMKGZRDFE-NVXWUHKLSA-N 1 0 290.451 3.690 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]Cc1cccc(C#N)c1 ZINC000314650200 1135145585 /nfs/dbraw/zinc/14/55/85/1135145585.db2.gz GGVZUSMXXFIRFK-CJNGLKHVSA-N 1 0 292.382 3.910 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]Cc1cccc(C#N)c1 ZINC000314650201 1135145889 /nfs/dbraw/zinc/14/58/89/1135145889.db2.gz GGVZUSMXXFIRFK-CZUORRHYSA-N 1 0 292.382 3.910 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCc3ccccc3C2)c1 ZINC000315472610 1135154375 /nfs/dbraw/zinc/15/43/75/1135154375.db2.gz RJVOGXJMEASIHB-CZUORRHYSA-N 1 0 297.398 3.609 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCN(C)[C@@H](C)C1)c1ccc2ccccc2c1O ZINC000316830240 1135169034 /nfs/dbraw/zinc/16/90/34/1135169034.db2.gz RVFHFZKHYXGQQW-DZKIICNBSA-N 1 0 298.430 3.679 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1cccc(F)c1)c1ccccc1O ZINC000020147847 171035243 /nfs/dbraw/zinc/03/52/43/171035243.db2.gz KFKFKPMWWUOILU-NWDGAFQWSA-N 1 0 259.324 3.943 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCCc3occc32)c1 ZINC000020204532 171069714 /nfs/dbraw/zinc/06/97/14/171069714.db2.gz IPDRUEJVNGDUIK-IAQYHMDHSA-N 1 0 287.359 3.722 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cccc(F)c1)c1ccccc1O ZINC000020473376 171217193 /nfs/dbraw/zinc/21/71/93/171217193.db2.gz NLUQIZXRCZUQQS-OAHLLOKOSA-N 1 0 259.324 3.772 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]C1CCCCCC1 ZINC000021801619 171326202 /nfs/dbraw/zinc/32/62/02/171326202.db2.gz FZAXNMUJOFUEOG-UHFFFAOYSA-N 1 0 253.773 3.858 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)c2cc(C)ccc2O)cc1 ZINC000035628709 172308325 /nfs/dbraw/zinc/30/83/25/172308325.db2.gz DUZBBNITNDGOQS-AWEZNQCLSA-N 1 0 255.361 3.860 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCCO1)c1ccc(N2CCCCC2)cc1 ZINC000153136769 261073630 /nfs/dbraw/zinc/07/36/30/261073630.db2.gz QASVERGWUKBZBV-QAPCUYQASA-N 1 0 288.435 3.507 20 10 CHCDRO CC[C@@H]([NH2+]CCCCNc1ccccn1)c1ccccc1O ZINC000155601175 261104813 /nfs/dbraw/zinc/10/48/13/261104813.db2.gz BAKGDJQYUMJCGT-MRXNPFEDSA-N 1 0 299.418 3.720 20 10 CHCDRO CC[C@@H]([NH2+]CC1(CCO)CCCCC1)c1ccccc1O ZINC000156287175 261119165 /nfs/dbraw/zinc/11/91/65/261119165.db2.gz BYCSHMGUQXYWCC-MRXNPFEDSA-N 1 0 291.435 3.766 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCCO[C@@H]1C(C)C)c1ccccc1O ZINC000156698709 261129710 /nfs/dbraw/zinc/12/97/10/261129710.db2.gz SPKGIEXBRQVYSD-UWWQBHOKSA-N 1 0 291.435 3.884 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1cccnc1)c1ccc(N(C)C)cc1 ZINC000158521880 261166452 /nfs/dbraw/zinc/16/64/52/261166452.db2.gz MDNDANHTOKLQGS-RDTXWAMCSA-N 1 0 283.419 3.950 20 10 CHCDRO COc1ccc(O)c(C[N@H+](C)[C@H](C)c2ccccc2)c1 ZINC000179596752 261801640 /nfs/dbraw/zinc/80/16/40/261801640.db2.gz NDFPWGQXLARNOA-CYBMUJFWSA-N 1 0 271.360 3.594 20 10 CHCDRO Cc1cccc(C[NH2+]C2(c3nccs3)CCCC2)c1O ZINC000182220013 261929428 /nfs/dbraw/zinc/92/94/28/261929428.db2.gz PRZBEDOQPPMLGO-UHFFFAOYSA-N 1 0 288.416 3.716 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCC[C@@H]2CCCCO2)c1 ZINC000183985239 262003968 /nfs/dbraw/zinc/00/39/68/262003968.db2.gz BHOFLUVAFSXAAA-GJZGRUSLSA-N 1 0 277.408 3.701 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCC[C@H]2CCCCO2)c1 ZINC000183985262 262003986 /nfs/dbraw/zinc/00/39/86/262003986.db2.gz BHOFLUVAFSXAAA-HUUCEWRRSA-N 1 0 277.408 3.701 20 10 CHCDRO C[C@@H]([NH2+]CCC[C@H]1CCCCO1)c1cc(F)ccc1O ZINC000184000338 262004525 /nfs/dbraw/zinc/00/45/25/262004525.db2.gz XFCHLLYBMCCEKR-TZMCWYRMSA-N 1 0 281.371 3.531 20 10 CHCDRO C[C@H]([NH2+]CCC[C@@H]1CCCCO1)c1cc(F)ccc1O ZINC000184000289 262004777 /nfs/dbraw/zinc/00/47/77/262004777.db2.gz XFCHLLYBMCCEKR-JSGCOSHPSA-N 1 0 281.371 3.531 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc([C@@H](C)O)cc2)c(O)c1 ZINC000185120243 262042981 /nfs/dbraw/zinc/04/29/81/262042981.db2.gz SLPVOQZRELCGNB-ZIAGYGMSSA-N 1 0 285.387 3.605 20 10 CHCDRO COc1cccc(C[NH2+]Cc2ccc(C(F)F)cc2)c1O ZINC000185172421 262044442 /nfs/dbraw/zinc/04/44/42/262044442.db2.gz CLXOHQVDDJBUDZ-UHFFFAOYSA-N 1 0 293.313 3.628 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCCCNc2ccccn2)c1 ZINC000185325398 262050815 /nfs/dbraw/zinc/05/08/15/262050815.db2.gz PRXFICFHYRKVGX-HNNXBMFYSA-N 1 0 299.418 3.639 20 10 CHCDRO C[C@H]([NH2+]C1CCSCC1)c1cc(Cl)ccc1O ZINC000185978658 262074434 /nfs/dbraw/zinc/07/44/34/262074434.db2.gz UGOZPMXDKOCFHP-VIFPVBQESA-N 1 0 271.813 3.592 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2nc(C3CC3)cs2)c(O)c1 ZINC000186117536 262079779 /nfs/dbraw/zinc/07/97/79/262079779.db2.gz PKMUOCKLRAVSTC-LLVKDONJSA-N 1 0 288.416 3.885 20 10 CHCDRO CCOCCC1(C[NH2+][C@H](C)c2cc(Cl)ccc2O)CC1 ZINC000186155231 262081813 /nfs/dbraw/zinc/08/18/13/262081813.db2.gz RRHXVHHLKBLQQS-GFCCVEGCSA-N 1 0 297.826 3.903 20 10 CHCDRO COc1cc(F)cc(C[NH2+][C@H](C)c2cc(F)ccc2O)c1 ZINC000186217124 262084809 /nfs/dbraw/zinc/08/48/09/262084809.db2.gz YQJVBEOALFYJRJ-SNVBAGLBSA-N 1 0 293.313 3.530 20 10 CHCDRO Cc1cnc([C@H](C)C[NH2+][C@H](C)c2ccc(C)cc2O)s1 ZINC000186777912 262109670 /nfs/dbraw/zinc/10/96/70/262109670.db2.gz QCKUMRXRJGJUBK-DGCLKSJQSA-N 1 0 290.432 3.920 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCCCOC(C)C)c1 ZINC000186529544 262316213 /nfs/dbraw/zinc/31/62/13/262316213.db2.gz ADNJQLKBDLHHRS-CQSZACIVSA-N 1 0 265.397 3.556 20 10 CHCDRO C[C@@H](C[NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1nccs1 ZINC000186737946 262322008 /nfs/dbraw/zinc/32/20/08/262322008.db2.gz GJTPUJYIUBPCDB-STQMWFEESA-N 1 0 289.448 3.663 20 10 CHCDRO CCn1cc([C@@H](C)[NH2+]Cc2c(C)c3ccccc3n2C)cn1 ZINC000359008179 266522280 /nfs/dbraw/zinc/52/22/80/266522280.db2.gz WDBCZQYKHKYBHR-CQSZACIVSA-N 1 0 296.418 3.554 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2[C@@H]3CCCO[C@@H]3C2(C)C)c(O)c1 ZINC000371870203 267475507 /nfs/dbraw/zinc/47/55/07/267475507.db2.gz OCKZUCCVJNIPNW-SDNTUTLCSA-N 1 0 289.419 3.555 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1cc(C)ccc1O)c1ccncc1 ZINC000185540919 327840476 /nfs/dbraw/zinc/84/04/76/327840476.db2.gz WDFDXUUCWFLESV-CJNGLKHVSA-N 1 0 270.376 3.898 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]CCSC(C)(C)C)c1 ZINC000273345733 327907664 /nfs/dbraw/zinc/90/76/64/327907664.db2.gz APIISKUCBPBDLD-NSHDSACASA-N 1 0 283.437 3.583 20 10 CHCDRO CSCc1ccc(C[NH2+]Cc2ccccc2O)cc1 ZINC000285508502 328247889 /nfs/dbraw/zinc/24/78/89/328247889.db2.gz NWENLPANTDTXTL-UHFFFAOYSA-N 1 0 273.401 3.545 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCOC[C@H]1C)c1ccc2ccccc2c1O ZINC000278613843 327177788 /nfs/dbraw/zinc/17/77/88/327177788.db2.gz RGPKQDDKPNZFFY-IIYDPXPESA-N 1 0 285.387 3.621 20 10 CHCDRO C[C@H]([NH2+]C1CCC2(CCOCC2)CC1)c1ccccc1O ZINC000360713120 328910553 /nfs/dbraw/zinc/91/05/53/328910553.db2.gz NOEMKSMJRSDDEM-AWEZNQCLSA-N 1 0 289.419 3.782 20 10 CHCDRO Cc1cccc2c1OCC[C@H]2[NH2+][C@@H](C)c1ccccc1O ZINC000189374397 329380373 /nfs/dbraw/zinc/38/03/73/329380373.db2.gz NSPDAFIFBCUCKE-XJKSGUPXSA-N 1 0 283.371 3.875 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]CC[C@@H]2CC=CCC2)c1 ZINC000527975904 330302009 /nfs/dbraw/zinc/30/20/09/330302009.db2.gz BKCMGXZARXWJII-ZIAGYGMSSA-N 1 0 275.392 3.798 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2ncccc2F)c1 ZINC000528034993 330302514 /nfs/dbraw/zinc/30/25/14/330302514.db2.gz CRIVSWUDKRPZMZ-NEPJUHHUSA-N 1 0 274.339 3.647 20 10 CHCDRO C[C@@H]([NH2+]CCOCC1CC1)c1ccc2ccccc2c1O ZINC000230661312 333319751 /nfs/dbraw/zinc/31/97/51/333319751.db2.gz OACFTQNBFVYEPV-CYBMUJFWSA-N 1 0 285.387 3.623 20 10 CHCDRO Oc1ccccc1C[NH2+]Cc1ccc(CSC(F)F)o1 ZINC000134236589 334085184 /nfs/dbraw/zinc/08/51/84/334085184.db2.gz GIHCGIVEOQBMBT-UHFFFAOYSA-N 1 0 299.342 3.731 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)c1ccc2ccccc2c1O)c1cnn(C)c1 ZINC000273366863 334764731 /nfs/dbraw/zinc/76/47/31/334764731.db2.gz BRUFTYRQYWQBGO-STQMWFEESA-N 1 0 295.386 3.691 20 10 CHCDRO CC(C)C[C@H](CO)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000040773762 519362890 /nfs/dbraw/zinc/36/28/90/519362890.db2.gz XCUWEMABAVJCCA-DZGCQCFKSA-N 1 0 287.403 3.603 20 10 CHCDRO CCOCc1ccccc1C[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000295861520 520215296 /nfs/dbraw/zinc/21/52/96/520215296.db2.gz GOAWMUKKUZCLAF-QGZVFWFLSA-N 1 0 297.398 3.706 20 10 CHCDRO CCO[C@@H](C[NH2+][C@H]1CCc2cccc(O)c21)c1ccccc1 ZINC000296584085 520312909 /nfs/dbraw/zinc/31/29/09/520312909.db2.gz WGSHXXYLUKZNAW-WMZOPIPTSA-N 1 0 297.398 3.747 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]C(C)(C)c2ccccc2)c1 ZINC000263685400 521148960 /nfs/dbraw/zinc/14/89/60/521148960.db2.gz NLEQJHHAEVAXPR-UHFFFAOYSA-N 1 0 285.387 3.816 20 10 CHCDRO CCOc1cccc(C[NH+](C2CCC2)C2CCC2)c1O ZINC000292856312 521332563 /nfs/dbraw/zinc/33/25/63/521332563.db2.gz UTXYLGCXTLEUQJ-UHFFFAOYSA-N 1 0 275.392 3.698 20 10 CHCDRO COCC[C@H]([NH2+][C@H](C)c1cc(F)ccc1O)c1ccco1 ZINC000273391116 521976899 /nfs/dbraw/zinc/97/68/99/521976899.db2.gz DNDKQVORCMZDNW-RISCZKNCSA-N 1 0 293.338 3.553 20 10 CHCDRO CC[C@H](CCO)C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000094936315 522144042 /nfs/dbraw/zinc/14/40/42/522144042.db2.gz BAEKVJVUDXQGJY-UONOGXRCSA-N 1 0 287.403 3.605 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)cc1F ZINC000127462401 522178225 /nfs/dbraw/zinc/17/82/25/522178225.db2.gz CFYYMEHSBAZCSH-KRWDZBQOSA-N 1 0 287.382 3.557 20 10 CHCDRO CC[C@H]([NH2+]CC(C)(C)CCCO)c1ccc(C)cc1O ZINC000280069713 522568877 /nfs/dbraw/zinc/56/88/77/522568877.db2.gz KYEJNHZGBZLPSG-HNNXBMFYSA-N 1 0 279.424 3.540 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)C1CCOCC1)c1ccc(C)cc1O ZINC000280282065 522687685 /nfs/dbraw/zinc/68/76/85/522687685.db2.gz YOJYHPGKPFGZJH-BBRMVZONSA-N 1 0 277.408 3.556 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1cn(C)nc1C)c1ccc(C)cc1O ZINC000280270946 522698944 /nfs/dbraw/zinc/69/89/44/522698944.db2.gz XWYAPMVQVFOAPL-LRDDRELGSA-N 1 0 287.407 3.544 20 10 CHCDRO C[N@H+](CCCCCO)Cc1cc(-c2ccccc2)ccc1O ZINC000279436155 522731148 /nfs/dbraw/zinc/73/11/48/522731148.db2.gz OPXJNWRSSASBDI-UHFFFAOYSA-N 1 0 299.414 3.654 20 10 CHCDRO COCC(C)(C)CCC[NH2+]Cc1c(O)cccc1Cl ZINC000290109991 522808015 /nfs/dbraw/zinc/80/80/15/522808015.db2.gz LASIYUVCWVHELV-UHFFFAOYSA-N 1 0 285.815 3.588 20 10 CHCDRO CC[C@@H]([NH2+]CCCc1nccs1)c1ccc(C)cc1O ZINC000280142187 522830899 /nfs/dbraw/zinc/83/08/99/522830899.db2.gz PRPYOVMPZOUGNV-CQSZACIVSA-N 1 0 290.432 3.831 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1nnc(C)s1)c1ccc(C)cc1O ZINC000280126274 522940680 /nfs/dbraw/zinc/94/06/80/522940680.db2.gz ORGKINCXGNHVPP-ZWNOBZJWSA-N 1 0 291.420 3.662 20 10 CHCDRO C[N@H+](Cc1ccc(N2CCCCC2)cc1)Cc1cccnc1 ZINC000248049553 523262795 /nfs/dbraw/zinc/26/27/95/523262795.db2.gz NACVDSJJFJELGU-UHFFFAOYSA-N 1 0 295.430 3.704 20 10 CHCDRO CO[C@@H](C)[C@H](C)[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000191647762 523445327 /nfs/dbraw/zinc/44/53/27/523445327.db2.gz KPUFIJGNYMBTOP-JYJNAYRXSA-N 1 0 290.451 3.751 20 10 CHCDRO CO[C@@](C)(C[NH2+][C@@H](C)c1cc(Cl)ccc1O)C1CC1 ZINC000291207754 523797115 /nfs/dbraw/zinc/79/71/15/523797115.db2.gz MNQLGYFJAMPGGB-BONVTDFDSA-N 1 0 283.799 3.511 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CCO[C@H](C(C)(C)C)C2)cc1C ZINC000270659878 524086117 /nfs/dbraw/zinc/08/61/17/524086117.db2.gz OCDHYHYSAGBPKQ-WBVHZDCISA-N 1 0 291.435 3.687 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2)c1 ZINC000020146072 524153058 /nfs/dbraw/zinc/15/30/58/524153058.db2.gz UHBRIOKLECCXTI-AWEZNQCLSA-N 1 0 284.403 3.612 20 10 CHCDRO C[C@H](CCc1ccc(O)cc1)[NH2+][C@H](C)c1ccccc1O ZINC000037140279 524234675 /nfs/dbraw/zinc/23/46/75/524234675.db2.gz KVFOKGGRXHSFIB-ZIAGYGMSSA-N 1 0 285.387 3.770 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)CCc2ccco2)c1 ZINC000020144911 524773590 /nfs/dbraw/zinc/77/35/90/524773590.db2.gz PCHZJVJHVAHTCG-OLZOCXBDSA-N 1 0 289.375 3.666 20 10 CHCDRO COc1ccc([C@@H](C)[NH2+][C@H](C)c2cc(F)ccc2O)cc1 ZINC000094618477 525163268 /nfs/dbraw/zinc/16/32/68/525163268.db2.gz ZGOJSUWESJRWPD-VXGBXAGGSA-N 1 0 289.350 3.952 20 10 CHCDRO Cc1ccccc1C[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000094617623 525168171 /nfs/dbraw/zinc/16/81/71/525168171.db2.gz AILXRVSEAAQVPU-LBPRGKRZSA-N 1 0 259.324 3.691 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)cc1C ZINC000127445804 525316654 /nfs/dbraw/zinc/31/66/54/525316654.db2.gz UXAGYJRFKCGBCP-INIZCTEOSA-N 1 0 270.376 3.674 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H](C)CCc2ccc(O)cc2)c1 ZINC000071407905 525351276 /nfs/dbraw/zinc/35/12/76/525351276.db2.gz XXUWXZFAPJRCOR-CQSZACIVSA-N 1 0 285.387 3.517 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)c1cccnc1)c1ccc(N(C)C)cc1 ZINC000037228908 525664787 /nfs/dbraw/zinc/66/47/87/525664787.db2.gz XJJFHFZFAHXKGX-ZIAGYGMSSA-N 1 0 269.392 3.559 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC(F)(F)C2)c(O)c1 ZINC000281074188 525727022 /nfs/dbraw/zinc/72/70/22/525727022.db2.gz IOIMNMCHAAOMLS-VXGBXAGGSA-N 1 0 269.335 3.787 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2COc3ccccc32)c(O)c1 ZINC000290459471 525925464 /nfs/dbraw/zinc/92/54/64/525925464.db2.gz WLVYRWRVRVUUMM-KBPBESRZSA-N 1 0 283.371 3.527 20 10 CHCDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]C[C@H]1CCCOC1 ZINC000263717966 526338337 /nfs/dbraw/zinc/33/83/37/526338337.db2.gz VOKGZEMVFJKBAP-OAHLLOKOSA-N 1 0 297.398 3.575 20 10 CHCDRO Oc1ccc(-c2ccccc2)cc1C[NH2+][C@H]1CCSC1 ZINC000266174656 526338793 /nfs/dbraw/zinc/33/87/93/526338793.db2.gz SNHCKUOMVDTELB-INIZCTEOSA-N 1 0 285.412 3.654 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+][C@H]2CCC(C)(C)C2)c1O ZINC000169092679 1119493806 /nfs/dbraw/zinc/49/38/06/1119493806.db2.gz HMSNBASJPLRKQW-LBPRGKRZSA-N 1 0 283.799 3.723 20 10 CHCDRO Cc1ccc(O)c(C[NH+]2CCC(Cc3cccnc3)CC2)c1 ZINC000359956348 1125499948 /nfs/dbraw/zinc/49/99/48/1125499948.db2.gz DWARVNPZNUDBRY-UHFFFAOYSA-N 1 0 296.414 3.550 20 10 CHCDRO CC[C@H](CSC)[NH2+][C@H](C)c1ccc(N(C)CC)cc1 ZINC000775420206 1122560069 /nfs/dbraw/zinc/56/00/69/1122560069.db2.gz IBVUUAIXPUDSOL-UKRRQHHQSA-N 1 0 280.481 3.935 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1CCCOC1)c1cc(Cl)ccc1O ZINC000775490642 1122620077 /nfs/dbraw/zinc/62/00/77/1122620077.db2.gz CVUJNVFPFIBKDF-BXUZGUMPSA-N 1 0 283.799 3.513 20 10 CHCDRO CC[C@H]([NH2+][C@H](COC)C1CC1)c1cc(Cl)ccc1O ZINC000775524606 1122642448 /nfs/dbraw/zinc/64/24/48/1122642448.db2.gz SUMNAYVHOBBEDA-UONOGXRCSA-N 1 0 283.799 3.511 20 10 CHCDRO CC[C@H]1CC[N@H+](Cc2ccc(N(C)C)c(C)c2)[C@@H]1C ZINC001193603179 1122704626 /nfs/dbraw/zinc/70/46/26/1122704626.db2.gz AOLPRNGGXBKFML-ZBFHGGJFSA-N 1 0 260.425 3.681 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@H]2C2CC2)c1O ZINC000775677155 1122901027 /nfs/dbraw/zinc/90/10/27/1122901027.db2.gz HYIOATRCGSAIDK-CQSZACIVSA-N 1 0 265.784 3.728 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2C[C@H](C)C[C@H]2C)c1O ZINC000775716551 1122921322 /nfs/dbraw/zinc/92/13/22/1122921322.db2.gz XQOWBYHXVDIISE-MWLCHTKSSA-N 1 0 253.773 3.584 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCN1C(C)(C)C)c1ccc(Cl)cc1O ZINC000850481921 1123273138 /nfs/dbraw/zinc/27/31/38/1123273138.db2.gz OQJJSJLLFSBDFI-DGCLKSJQSA-N 1 0 296.842 3.569 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1C(C)(C)C1(F)F)c1cc(Cl)ccc1O ZINC000850551329 1123289930 /nfs/dbraw/zinc/28/99/30/1123289930.db2.gz GWKBBFGIHAMHIO-PRHODGIISA-N 1 0 289.753 3.988 20 10 CHCDRO C[N@H+](Cc1c(O)cccc1Cl)C1CCCCC1 ZINC000131742926 1125409937 /nfs/dbraw/zinc/40/99/37/1125409937.db2.gz JYYCXGYYKHOTCD-UHFFFAOYSA-N 1 0 253.773 3.810 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2C[C@H]2C2CC2)c(O)c1C ZINC000834906217 1131728270 /nfs/dbraw/zinc/72/82/70/1131728270.db2.gz NRZBYBSFCSOVRO-INWMFGNUSA-N 1 0 259.393 3.706 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]C(C)(C)C2CC2)cc1 ZINC000835039419 1131763034 /nfs/dbraw/zinc/76/30/34/1131763034.db2.gz GOXXEJAIDJFDMD-AATRIKPKSA-N 1 0 258.409 3.544 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC[C@H](CF)C2)cc1Cl ZINC001231870708 1132383089 /nfs/dbraw/zinc/38/30/89/1132383089.db2.gz PCYWTPXWYZEDCW-LLVKDONJSA-N 1 0 271.763 3.536 20 10 CHCDRO CCc1ccc(C[N@@H+](CC)Cc2ccccc2O)o1 ZINC001204394710 1133442625 /nfs/dbraw/zinc/44/26/25/1133442625.db2.gz JKQRJEDVOSSMMP-UHFFFAOYSA-N 1 0 259.349 3.570 20 10 CHCDRO CSc1ccc(C[NH2+]Cc2cccc(F)c2[O-])cc1 ZINC001205450493 1133578107 /nfs/dbraw/zinc/57/81/07/1133578107.db2.gz KIULQIAJNJANDP-UHFFFAOYSA-N 1 0 277.364 3.543 20 10 CHCDRO COc1cccc(C[NH+]2CCC3(CCCC3)CC2)c1O ZINC000133993401 1125516717 /nfs/dbraw/zinc/51/67/17/1125516717.db2.gz DNJJJMRRTNGWNR-UHFFFAOYSA-N 1 0 275.392 3.557 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@H]2CCCC[C@@H]2C(C)C)c1 ZINC000214933812 1125547803 /nfs/dbraw/zinc/54/78/03/1125547803.db2.gz NVVHAGFYXIWMRZ-CVEARBPZSA-N 1 0 277.408 3.705 20 10 CHCDRO Oc1ccccc1C[NH2+]C1CC(c2ccc(F)cc2)C1 ZINC000134482187 1125563578 /nfs/dbraw/zinc/56/35/78/1125563578.db2.gz RMVSPYMRWKXRHG-UHFFFAOYSA-N 1 0 271.335 3.567 20 10 CHCDRO C[C@@H]1C[C@@H](C)[N@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000134957844 1125570459 /nfs/dbraw/zinc/57/04/59/1125570459.db2.gz UZIDCXPKQQTGEZ-CHWSQXEVSA-N 1 0 255.361 3.776 20 10 CHCDRO C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC000135147763 1125579636 /nfs/dbraw/zinc/57/96/36/1125579636.db2.gz NPAIESKTJBLRKC-GDBMZVCRSA-N 1 0 258.409 3.565 20 10 CHCDRO CCOC(C)(C)C[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841752228 1125582330 /nfs/dbraw/zinc/58/23/30/1125582330.db2.gz NJLRGPOFPCPBRI-JTQLQIEISA-N 1 0 271.788 3.511 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]C(C)(C)C(C)(C)C)c1O ZINC000388756731 1125679365 /nfs/dbraw/zinc/67/93/65/1125679365.db2.gz NELQZAHILXZNMF-UHFFFAOYSA-N 1 0 285.815 3.969 20 10 CHCDRO C[C@@H]([NH2+]Cc1cc(C2CC2)no1)c1ccc(Cl)cc1O ZINC000886684700 1125706865 /nfs/dbraw/zinc/70/68/65/1125706865.db2.gz QFLWLWIGGHAYPO-SECBINFHSA-N 1 0 292.766 3.762 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2cc(C3CC3)no2)c(O)c1C ZINC000886684507 1125707889 /nfs/dbraw/zinc/70/78/89/1125707889.db2.gz MTKKMSLGDYIPHF-LBPRGKRZSA-N 1 0 286.375 3.725 20 10 CHCDRO Oc1ccc(Br)cc1C[N@@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000826539334 1125755822 /nfs/dbraw/zinc/75/58/22/1125755822.db2.gz RSHYQKCSXLTVCY-GWCFXTLKSA-N 1 0 296.208 3.529 20 10 CHCDRO C[C@@H]1CC[C@H]1[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000796527133 1129774993 /nfs/dbraw/zinc/77/49/93/1129774993.db2.gz VSHYILBHYFRIOR-QMTHXVAHSA-N 1 0 286.341 3.660 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)C(C)(C)OC)c1ccc(C)cc1O ZINC000903331432 1130158059 /nfs/dbraw/zinc/15/80/59/1130158059.db2.gz NKVFDZSRPHRVEP-GXTWGEPZSA-N 1 0 265.397 3.555 20 10 CHCDRO CC[C@H]([NH2+]CC1(SC)CC1)c1cc(Cl)ccc1O ZINC000788605157 1130197153 /nfs/dbraw/zinc/19/71/53/1130197153.db2.gz GTSWUPXLCLDRFP-LBPRGKRZSA-N 1 0 285.840 3.982 20 10 CHCDRO Cc1cccc(C[NH2+]Cc2ccccc2OC(F)F)c1O ZINC000158091431 1126745619 /nfs/dbraw/zinc/74/56/19/1126745619.db2.gz TUUWZJFDJANKFQ-UHFFFAOYSA-N 1 0 293.313 3.592 20 10 CHCDRO COc1ccc(O)c(C[N@H+](C)[C@H](C)c2cccs2)c1 ZINC000179713961 1126833273 /nfs/dbraw/zinc/83/32/73/1126833273.db2.gz WRMJEZSBVWIVBW-LLVKDONJSA-N 1 0 277.389 3.655 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(Cl)cn1)c1ccc(N(C)C)cc1 ZINC000182118130 1126866212 /nfs/dbraw/zinc/86/62/12/1126866212.db2.gz XVKWUTRRRQCPIJ-GFCCVEGCSA-N 1 0 289.810 3.652 20 10 CHCDRO C[C@@H](C[NH2+][C@@H](C)c1ccccc1O)Oc1ccccc1 ZINC000183605550 1126889426 /nfs/dbraw/zinc/88/94/26/1126889426.db2.gz UHGRBRQGDOXHSO-KBPBESRZSA-N 1 0 271.360 3.510 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+](C)[C@H](C)c2cccnc2)c1O ZINC000183729041 1126892053 /nfs/dbraw/zinc/89/20/53/1126892053.db2.gz PVZPJAIABSPAEI-GFCCVEGCSA-N 1 0 290.794 3.942 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2cn3c(cccc3C)n2)c(O)c1 ZINC000185412644 1126899332 /nfs/dbraw/zinc/89/93/32/1126899332.db2.gz WXTIPJZLIAJMKG-CQSZACIVSA-N 1 0 295.386 3.508 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC[C@@](C)(O)c2ccccc2)c(O)c1 ZINC000187927077 1126917695 /nfs/dbraw/zinc/91/76/95/1126917695.db2.gz MGJOUWPESOIRTI-DNVCBOLYSA-N 1 0 299.414 3.649 20 10 CHCDRO CO[C@H](C)[C@H](C)[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000191647745 1126953665 /nfs/dbraw/zinc/95/36/65/1126953665.db2.gz KPUFIJGNYMBTOP-HRCADAONSA-N 1 0 290.451 3.751 20 10 CHCDRO CC[C@@H](c1ccncc1)[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC000193456313 1126969530 /nfs/dbraw/zinc/96/95/30/1126969530.db2.gz BRVKRTUQWICIRG-SFHVURJKSA-N 1 0 283.419 3.731 20 10 CHCDRO Cc1cc(C)c(C[NH2+][C@H]2C[C@@H]3[C@H](C2)C3(C)C)c(O)c1 ZINC001170730866 1130836793 /nfs/dbraw/zinc/83/67/93/1130836793.db2.gz LYMIRHBGUSJAFP-YOWGUQMCSA-N 1 0 259.393 3.533 20 10 CHCDRO CC1(C)C[N@H+](Cc2c(O)cccc2Cl)C1(C)C ZINC001319706720 1126981977 /nfs/dbraw/zinc/98/19/77/1126981977.db2.gz ABOINNWJLQRVGU-UHFFFAOYSA-N 1 0 253.773 3.666 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H]2CCO[C@H](C(C)(C)C)C2)cc1C ZINC000270602180 1127058561 /nfs/dbraw/zinc/05/85/61/1127058561.db2.gz AUPSMNQUICPJDV-RDJZCZTQSA-N 1 0 291.435 3.692 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H]2CCO[C@H](C(C)(C)C)C2)cc1C ZINC000270602184 1127058577 /nfs/dbraw/zinc/05/85/77/1127058577.db2.gz AUPSMNQUICPJDV-WBVHZDCISA-N 1 0 291.435 3.692 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCc2c1cccc2F)c1ccccc1O ZINC000271669736 1127096721 /nfs/dbraw/zinc/09/67/21/1127096721.db2.gz MYOAYXJYXLVLKM-BZNIZROVSA-N 1 0 271.335 3.869 20 10 CHCDRO CCOc1ccc(C[NH+]2[C@@H](C)CCC[C@@H]2C)c(O)c1 ZINC001237046224 1131041574 /nfs/dbraw/zinc/04/15/74/1131041574.db2.gz ZSMBPUUPUGTCNI-STQMWFEESA-N 1 0 263.381 3.554 20 10 CHCDRO C[C@H]1C[C@@H](CF)[N@H+](Cc2cc(C(F)(F)F)ccc2O)C1 ZINC001237138797 1131055420 /nfs/dbraw/zinc/05/54/20/1131055420.db2.gz YVUJTAGUPGZUMR-CABZTGNLSA-N 1 0 291.288 3.591 20 10 CHCDRO Oc1ccc(C(F)(F)F)cc1C[NH+]1C2CCC1CC2 ZINC001237140310 1131057217 /nfs/dbraw/zinc/05/72/17/1131057217.db2.gz JBNGNIUFCFQRDG-UHFFFAOYSA-N 1 0 271.282 3.538 20 10 CHCDRO CC[C@@H](CC(F)(F)F)[NH2+]Cc1cc(Cl)ccc1O ZINC000760655441 1127147010 /nfs/dbraw/zinc/14/70/10/1127147010.db2.gz YGTQEIQOBNCUFH-JTQLQIEISA-N 1 0 281.705 3.866 20 10 CHCDRO COc1cc(C)cc(C[N@H+](C2CC2)C2CCCC2)c1O ZINC000164001238 1127149082 /nfs/dbraw/zinc/14/90/82/1127149082.db2.gz ZXWAJQUVZRTEJM-UHFFFAOYSA-N 1 0 275.392 3.616 20 10 CHCDRO CC[C@@H](CSC)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000164073656 1127152234 /nfs/dbraw/zinc/15/22/34/1127152234.db2.gz DOLVABUXNKXONV-JSGCOSHPSA-N 1 0 266.454 3.545 20 10 CHCDRO CC[C@H](CSC)[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000164073994 1127152406 /nfs/dbraw/zinc/15/24/06/1127152406.db2.gz DOLVABUXNKXONV-TZMCWYRMSA-N 1 0 266.454 3.545 20 10 CHCDRO COc1cc(C)cc(C[N@@H+]2CC[C@@H](c3ccccc3)C2)c1O ZINC000164226426 1127156848 /nfs/dbraw/zinc/15/68/48/1127156848.db2.gz LCCOBSTXBGEIGD-MRXNPFEDSA-N 1 0 297.398 3.699 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2)c(O)c1 ZINC000284257933 1127178982 /nfs/dbraw/zinc/17/89/82/1127178982.db2.gz WCEBXFCJXXPGHO-OAHLLOKOSA-N 1 0 298.430 3.926 20 10 CHCDRO Cc1nc(CC[NH2+][C@H](C)c2c(C)cc(C)cc2O)cs1 ZINC000284248960 1127179488 /nfs/dbraw/zinc/17/94/88/1127179488.db2.gz VMZKSTSOUIPFIN-GFCCVEGCSA-N 1 0 290.432 3.667 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2CCC[C@H](CF)C2)c1O ZINC001237687528 1131128007 /nfs/dbraw/zinc/12/80/07/1131128007.db2.gz KUHQTJPIAZYQIB-LLVKDONJSA-N 1 0 271.763 3.536 20 10 CHCDRO COCC(C)(C)CCC[NH2+][C@H](C)c1cc(C)ccc1O ZINC000287117235 1127289771 /nfs/dbraw/zinc/28/97/71/1127289771.db2.gz QWVQFGPBGOEFSE-CQSZACIVSA-N 1 0 279.424 3.804 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1ccnn1C(C)C ZINC000355122460 1127318509 /nfs/dbraw/zinc/31/85/09/1127318509.db2.gz MEIWIIBFPHRSJE-UHFFFAOYSA-N 1 0 296.418 3.554 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(F)ccc1O)c1ccccc1OC ZINC000226584464 1127412303 /nfs/dbraw/zinc/41/23/03/1127412303.db2.gz SLQJJROKMVTWJV-HNNXBMFYSA-N 1 0 289.350 3.781 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]Cc1ccc(F)c(Cl)c1 ZINC000226589366 1127412742 /nfs/dbraw/zinc/41/27/42/1127412742.db2.gz AWGGSNHKFUWDTE-UHFFFAOYSA-N 1 0 283.705 3.614 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCCCS1)c1ccc(N(C)C)cc1 ZINC000158084238 1127436752 /nfs/dbraw/zinc/43/67/52/1127436752.db2.gz OKERBGOTDFEXOR-BBRMVZONSA-N 1 0 278.465 3.689 20 10 CHCDRO Cc1cccc(C[NH2+]CC[C@@H](C)c2ccccc2)c1O ZINC000158125238 1127451801 /nfs/dbraw/zinc/45/18/01/1127451801.db2.gz RFVFVBBVXJOALL-CQSZACIVSA-N 1 0 269.388 3.984 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCCC[C@@H]1O)c1ccc2ccccc2c1O ZINC000158227711 1127467741 /nfs/dbraw/zinc/46/77/41/1127467741.db2.gz SOOSBFKSEJGCJB-SIIHOXLZSA-N 1 0 299.414 3.747 20 10 CHCDRO C[C@@H]([NH2+]C1CC=CC1)c1ccc2ccccc2c1O ZINC000168822626 1127471160 /nfs/dbraw/zinc/47/11/60/1127471160.db2.gz CJESZTPGHDJRFQ-GFCCVEGCSA-N 1 0 253.345 3.915 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CC[C@@H]2CCCCO2)cc1 ZINC000227336354 1127471495 /nfs/dbraw/zinc/47/14/95/1127471495.db2.gz MDFZZCJXALLNLV-SFHVURJKSA-N 1 0 290.451 3.582 20 10 CHCDRO Cc1cc(C[NH+]2CCCCC2)c(O)c(C(C)(C)C)c1 ZINC000169435982 1127516951 /nfs/dbraw/zinc/51/69/51/1127516951.db2.gz XNMBWEURMLCRCV-UHFFFAOYSA-N 1 0 261.409 3.984 20 10 CHCDRO CC[N@H+](CCC1CC1)Cc1ccc(N(C)C)c(F)c1 ZINC000761226267 1127552150 /nfs/dbraw/zinc/55/21/50/1127552150.db2.gz NPHXMHTUPHSJRT-UHFFFAOYSA-N 1 0 264.388 3.514 20 10 CHCDRO CC[C@@H](CC(F)(F)F)[NH2+]Cc1cccc(Cl)c1[O-] ZINC000761228188 1127553327 /nfs/dbraw/zinc/55/33/27/1127553327.db2.gz JDUZUMMXWLOPBW-VIFPVBQESA-N 1 0 281.705 3.866 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+][C@@H](C)CCC(C)C)c1O ZINC000228668980 1127583016 /nfs/dbraw/zinc/58/30/16/1127583016.db2.gz OGGFJBSBRBFROU-NSHDSACASA-N 1 0 285.815 3.969 20 10 CHCDRO CCC1(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)CCOCC1 ZINC000294558957 1127583112 /nfs/dbraw/zinc/58/31/12/1127583112.db2.gz BHCNDNXCBGBJAI-HNNXBMFYSA-N 1 0 291.435 3.866 20 10 CHCDRO Cc1cc(C[NH2+]Cc2ccc(N(C)C)c(F)c2)cs1 ZINC000294949267 1127610262 /nfs/dbraw/zinc/61/02/62/1127610262.db2.gz FFWFYPBWHYGWPX-UHFFFAOYSA-N 1 0 278.396 3.551 20 10 CHCDRO Cc1csc([C@H](C)C[NH2+][C@H]2CCc3cccc(O)c32)n1 ZINC000295783845 1127652646 /nfs/dbraw/zinc/65/26/46/1127652646.db2.gz ADELAVWGYDJSFU-MFKMUULPSA-N 1 0 288.416 3.538 20 10 CHCDRO COc1cc(O)c(C[N@H+](C)C[C@H]2CC2(C)C)cc1Cl ZINC001232270083 1127653632 /nfs/dbraw/zinc/65/36/32/1127653632.db2.gz SMNDOAHVNJXPEE-LLVKDONJSA-N 1 0 283.799 3.532 20 10 CHCDRO Cc1ccc(C[NH2+][C@H]2CCc3cccc(O)c32)c(C)c1 ZINC000296129256 1127663307 /nfs/dbraw/zinc/66/33/07/1127663307.db2.gz VQLYDEIKDWQHOY-INIZCTEOSA-N 1 0 267.372 3.786 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]C[C@H]1CCCC(F)(F)C1)CC2 ZINC000296423004 1127671590 /nfs/dbraw/zinc/67/15/90/1127671590.db2.gz LNVKOIUQONEBCY-WCQYABFASA-N 1 0 281.346 3.795 20 10 CHCDRO CCO[C@@H](C[NH2+][C@@H]1CCc2cccc(O)c21)c1ccccc1 ZINC000296584082 1127677038 /nfs/dbraw/zinc/67/70/38/1127677038.db2.gz WGSHXXYLUKZNAW-AEFFLSMTSA-N 1 0 297.398 3.747 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CCC(C)(F)F)c(O)c1 ZINC000297416360 1127696313 /nfs/dbraw/zinc/69/63/13/1127696313.db2.gz UJFMVGCWFHISAV-LLVKDONJSA-N 1 0 257.324 3.705 20 10 CHCDRO CCc1nc([C@@H](C)[NH2+][C@@H]2CCc3cccc(O)c32)cs1 ZINC000297685648 1127704092 /nfs/dbraw/zinc/70/40/92/1127704092.db2.gz LRZHDEFSDRJAPV-ZYHUDNBSSA-N 1 0 288.416 3.749 20 10 CHCDRO CSCCCCCC[NH2+]Cc1ccc2c(c1)CCO2 ZINC000230148688 1127743830 /nfs/dbraw/zinc/74/38/30/1127743830.db2.gz GOLZPCFJLKIPJX-UHFFFAOYSA-N 1 0 279.449 3.635 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]C[C@@H]2CC[C@H](C)C2)c1O ZINC000230407286 1127751906 /nfs/dbraw/zinc/75/19/06/1127751906.db2.gz FTIURANCXNKSLK-WDEREUQCSA-N 1 0 283.799 3.580 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]C[C@H]2CCC[C@@H]2C)c1O ZINC000230659102 1127771765 /nfs/dbraw/zinc/77/17/65/1127771765.db2.gz KPIBWMDBRLKETC-WDEREUQCSA-N 1 0 283.799 3.580 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[NH2+]CCCC1CC1 ZINC000134869041 1127964888 /nfs/dbraw/zinc/96/48/88/1127964888.db2.gz PVQUJXAECPEXJV-UHFFFAOYSA-N 1 0 258.409 3.567 20 10 CHCDRO Clc1sccc1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000312757230 1128088873 /nfs/dbraw/zinc/08/88/73/1128088873.db2.gz QTQSVGDFHPQXPN-UHFFFAOYSA-N 1 0 279.792 3.626 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)[C@H]1CCc2cc(F)ccc2C1 ZINC001168444771 1128099551 /nfs/dbraw/zinc/09/95/51/1128099551.db2.gz GYFSEHOZROBKMK-SFHVURJKSA-N 1 0 299.389 3.911 20 10 CHCDRO CCC[C@@H]1C[N@H+](Cc2c(O)ccc3ccccc32)CCO1 ZINC000152486344 1128128381 /nfs/dbraw/zinc/12/83/81/1128128381.db2.gz YBWVWEUMHDGABE-OAHLLOKOSA-N 1 0 285.387 3.546 20 10 CHCDRO C[C@H](Cc1cccc(F)c1)[NH2+][C@@H](C)c1ccccc1O ZINC001168459208 1128141900 /nfs/dbraw/zinc/14/19/00/1128141900.db2.gz KUPXSGFSYWBVGU-OLZOCXBDSA-N 1 0 273.351 3.813 20 10 CHCDRO Cc1ccccc1[C@@H](C)[NH2+]Cc1cc(F)ccc1O ZINC000226582435 1128196052 /nfs/dbraw/zinc/19/60/52/1128196052.db2.gz XSFQXFKCCVWCSD-GFCCVEGCSA-N 1 0 259.324 3.691 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc3c(c2)C[C@H](C)O3)c(O)c1 ZINC000926917656 1128202466 /nfs/dbraw/zinc/20/24/66/1128202466.db2.gz CQNDVIYWGSNZDO-KBPBESRZSA-N 1 0 297.398 3.875 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc3c(c2)C[C@@H](C)O3)c(O)c1 ZINC000926917657 1128202759 /nfs/dbraw/zinc/20/27/59/1128202759.db2.gz CQNDVIYWGSNZDO-KGLIPLIRSA-N 1 0 297.398 3.875 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCS[C@H](C)C2)c(O)c1C ZINC000927030368 1128209829 /nfs/dbraw/zinc/20/98/29/1128209829.db2.gz ICTRDBMQYNTQAK-KWCYVHTRSA-N 1 0 279.449 3.944 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCCc2cccnc21)c1ccccc1O ZINC000927059714 1128212360 /nfs/dbraw/zinc/21/23/60/1128212360.db2.gz LNEUGJUJQYVZDS-SWLSCSKDSA-N 1 0 268.360 3.515 20 10 CHCDRO CC[C@H]([NH2+]Cc1cccc2c1OCC2)c1ccc(C)cc1O ZINC000927089507 1128216494 /nfs/dbraw/zinc/21/64/94/1128216494.db2.gz CAGXEMUAXSNVGQ-KRWDZBQOSA-N 1 0 297.398 3.876 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2CC(C)(C)OC2(C)C)c1 ZINC000927099172 1128217323 /nfs/dbraw/zinc/21/73/23/1128217323.db2.gz ARHJSROEALQHRU-KGLIPLIRSA-N 1 0 291.435 3.945 20 10 CHCDRO C[C@@H]([NH2+]C[C@@]1(c2ccccc2)CCCO1)c1ccccc1O ZINC000927114176 1128218928 /nfs/dbraw/zinc/21/89/28/1128218928.db2.gz CSSUIOCKCLRWKO-DNVCBOLYSA-N 1 0 297.398 3.749 20 10 CHCDRO CCC[N@H+](Cc1ccccc1O)[C@H](C)c1ccc(F)nc1 ZINC000929753431 1128285359 /nfs/dbraw/zinc/28/53/59/1128285359.db2.gz QAAHBQVOGLGJCX-CYBMUJFWSA-N 1 0 288.366 3.900 20 10 CHCDRO Cc1c(C[N@@H+]2CCCC23CC3)c2ccccc2n1C ZINC001138252762 1128285450 /nfs/dbraw/zinc/28/54/50/1128285450.db2.gz TUCYMURSHBWERR-UHFFFAOYSA-N 1 0 254.377 3.615 20 10 CHCDRO CC[C@H]1CCC[N@H+](Cc2c(O)ccc3ccncc32)C1 ZINC000915208577 1128291927 /nfs/dbraw/zinc/29/19/27/1128291927.db2.gz GOLSUYJPLQIYRC-ZDUSSCGKSA-N 1 0 270.376 3.562 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C2Cc3ccccc3C2)c(O)c1C ZINC000762781909 1128318122 /nfs/dbraw/zinc/31/81/22/1128318122.db2.gz SPLLUMHBLKRBDM-AWEZNQCLSA-N 1 0 281.399 3.827 20 10 CHCDRO COCC[N@H+](Cc1ccccc1)Cc1cc(C)c(C)cc1O ZINC000915807393 1128340396 /nfs/dbraw/zinc/34/03/96/1128340396.db2.gz AFHMHKPIJRZJAX-UHFFFAOYSA-N 1 0 299.414 3.658 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCOC(C)(C)[C@@H]2C)cc1C(C)C ZINC000763212649 1128377710 /nfs/dbraw/zinc/37/77/10/1128377710.db2.gz OYUPSQUNYQTDLC-AWEZNQCLSA-N 1 0 291.435 3.823 20 10 CHCDRO Cc1cc(C[N@@H+]2CCCSCC2)c(O)c(C(C)(C)C)c1 ZINC000917464539 1128500975 /nfs/dbraw/zinc/50/09/75/1128500975.db2.gz IOGKPCDWWBSXDS-UHFFFAOYSA-N 1 0 293.476 3.937 20 10 CHCDRO CC[N@H+](Cc1cccs1)Cc1cc(C)cc(OC)c1O ZINC000918065098 1128532757 /nfs/dbraw/zinc/53/27/57/1128532757.db2.gz MKDLIWWUVUIFRU-UHFFFAOYSA-N 1 0 291.416 3.793 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C2(C)CCCC2)cc1 ZINC000042176696 1128567899 /nfs/dbraw/zinc/56/78/99/1128567899.db2.gz KQSAGPVYZDDSDY-UHFFFAOYSA-N 1 0 260.425 3.955 20 10 CHCDRO C[C@H]1CCCC[C@H]1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000042859554 1128587580 /nfs/dbraw/zinc/58/75/80/1128587580.db2.gz PREOXHAETZUGAC-BBRMVZONSA-N 1 0 259.393 3.537 20 10 CHCDRO CC[C@H]([NH2+]CCc1cccc(OC)c1)c1ccccc1O ZINC000155180036 1128663905 /nfs/dbraw/zinc/66/39/05/1128663905.db2.gz IYYQJDCPQVFVJW-KRWDZBQOSA-N 1 0 285.387 3.684 20 10 CHCDRO C[C@H]1C[C@@H](c2ccccc2)C[N@@H+]1Cc1cc(F)ccc1O ZINC000779020258 1128683490 /nfs/dbraw/zinc/68/34/90/1128683490.db2.gz LBGSTMVPFPJIGN-DZGCQCFKSA-N 1 0 285.362 3.909 20 10 CHCDRO CC[C@H]([NH2+]CC(C)(C)C[C@H](C)O)c1ccc(N(C)C)cc1 ZINC000090086220 1128718084 /nfs/dbraw/zinc/71/80/84/1128718084.db2.gz JTDSZYIGUSTHQZ-YOEHRIQHSA-N 1 0 292.467 3.590 20 10 CHCDRO CCOC[C@H](C)[NH2+][C@@H](CC)c1cc(Cl)ccc1O ZINC000779073525 1128719551 /nfs/dbraw/zinc/71/95/51/1128719551.db2.gz OONDIPVSRGWBEX-GWCFXTLKSA-N 1 0 271.788 3.511 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1CCC(C)(C)O1)c1ccc(N(C)C)cc1 ZINC000779079341 1128722837 /nfs/dbraw/zinc/72/28/37/1128722837.db2.gz MPDZXYYLVMQNAM-DLBZAZTESA-N 1 0 290.451 3.751 20 10 CHCDRO CS[C@@H]1CCC[C@H]([NH2+][C@@H](C)c2ccccc2O)C1 ZINC000228793585 1117770585 /nfs/dbraw/zinc/77/05/85/1117770585.db2.gz QKKXJWCLJCVODL-RWMBFGLXSA-N 1 0 265.422 3.717 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H](C2CC2)C2CCC2)c(O)c1 ZINC000325009454 1117782111 /nfs/dbraw/zinc/78/21/11/1117782111.db2.gz CEFXDSTWFCIBTE-SJCJKPOMSA-N 1 0 259.393 3.930 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H](CCO)c2ccccc2)c1 ZINC000185525262 1117836967 /nfs/dbraw/zinc/83/69/67/1117836967.db2.gz VBUMLLWZVWBSRB-WBVHZDCISA-N 1 0 299.414 3.517 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H](CCO)c2ccccc2)c1 ZINC000185525239 1117837861 /nfs/dbraw/zinc/83/78/61/1117837861.db2.gz VBUMLLWZVWBSRB-DOTOQJQBSA-N 1 0 299.414 3.517 20 10 CHCDRO CCc1cnc(CC[NH2+][C@H](C)c2ccc(C)cc2O)s1 ZINC000185583659 1117853027 /nfs/dbraw/zinc/85/30/27/1117853027.db2.gz SLHBXPMPILMVAO-GFCCVEGCSA-N 1 0 290.432 3.613 20 10 CHCDRO CCc1cnc(CC[NH2+][C@@H](C)c2ccc(C)cc2O)s1 ZINC000185583642 1117853119 /nfs/dbraw/zinc/85/31/19/1117853119.db2.gz SLHBXPMPILMVAO-LBPRGKRZSA-N 1 0 290.432 3.613 20 10 CHCDRO CCO[C@@H](CC[NH2+][C@H](C)c1ccc(C)cc1O)C(C)C ZINC000185625698 1117859693 /nfs/dbraw/zinc/85/96/93/1117859693.db2.gz NQLAJFCRNSUABY-PBHICJAKSA-N 1 0 279.424 3.802 20 10 CHCDRO CCS[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(N(C)C)cc1 ZINC000233991375 1117874159 /nfs/dbraw/zinc/87/41/59/1117874159.db2.gz GNJKVTOCQWEYEN-JKSUJKDBSA-N 1 0 278.465 3.516 20 10 CHCDRO CO[C@H](C[NH2+][C@H](C)c1cc(C)ccc1O)C1CCCC1 ZINC000692973472 1117938707 /nfs/dbraw/zinc/93/87/07/1117938707.db2.gz CAGUHXWXGDAEGL-CXAGYDPISA-N 1 0 277.408 3.556 20 10 CHCDRO CO[C@H](C[NH2+][C@@H](C)c1ccc(C)cc1O)C1CCCC1 ZINC000692981382 1117959457 /nfs/dbraw/zinc/95/94/57/1117959457.db2.gz UWAGZFCHNLELHQ-SUMWQHHRSA-N 1 0 277.408 3.556 20 10 CHCDRO C[C@H]1C[N@H+](Cc2ccccc2O)[C@@H]1c1ccccc1 ZINC000179584519 1128748998 /nfs/dbraw/zinc/74/89/98/1128748998.db2.gz DKAZEJLOWUVRGO-GUYCJALGSA-N 1 0 253.345 3.585 20 10 CHCDRO Cc1cccc(C[N@H+](C)Cc2nc3ccccc3s2)c1O ZINC000179610643 1128751106 /nfs/dbraw/zinc/75/11/06/1128751106.db2.gz HHTCFSFFRLVSNI-UHFFFAOYSA-N 1 0 298.411 3.942 20 10 CHCDRO Cc1cccc(C[N@@H+](C)[C@@H](C)c2cccs2)c1O ZINC000179713884 1118051071 /nfs/dbraw/zinc/05/10/71/1118051071.db2.gz LQIBHOVVIBBJKQ-LBPRGKRZSA-N 1 0 261.390 3.955 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2C[C@@H]3CCCC[C@@H]3C2)cc1C ZINC000749977867 1118090646 /nfs/dbraw/zinc/09/06/46/1118090646.db2.gz ROYKLJLNJXCUBR-GASCZTMLSA-N 1 0 259.393 3.631 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CC[C@@](C)(O)c2ccccc2)c1 ZINC000187909996 1128757837 /nfs/dbraw/zinc/75/78/37/1128757837.db2.gz KSEWVJRSUBVAMU-HNAYVOBHSA-N 1 0 299.414 3.649 20 10 CHCDRO COC[C@H](C)[NH2+]Cc1ccc(N(C)C2CCCCC2)cc1 ZINC000765445122 1118152203 /nfs/dbraw/zinc/15/22/03/1118152203.db2.gz KUCKTYCVNBMTSN-HNNXBMFYSA-N 1 0 290.451 3.580 20 10 CHCDRO CO[C@H](C)C[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000188127955 1128760021 /nfs/dbraw/zinc/76/00/21/1128760021.db2.gz YGLUGWNKOJFBIY-ZIAGYGMSSA-N 1 0 294.414 3.502 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]Cc1ccc(F)c(F)c1 ZINC000083552206 1118169744 /nfs/dbraw/zinc/16/97/44/1118169744.db2.gz VSMKBYWAGPHMSO-UHFFFAOYSA-N 1 0 283.705 3.614 20 10 CHCDRO c1cc2c(o1)CCC[C@H]2[NH2+]Cc1ccc2c(c1)CCCO2 ZINC000921527878 1118171117 /nfs/dbraw/zinc/17/11/17/1118171117.db2.gz PIRKSYIWXLBBHH-MRXNPFEDSA-N 1 0 283.371 3.772 20 10 CHCDRO C[C@H]([NH2+]CCc1ccccc1Cl)c1ccccc1O ZINC000179891316 1128764148 /nfs/dbraw/zinc/76/41/48/1128764148.db2.gz LYIWYJVSERZDHE-LBPRGKRZSA-N 1 0 275.779 3.939 20 10 CHCDRO Cc1cccc(C[N@@H+](Cc2cccc(O)c2)CC2CC2)c1O ZINC000179917568 1128766304 /nfs/dbraw/zinc/76/63/04/1128766304.db2.gz NKICMBIRNKNLCL-UHFFFAOYSA-N 1 0 297.398 3.818 20 10 CHCDRO CC[N@H+](Cc1cc(F)ccc1O)[C@@H](C)c1ccc(C#N)cc1 ZINC000179937322 1128766968 /nfs/dbraw/zinc/76/69/68/1128766968.db2.gz MAJFWUUSHKCKJV-ZDUSSCGKSA-N 1 0 298.361 3.986 20 10 CHCDRO Cc1ccoc1C[NH2+]Cc1c(C)c2ccccc2n1C ZINC000312665403 1118355357 /nfs/dbraw/zinc/35/53/57/1118355357.db2.gz IDTLGDVRQDWWIB-UHFFFAOYSA-N 1 0 268.360 3.678 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]CCc1ccccc1F ZINC000083551452 1118356307 /nfs/dbraw/zinc/35/63/07/1118356307.db2.gz LMJBUDMNGAMHMU-UHFFFAOYSA-N 1 0 279.742 3.517 20 10 CHCDRO Cc1cccc(C[N@H+]2C[C@@H](c3ccccc3)OC[C@@H]2C)c1O ZINC000180021712 1128772652 /nfs/dbraw/zinc/77/26/52/1128772652.db2.gz LVPSTXSRHAIHQG-YJBOKZPZSA-N 1 0 297.398 3.663 20 10 CHCDRO Cc1cc(C)cc(C[NH2+]Cc2ccc3c(c2)CCO3)c1 ZINC000693193211 1118368537 /nfs/dbraw/zinc/36/85/37/1118368537.db2.gz MKYXPNMUXKBJSL-UHFFFAOYSA-N 1 0 267.372 3.528 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CC(C)(C)OC1(C)C)c1ccc(N(C)C)cc1 ZINC000779175480 1128774815 /nfs/dbraw/zinc/77/48/15/1128774815.db2.gz IDKXZDQFJBWRET-CZUORRHYSA-N 1 0 290.451 3.749 20 10 CHCDRO CCc1ccccc1C[NH2+]Cc1c(O)cccc1Cl ZINC000086485750 1118440516 /nfs/dbraw/zinc/44/05/16/1118440516.db2.gz VBWGNTZTGYOBDJ-UHFFFAOYSA-N 1 0 275.779 3.898 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CC2(C)CCC2)c(Cl)c1 ZINC001656651652 1118448251 /nfs/dbraw/zinc/44/82/51/1118448251.db2.gz AAVWMYBPIHNLQU-UHFFFAOYSA-N 1 0 253.773 3.634 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2CCC[C@H](C)CC2)cc1Cl ZINC001658348086 1118466898 /nfs/dbraw/zinc/46/68/98/1118466898.db2.gz JDDGBMSAIQDRTO-NSHDSACASA-N 1 0 267.800 3.976 20 10 CHCDRO Cc1cc(C[N@@H+](C)Cc2ccccc2O)cc(C)c1F ZINC001143381711 1118516440 /nfs/dbraw/zinc/51/64/40/1118516440.db2.gz LNEZDFZIDHACAZ-UHFFFAOYSA-N 1 0 273.351 3.780 20 10 CHCDRO C[C@@H]1CCC[C@H]1C[NH2+]Cc1c(O)cccc1Br ZINC000706847063 1118552903 /nfs/dbraw/zinc/55/29/03/1118552903.db2.gz VFDUJDUGCHTQQM-MNOVXSKESA-N 1 0 298.224 3.681 20 10 CHCDRO CCOc1cccc(C[NH2+][C@H]2CCC[C@@H](CC)C2)c1O ZINC000068591615 1128786708 /nfs/dbraw/zinc/78/67/08/1128786708.db2.gz WZWVJHAGXZYZOW-HIFRSBDPSA-N 1 0 277.408 3.849 20 10 CHCDRO CCc1cccc(C[NH2+][C@H](C)c2cc(OC)ccc2O)c1 ZINC000189844291 1128786899 /nfs/dbraw/zinc/78/68/99/1128786899.db2.gz YPJTVFOYQMYZQW-CYBMUJFWSA-N 1 0 285.387 3.814 20 10 CHCDRO Cc1noc(C)c1[C@@H](C)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000092326523 1118583135 /nfs/dbraw/zinc/58/31/35/1118583135.db2.gz BSWCWBDLNCUZCB-NWDGAFQWSA-N 1 0 287.407 3.769 20 10 CHCDRO C[C@@H]1CCCC[C@@H]1C[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000109935207 1118591185 /nfs/dbraw/zinc/59/11/85/1118591185.db2.gz NTBABMMAXOTFEX-CRAIPNDOSA-N 1 0 286.463 3.985 20 10 CHCDRO CC(C)[C@H]1CCC[N@@H+]1Cc1c(O)cccc1Br ZINC000707152890 1118651258 /nfs/dbraw/zinc/65/12/58/1118651258.db2.gz QTVQNQMVRDTYLH-CYBMUJFWSA-N 1 0 298.224 3.775 20 10 CHCDRO Oc1cc(Cl)ccc1C[N@@H+]1CC[C@@H](F)C(F)(F)CC1 ZINC001140461940 1118720528 /nfs/dbraw/zinc/72/05/28/1118720528.db2.gz ZKRCTTXQIJYXMN-GFCCVEGCSA-N 1 0 293.716 3.615 20 10 CHCDRO C[N@H+](Cc1ccc(Cl)nc1)Cc1ccc(Cl)cc1O ZINC001140464851 1118737945 /nfs/dbraw/zinc/73/79/45/1118737945.db2.gz CLXXFSCBWZQUGK-UHFFFAOYSA-N 1 0 297.185 3.726 20 10 CHCDRO CCC[N@@H+](Cc1ccccc1O)Cc1cnc(F)cc1C ZINC000891853468 1118803476 /nfs/dbraw/zinc/80/34/76/1118803476.db2.gz NVZQKAIZCAYSSX-UHFFFAOYSA-N 1 0 288.366 3.647 20 10 CHCDRO Cc1cscc1C[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000094877274 1118884175 /nfs/dbraw/zinc/88/41/75/1118884175.db2.gz PYAPLTGJDVVHHH-LBPRGKRZSA-N 1 0 261.390 3.921 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1ccccc1O)c1ccncc1 ZINC000183529163 1118983010 /nfs/dbraw/zinc/98/30/10/1118983010.db2.gz ZHMKWWMJOQPOBC-DOMZBBRYSA-N 1 0 256.349 3.589 20 10 CHCDRO Cc1cc(C[NH2+][C@@H](C)c2ccc3ccccc3c2O)on1 ZINC000044985720 1119063041 /nfs/dbraw/zinc/06/30/41/1119063041.db2.gz CJNNYAONFGXTLM-LBPRGKRZSA-N 1 0 282.343 3.693 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc(OC)ccc1O)c1ccccc1F ZINC000180900470 1128819136 /nfs/dbraw/zinc/81/91/36/1128819136.db2.gz NQFKHELCIKWRIC-MRXNPFEDSA-N 1 0 289.350 3.781 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)Cc2ccsc2)cc1C ZINC000048557103 1119081295 /nfs/dbraw/zinc/08/12/95/1119081295.db2.gz GOHCXKKGGVBKSL-ZDUSSCGKSA-N 1 0 275.417 3.786 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCC[C@H]3CCCC[C@H]32)c1O ZINC000226156910 1119103216 /nfs/dbraw/zinc/10/32/16/1119103216.db2.gz WOELZBHZECEGOB-GDBMZVCRSA-N 1 0 289.419 3.946 20 10 CHCDRO CCCC1CC[NH+](Cc2cc(F)ccc2O)CC1 ZINC000226563847 1119157858 /nfs/dbraw/zinc/15/78/58/1119157858.db2.gz CAETXRAESKVQSC-UHFFFAOYSA-N 1 0 251.345 3.543 20 10 CHCDRO CC[C@@H]1CCCC[C@H]1[NH2+]Cc1cc(F)ccc1O ZINC000226584026 1119212833 /nfs/dbraw/zinc/21/28/33/1119212833.db2.gz DIAJHERTUMQGHO-BXUZGUMPSA-N 1 0 251.345 3.590 20 10 CHCDRO CC[C@H]([NH2+]CCCC(F)(F)F)c1ccccc1O ZINC000148647559 1119375712 /nfs/dbraw/zinc/37/57/12/1119375712.db2.gz OVANGZRELOZRBI-NSHDSACASA-N 1 0 261.287 3.775 20 10 CHCDRO CCOCC[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000161894959 1119419227 /nfs/dbraw/zinc/41/92/27/1119419227.db2.gz QHRMMFWHCHQZFM-CQSZACIVSA-N 1 0 294.414 3.503 20 10 CHCDRO C[C@@H]([NH2+]Cc1cc(F)cc(F)c1[O-])c1ccsc1 ZINC000708453145 1119467040 /nfs/dbraw/zinc/46/70/40/1119467040.db2.gz DCTRSGPAMAODKR-MRVPVSSYSA-N 1 0 269.316 3.583 20 10 CHCDRO CSC[C@H](C)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000168786770 1119477874 /nfs/dbraw/zinc/47/78/74/1119477874.db2.gz NRIBYLOGNHYPPK-NWDGAFQWSA-N 1 0 275.417 3.948 20 10 CHCDRO COc1ccccc1C[N@H+](Cc1ccccc1O)C1CC1 ZINC000179556820 1119751409 /nfs/dbraw/zinc/75/14/09/1119751409.db2.gz WONKQPBQWZWQIH-UHFFFAOYSA-N 1 0 283.371 3.565 20 10 CHCDRO C[N@H+](Cc1ccccc1O)Cc1ccc(Cl)cc1F ZINC000179571230 1119751786 /nfs/dbraw/zinc/75/17/86/1119751786.db2.gz GBIKCSGGXFZCBK-UHFFFAOYSA-N 1 0 279.742 3.817 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C[C@@H]2CCCCC2(F)F)c1 ZINC000295077241 1119850027 /nfs/dbraw/zinc/85/00/27/1119850027.db2.gz HWNLHXFTSXPNFY-ZDUSSCGKSA-N 1 0 269.335 3.616 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccoc1 ZINC000178192033 1119944437 /nfs/dbraw/zinc/94/44/37/1119944437.db2.gz NGCHYDZXMLZQRI-CYBMUJFWSA-N 1 0 270.376 3.513 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCCC(F)(F)C2)c1 ZINC000695123544 1120109987 /nfs/dbraw/zinc/10/99/87/1120109987.db2.gz AQDYMSVPNLJKLS-NEPJUHHUSA-N 1 0 269.335 3.929 20 10 CHCDRO Cc1ccc(C[C@@H](C)[NH2+]Cc2cc(C)ccc2O)s1 ZINC000078003633 1128891016 /nfs/dbraw/zinc/89/10/16/1128891016.db2.gz SRGIHECPVWLVJO-GFCCVEGCSA-N 1 0 275.417 3.791 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2ncccc2c1)c1ccccc1O ZINC000186462886 1120204317 /nfs/dbraw/zinc/20/43/17/1120204317.db2.gz YOVIRVBKVXFVSK-CYBMUJFWSA-N 1 0 278.355 3.791 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@@H]1CCc3ccccc3C1)CC2 ZINC000314450195 1120210648 /nfs/dbraw/zinc/21/06/48/1120210648.db2.gz DOEXVVPKXARMAS-SJORKVTESA-N 1 0 279.383 3.527 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(C)c(C)c2)c1 ZINC000191031879 1128899810 /nfs/dbraw/zinc/89/98/10/1128899810.db2.gz MIWAKFKYOCVLTC-CQSZACIVSA-N 1 0 285.387 3.868 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H]2CC(C)(C)OC2(C)C)c1 ZINC000186499713 1120241149 /nfs/dbraw/zinc/24/11/49/1120241149.db2.gz SLPAYZGDKRJZJA-DOMZBBRYSA-N 1 0 277.408 3.697 20 10 CHCDRO Oc1ccccc1C[N@H+](Cc1cccs1)C1CC1 ZINC000179556853 1120249922 /nfs/dbraw/zinc/24/99/22/1120249922.db2.gz GYEVPEWHWUWEDZ-UHFFFAOYSA-N 1 0 259.374 3.618 20 10 CHCDRO CC[C@@H](C)[C@@](C)(O)C[NH2+][C@@H](CC)c1ccc(N(C)C)cc1 ZINC000765948070 1120251231 /nfs/dbraw/zinc/25/12/31/1120251231.db2.gz YYNMJNQNKMWUPJ-JLSDUUJJSA-N 1 0 292.467 3.590 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)Cc1ccco1)c1cc(Cl)ccc1O ZINC000756379507 1120283196 /nfs/dbraw/zinc/28/31/96/1120283196.db2.gz OFPDAJWYSZWWIE-WDEREUQCSA-N 1 0 279.767 3.920 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCCC[C@H]2C(C)C)c1O ZINC000395873720 1120302720 /nfs/dbraw/zinc/30/27/20/1120302720.db2.gz ZUTNQXIIZLDZEO-HNNXBMFYSA-N 1 0 277.408 3.801 20 10 CHCDRO c1c(C[NH+]2CCC3(CC3)CC2)cc2c3c1CCCN3CCC2 ZINC001141075759 1120302961 /nfs/dbraw/zinc/30/29/61/1120302961.db2.gz ZLLZKKYFVMTBTA-UHFFFAOYSA-N 1 0 296.458 3.761 20 10 CHCDRO CC[C@H]([NH2+]CC1CCSCC1)c1ccc(N(C)C)cc1 ZINC000765962235 1120304812 /nfs/dbraw/zinc/30/48/12/1120304812.db2.gz TVXFCWWBYISKIW-KRWDZBQOSA-N 1 0 292.492 3.937 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]CCc2ccc(C)cc2)c1 ZINC000182334552 1120318258 /nfs/dbraw/zinc/31/82/58/1120318258.db2.gz UOXONQRKALSAQM-AWEZNQCLSA-N 1 0 285.387 3.603 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2c(F)cccc2F)c1 ZINC000182803020 1120329458 /nfs/dbraw/zinc/32/94/58/1120329458.db2.gz OCHOZNTWHRZHEE-JTQLQIEISA-N 1 0 293.313 3.530 20 10 CHCDRO Cc1noc(C)c1[C@@H](C)[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000092327740 1120357209 /nfs/dbraw/zinc/35/72/09/1120357209.db2.gz GBFHXWGIOKBZDM-WDEREUQCSA-N 1 0 274.364 3.717 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCSC(F)(F)F)c1 ZINC000185086308 1120370705 /nfs/dbraw/zinc/37/07/05/1120370705.db2.gz ZHGBBUGGGDSHDN-VIFPVBQESA-N 1 0 279.327 3.604 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+]CCOC2CCCC2)c2c1c(F)ccc2O ZINC000756491569 1120382836 /nfs/dbraw/zinc/38/28/36/1120382836.db2.gz VXBSYPOTCMNUQN-RISCZKNCSA-N 1 0 293.382 3.628 20 10 CHCDRO CC[C@H]([NH2+]CC1(OC)CCCCC1)c1ccccc1O ZINC000186505228 1120400074 /nfs/dbraw/zinc/40/00/74/1120400074.db2.gz SCTRNBGTYNCOLP-HNNXBMFYSA-N 1 0 277.408 3.782 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H](C)c2ccccn2)c1 ZINC000692689434 1120488695 /nfs/dbraw/zinc/48/86/95/1120488695.db2.gz GAFSRQYFOLSKLJ-ZIAGYGMSSA-N 1 0 270.376 3.550 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)[C@H]1CC1(C)C ZINC000397748137 1120516055 /nfs/dbraw/zinc/51/60/55/1120516055.db2.gz IVTZVAFYAPOCMC-RHSMWYFYSA-N 1 0 272.436 3.811 20 10 CHCDRO C[C@H]1CC[N@H+](Cc2c(O)ccc3ccccc32)CCS1 ZINC000191666181 1120525619 /nfs/dbraw/zinc/52/56/19/1120525619.db2.gz NVIOGKCEZQTWRY-ZDUSSCGKSA-N 1 0 287.428 3.873 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(C)cc2)c1 ZINC000019962557 1120553116 /nfs/dbraw/zinc/55/31/16/1120553116.db2.gz ZTFOGAHOYMCLAD-ZDUSSCGKSA-N 1 0 271.360 3.560 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H](C)c2ccc(F)cc2C)c1 ZINC000922666776 1120575636 /nfs/dbraw/zinc/57/56/36/1120575636.db2.gz DCUFOOPYNXKYPF-ZDUSSCGKSA-N 1 0 273.351 3.999 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)c2ccc(C)cc2O)cc1 ZINC000020092185 1120582844 /nfs/dbraw/zinc/58/28/44/1120582844.db2.gz FOWNIFNSHZENLO-CQSZACIVSA-N 1 0 255.361 3.860 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2ncccc2c1)c1cc(F)ccc1O ZINC000195148498 1120615697 /nfs/dbraw/zinc/61/56/97/1120615697.db2.gz WSEFSIDWPWCLSZ-GFCCVEGCSA-N 1 0 296.345 3.930 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C(C)C)C1CC1 ZINC000766030737 1120673967 /nfs/dbraw/zinc/67/39/67/1120673967.db2.gz WVVIKXUQOJHMKC-QGZVFWFLSA-N 1 0 260.425 3.585 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)Cc1ccsc1 ZINC000766028884 1120674140 /nfs/dbraw/zinc/67/41/40/1120674140.db2.gz IHYOIUHHZPQBTD-CQSZACIVSA-N 1 0 288.460 3.843 20 10 CHCDRO CCCC[N@H+](Cc1ncc(C)s1)Cc1ccccc1O ZINC000282463694 1120690946 /nfs/dbraw/zinc/69/09/46/1120690946.db2.gz NCWLCDXRRFCCIH-UHFFFAOYSA-N 1 0 290.432 3.959 20 10 CHCDRO C[C@H](C[NH2+][C@@H]1CCc2cccc(O)c21)c1ccccc1 ZINC000313529981 1120748031 /nfs/dbraw/zinc/74/80/31/1120748031.db2.gz MUEQEGMRLKXXDB-CZUORRHYSA-N 1 0 267.372 3.773 20 10 CHCDRO Cc1cccc(C[NH2+]CCCc2c[nH]c3ccccc23)c1O ZINC000182190693 1128939961 /nfs/dbraw/zinc/93/99/61/1128939961.db2.gz KIJANLNNOOJESI-UHFFFAOYSA-N 1 0 294.398 3.904 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CC[C@H](C)C[C@@H]2C)cc1C ZINC000070111893 1128941740 /nfs/dbraw/zinc/94/17/40/1128941740.db2.gz ATWBKMRBXNDJMR-HEHGZKQESA-N 1 0 261.409 3.918 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](c2cccnc2)C2CC2)c1 ZINC000756782556 1120838228 /nfs/dbraw/zinc/83/82/28/1120838228.db2.gz CDXNMMGDYIMPFR-SCLBCKFNSA-N 1 0 282.387 3.898 20 10 CHCDRO CCOCCCC[NH2+][C@H](C)c1ccc(N(C)CC)cc1 ZINC000165094564 1120904838 /nfs/dbraw/zinc/90/48/38/1120904838.db2.gz JMFJBGVUKZJWRW-OAHLLOKOSA-N 1 0 278.440 3.610 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCC[C@H](O)C1)c1ccc2ccccc2c1O ZINC000185538691 1120912143 /nfs/dbraw/zinc/91/21/43/1120912143.db2.gz GLQRBBFBPZODTN-DZKIICNBSA-N 1 0 299.414 3.747 20 10 CHCDRO C[C@@H](Cc1ccccc1F)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000162915406 1120947335 /nfs/dbraw/zinc/94/73/35/1120947335.db2.gz PNMGCFSHSPNQKU-AWEZNQCLSA-N 1 0 286.394 3.613 20 10 CHCDRO Cc1cccc(OCC[NH2+][C@@H](C)c2ccc(N(C)C)cc2)c1 ZINC000314905401 1120978755 /nfs/dbraw/zinc/97/87/55/1120978755.db2.gz CUAOWXYFFLSDJU-INIZCTEOSA-N 1 0 298.430 3.791 20 10 CHCDRO CCOc1cccc(CNc2cccc3ccncc32)c1O ZINC000317034967 1120985582 /nfs/dbraw/zinc/98/55/82/1120985582.db2.gz XQZCSBZEJPTIKE-UHFFFAOYSA-N 1 0 294.354 3.951 20 10 CHCDRO Cc1cc(C[NH2+][C@@H](C)[C@H]2CCOC2)c(C)n1-c1ccccc1 ZINC000317698840 1121036381 /nfs/dbraw/zinc/03/63/81/1121036381.db2.gz HAEVCOFHHRGQQP-RDJZCZTQSA-N 1 0 298.430 3.609 20 10 CHCDRO CCc1cnccc1[C@H](C)[NH2+]Cc1cc(C)ccc1O ZINC000773426867 1121095182 /nfs/dbraw/zinc/09/51/82/1121095182.db2.gz HUQLTMOWQLEVRD-ZDUSSCGKSA-N 1 0 270.376 3.509 20 10 CHCDRO CCSC1(C[NH2+][C@H](C)c2ccc(C)cc2O)CC1 ZINC000700815783 1121122837 /nfs/dbraw/zinc/12/28/37/1121122837.db2.gz FLBPMLJRCRPDPF-GFCCVEGCSA-N 1 0 265.422 3.637 20 10 CHCDRO C[C@@H]([NH2+]CCCSc1nccs1)[C@H]1CC1(C)C ZINC000785473297 1121157332 /nfs/dbraw/zinc/15/73/32/1121157332.db2.gz MDNXTXOIWOGIJW-GHMZBOCLSA-N 1 0 270.467 3.650 20 10 CHCDRO Cc1cc(C[NH2+]CC[C@@H]2CCOC2)c(C)n1-c1ccccc1 ZINC000318836997 1121160054 /nfs/dbraw/zinc/16/00/54/1121160054.db2.gz LYOUJJIEEUBLMY-QGZVFWFLSA-N 1 0 298.430 3.610 20 10 CHCDRO CCCC[C@@H](COC)[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000766076214 1121183981 /nfs/dbraw/zinc/18/39/81/1121183981.db2.gz QMGLLLDIHGIBCN-ZBFHGGJFSA-N 1 0 278.440 3.608 20 10 CHCDRO Cc1cccc2c(CC[NH2+]Cc3cccc(C)c3O)c[nH]c21 ZINC000182420728 1128968826 /nfs/dbraw/zinc/96/88/26/1128968826.db2.gz NBFBMSCOPJKTOV-UHFFFAOYSA-N 1 0 294.398 3.823 20 10 CHCDRO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000066236444 1121203896 /nfs/dbraw/zinc/20/38/96/1121203896.db2.gz MVFGKDCSALDCTP-OAHLLOKOSA-N 1 0 298.430 3.920 20 10 CHCDRO CC(C)O[C@@H]1C[C@H]([NH2+]Cc2cc(Cl)ccc2O)C1(C)C ZINC000766088348 1121207421 /nfs/dbraw/zinc/20/74/21/1121207421.db2.gz HUXADWRRIIUVRI-LSDHHAIUSA-N 1 0 297.826 3.727 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]CCCSCC(C)C)c1 ZINC000182456850 1128971696 /nfs/dbraw/zinc/97/16/96/1128971696.db2.gz QAOBANPNXACKON-ZDUSSCGKSA-N 1 0 297.464 3.831 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCCC12CCOCC2)c1ccccc1O ZINC001175419494 1121316961 /nfs/dbraw/zinc/31/69/61/1121316961.db2.gz VPDFFYVNPNPVEB-HUUCEWRRSA-N 1 0 289.419 3.640 20 10 CHCDRO Oc1ccc(F)c(Cl)c1C[N@@H+]1CC[C@@H]2CCC[C@@H]2C1 ZINC001237123805 1128981818 /nfs/dbraw/zinc/98/18/18/1128981818.db2.gz LGCPLBWEMYMJSA-WDEREUQCSA-N 1 0 283.774 3.807 20 10 CHCDRO C[N@H+](Cc1cc(C(C)(C)C)c[nH]1)Cc1ccccc1O ZINC001249479665 1121384334 /nfs/dbraw/zinc/38/43/34/1121384334.db2.gz MSXGGRPFYRPWLK-UHFFFAOYSA-N 1 0 272.392 3.650 20 10 CHCDRO CCC[C@H](C[NH2+][C@H](C)c1ccc(C)cc1O)OCC ZINC000705319226 1121396657 /nfs/dbraw/zinc/39/66/57/1121396657.db2.gz XMMMDEOIACUOOH-ZIAGYGMSSA-N 1 0 265.397 3.556 20 10 CHCDRO CC[N@H+](Cc1cccc(F)c1)Cc1c([O-])cccc1F ZINC001137839281 1121428051 /nfs/dbraw/zinc/42/80/51/1121428051.db2.gz ZRGYXTGWMSGNET-UHFFFAOYSA-N 1 0 277.314 3.693 20 10 CHCDRO CC(=O)c1cc(Cl)cc(C[N@@H+]2CCC[C@H]2C2CC2)c1O ZINC000706681796 1121434302 /nfs/dbraw/zinc/43/43/02/1121434302.db2.gz XXZJRXPUMCPULN-HNNXBMFYSA-N 1 0 293.794 3.623 20 10 CHCDRO CCCN(Cc1nc(C)c(C)s1)c1ccc(C[NH3+])cc1 ZINC000894044620 1121460621 /nfs/dbraw/zinc/46/06/21/1121460621.db2.gz AXZUNKLZEHMSDB-UHFFFAOYSA-N 1 0 289.448 3.635 20 10 CHCDRO CCOc1cccc(C[NH2+]C2(C)CCC(C)CC2)c1O ZINC000236920609 1121480811 /nfs/dbraw/zinc/48/08/11/1121480811.db2.gz FBAVOQPSTPIPGZ-UHFFFAOYSA-N 1 0 277.408 3.849 20 10 CHCDRO C[C@H]([NH2+]C1CCC(F)(F)CC1)c1ccccc1O ZINC000688455737 1128988067 /nfs/dbraw/zinc/98/80/67/1128988067.db2.gz MPHLIJRSWZVVMP-JTQLQIEISA-N 1 0 255.308 3.621 20 10 CHCDRO COc1cc(C)cc(C[NH2+][C@@H](c2ccccc2)C2CC2)c1O ZINC000894159937 1121677049 /nfs/dbraw/zinc/67/70/49/1121677049.db2.gz HMRCJGYZPOBSCD-SFHVURJKSA-N 1 0 297.398 3.950 20 10 CHCDRO COCC(C)(C)CC[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C ZINC001119066882 1121704539 /nfs/dbraw/zinc/70/45/39/1121704539.db2.gz VCEDWXORHIEGCR-UONOGXRCSA-N 1 0 291.435 3.901 20 10 CHCDRO c1ccc2c(c1)CCC([NH2+]Cc1ccc3c(c1)CCO3)CC2 ZINC001177586841 1121740579 /nfs/dbraw/zinc/74/05/79/1121740579.db2.gz LQEOSZCTSPWWFY-UHFFFAOYSA-N 1 0 293.410 3.659 20 10 CHCDRO CCCC(C)(C)[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC001177683331 1121744541 /nfs/dbraw/zinc/74/45/41/1121744541.db2.gz AWCOKJKFMIBBTH-BQYQJAHWSA-N 1 0 260.425 3.934 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CC[C@@H](C)C2)cc1F ZINC001177795468 1121750684 /nfs/dbraw/zinc/75/06/84/1121750684.db2.gz TWTYXUDSQLRBLS-UKRRQHHQSA-N 1 0 278.415 3.950 20 10 CHCDRO COc1ccc(C[NH2+]C[C@@H]2CSc3ccccc32)cc1C ZINC001178787361 1121815103 /nfs/dbraw/zinc/81/51/03/1121815103.db2.gz RLHDTMMYVFBDQF-OAHLLOKOSA-N 1 0 299.439 3.983 20 10 CHCDRO CC1(C)CCC[C@@H]1C[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001178783682 1121816121 /nfs/dbraw/zinc/81/61/21/1121816121.db2.gz XSOAXVLCACZUCO-MRXNPFEDSA-N 1 0 273.420 3.928 20 10 CHCDRO CCOCC[N@H+](CC)Cc1cc(C(C)C)c(C)cc1O ZINC000730802452 1121827105 /nfs/dbraw/zinc/82/71/05/1121827105.db2.gz XARFUOZTBCDOGR-UHFFFAOYSA-N 1 0 279.424 3.682 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)[C@@H]1CC1(C)C ZINC001178977457 1121831454 /nfs/dbraw/zinc/83/14/54/1121831454.db2.gz MBFUYOIKRYIKOO-WFASDCNBSA-N 1 0 296.405 3.945 20 10 CHCDRO CC[C@@H](Cc1ccc(F)cc1)[NH2+]Cc1ccc2c(c1)CCO2 ZINC001179129367 1121852401 /nfs/dbraw/zinc/85/24/01/1121852401.db2.gz OSKVUSACOGVTLQ-SFHVURJKSA-N 1 0 299.389 3.872 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2ccc(N(C)C)c3ccccc23)[C@@H](C)CO1 ZINC001204240069 1121862611 /nfs/dbraw/zinc/86/26/11/1121862611.db2.gz HEPXDGXAIDIVHG-LSDHHAIUSA-N 1 0 298.430 3.515 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C[C@H]2CCCC23CC3)cc1F ZINC001179304599 1121867351 /nfs/dbraw/zinc/86/73/51/1121867351.db2.gz ONVCSDYWYOAOIM-CQSZACIVSA-N 1 0 276.399 3.562 20 10 CHCDRO Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc3c(c1)CCO3)CC2 ZINC000731452024 1121868916 /nfs/dbraw/zinc/86/89/16/1121868916.db2.gz LSSGUUJGNMRGRB-GOSISDBHSA-N 1 0 279.383 3.707 20 10 CHCDRO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc3c(c1)CCO3)CC2 ZINC000731452025 1121869146 /nfs/dbraw/zinc/86/91/46/1121869146.db2.gz LSSGUUJGNMRGRB-SFHVURJKSA-N 1 0 279.383 3.707 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@]2(C)CC2(C)C)c(Cl)c1 ZINC001179468540 1121880933 /nfs/dbraw/zinc/88/09/33/1121880933.db2.gz GSUDJLAFDCCUON-HNNXBMFYSA-N 1 0 267.800 3.880 20 10 CHCDRO CC(C)OCC[N@H+](Cc1ccccc1O)C1CCCC1 ZINC000731845899 1121886119 /nfs/dbraw/zinc/88/61/19/1121886119.db2.gz MJUZNNHSEPNHGE-UHFFFAOYSA-N 1 0 277.408 3.562 20 10 CHCDRO COc1cc(C)c(C[N@@H+]2Cc3ccccc3C[C@@H]2C)c(O)c1 ZINC001180097112 1121944093 /nfs/dbraw/zinc/94/40/93/1121944093.db2.gz BCOIRQFJNGYORO-AWEZNQCLSA-N 1 0 297.398 3.656 20 10 CHCDRO CC[C@@]1(C)CC[N@H+](Cc2cc(Cl)c(C)cc2O)C1 ZINC001180080804 1121947793 /nfs/dbraw/zinc/94/77/93/1121947793.db2.gz GHGJQUPIQDWOEN-HNNXBMFYSA-N 1 0 267.800 3.976 20 10 CHCDRO CCC[C@@]1(C)CCC[N@H+](Cc2cc(F)ccc2O)C1 ZINC001180203260 1121961898 /nfs/dbraw/zinc/96/18/98/1121961898.db2.gz NRXUDIMJMMRWMR-INIZCTEOSA-N 1 0 265.372 3.934 20 10 CHCDRO C[C@]1(C[NH2+]Cc2cc(-c3ccccc3)ccc2O)CCOC1 ZINC000733328296 1121977752 /nfs/dbraw/zinc/97/77/52/1121977752.db2.gz SSFIYIFNYKBKJS-LJQANCHMSA-N 1 0 297.398 3.575 20 10 CHCDRO Oc1ccc(C[NH+]2CCC(c3cccs3)CC2)c(O)c1 ZINC001204274401 1121995209 /nfs/dbraw/zinc/99/52/09/1121995209.db2.gz ADAZONBHTRAHTK-UHFFFAOYSA-N 1 0 289.400 3.539 20 10 CHCDRO COCCCCC[N@H+](Cc1ccccc1O)C1CCCC1 ZINC000733613414 1122001561 /nfs/dbraw/zinc/00/15/61/1122001561.db2.gz SRVUCYOBXHXPNN-UHFFFAOYSA-N 1 0 291.435 3.954 20 10 CHCDRO CC[C@H]1CC[C@@H](C)[N@@H+]1Cc1ccc(Cl)cc1O ZINC001181543953 1122061179 /nfs/dbraw/zinc/06/11/79/1122061179.db2.gz IYRNOBWGQURMGT-MFKMUULPSA-N 1 0 253.773 3.809 20 10 CHCDRO CO[C@@](C)([C@H](C)[NH2+]Cc1cc(C(C)C)ccc1O)C1CC1 ZINC001182356443 1122147512 /nfs/dbraw/zinc/14/75/12/1122147512.db2.gz KJCTTXRKHKLLCB-UGSOOPFHSA-N 1 0 291.435 3.809 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc2c(n1)CCCC2)c1ccccc1O ZINC000774446011 1122165599 /nfs/dbraw/zinc/16/55/99/1122165599.db2.gz SKLBOFBGCQLPHQ-QGZVFWFLSA-N 1 0 296.414 3.907 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1O ZINC000271700420 1122171414 /nfs/dbraw/zinc/17/14/14/1122171414.db2.gz TZFIFKJABZNANC-NWDGAFQWSA-N 1 0 286.331 3.712 20 10 CHCDRO Oc1cc(Br)ccc1C[N@@H+]1C[C@H]2CCCC[C@H]21 ZINC001182742777 1122187390 /nfs/dbraw/zinc/18/73/90/1122187390.db2.gz JIYQPRRUDFSFDC-ZWNOBZJWSA-N 1 0 296.208 3.529 20 10 CHCDRO CO[C@H](C[NH2+]Cc1ccc(Cl)cc1O)C1CCCCC1 ZINC001183084111 1122203038 /nfs/dbraw/zinc/20/30/38/1122203038.db2.gz KGCCBSPWNREIKO-MRXNPFEDSA-N 1 0 297.826 3.731 20 10 CHCDRO CO[C@@H](C[NH2+]Cc1ccc(Cl)cc1O)C1CCCCC1 ZINC001183084110 1122203381 /nfs/dbraw/zinc/20/33/81/1122203381.db2.gz KGCCBSPWNREIKO-INIZCTEOSA-N 1 0 297.826 3.731 20 10 CHCDRO COc1ccc(O)c(C[NH+]2CC([C@@H]3CCC[C@H](C)C3)C2)c1 ZINC001183442193 1122224122 /nfs/dbraw/zinc/22/41/22/1122224122.db2.gz CTDPVKTWHYGMID-UONOGXRCSA-N 1 0 289.419 3.659 20 10 CHCDRO Cc1ccc(C[NH+]2CC([C@@H]3CCC[C@@H](C)C3)C2)c(O)c1 ZINC001183441909 1122224191 /nfs/dbraw/zinc/22/41/91/1122224191.db2.gz BDDMGHRZCZOZPG-UKRRQHHQSA-N 1 0 273.420 3.959 20 10 CHCDRO Cc1nc(CC[NH2+][C@H](C)c2ccc(C)c(C)c2O)cs1 ZINC000273298338 1122226335 /nfs/dbraw/zinc/22/63/35/1122226335.db2.gz APXBISRNYGUTMK-GFCCVEGCSA-N 1 0 290.432 3.667 20 10 CHCDRO Cc1ccc([C@H](O)C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)cc1 ZINC000273299385 1122226745 /nfs/dbraw/zinc/22/67/45/1122226745.db2.gz AZPYTQZFDCMSLD-MAUKXSAKSA-N 1 0 299.414 3.702 20 10 CHCDRO C=C/C=C\CC[NH2+]Cc1ccc2ccccc2c1O ZINC001183581310 1122230814 /nfs/dbraw/zinc/23/08/14/1122230814.db2.gz FUMXXTFCIKSEDD-ARJAWSKDSA-N 1 0 253.345 3.767 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC[C@@H]2CCO[C@@H](C)C2)c(O)c1C ZINC000273402680 1122231377 /nfs/dbraw/zinc/23/13/77/1122231377.db2.gz GQAHHJTYNIYUKP-CWRNSKLLSA-N 1 0 291.435 3.865 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2cccc(F)c2)c(O)c1C ZINC000273391900 1122231970 /nfs/dbraw/zinc/23/19/70/1122231970.db2.gz KXTDISZFEBBHQE-CYBMUJFWSA-N 1 0 273.351 3.999 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccccn2)c(O)c1C ZINC000273427563 1122232997 /nfs/dbraw/zinc/23/29/97/1122232997.db2.gz UREUJQODVBPUCE-KBPBESRZSA-N 1 0 270.376 3.816 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCO[C@@H](C(C)(C)C)C2)c1 ZINC000273483347 1122234970 /nfs/dbraw/zinc/23/49/70/1122234970.db2.gz MRCSZSIJKNWHLA-GRDNDAEWSA-N 1 0 291.435 3.945 20 10 CHCDRO CC(C)C[C@@H]1C[C@H]([NH2+][C@@H](C)c2cc(F)ccc2O)CCO1 ZINC000273533193 1122237142 /nfs/dbraw/zinc/23/71/42/1122237142.db2.gz WTPRZZZGXVITOS-NWANDNLSSA-N 1 0 295.398 3.776 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccccc2N(C)C)c(O)c1C ZINC000273543045 1122237401 /nfs/dbraw/zinc/23/74/01/1122237401.db2.gz YUWMCMGPDAOBPA-OAHLLOKOSA-N 1 0 298.430 3.926 20 10 CHCDRO C[C@@H]([NH2+]CC1(CCO)CCCC1)c1cc(Cl)ccc1O ZINC000273580757 1122240320 /nfs/dbraw/zinc/24/03/20/1122240320.db2.gz MRCXBWVCVDSSLZ-GFCCVEGCSA-N 1 0 297.826 3.639 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]CC[C@@H]1CC[C@@H]2C[C@@H]21 ZINC001183846426 1122242201 /nfs/dbraw/zinc/24/22/01/1122242201.db2.gz SUZOCTLPYGQCLU-HDMKZQKVSA-N 1 0 272.436 3.587 20 10 CHCDRO CC[C@H]1CCC[C@@H](C[NH2+]Cc2c([O-])cccc2F)C1 ZINC001183920348 1122248244 /nfs/dbraw/zinc/24/82/44/1122248244.db2.gz XBHPSYVFIZGSJW-QWHCGFSZSA-N 1 0 265.372 3.837 20 10 CHCDRO CCc1cccc(C[NH2+]C[C@H]2CC(C)(C)OC2(C)C)c1O ZINC001183981080 1122250833 /nfs/dbraw/zinc/25/08/33/1122250833.db2.gz JENGWKXWFPSNIR-OAHLLOKOSA-N 1 0 291.435 3.638 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccc(F)c(F)c1)c1ccccc1O ZINC000183345814 1129047005 /nfs/dbraw/zinc/04/70/05/1129047005.db2.gz AODRSZYNFYMBQN-MRXNPFEDSA-N 1 0 291.341 3.954 20 10 CHCDRO COc1ccc(O)c(C[N@H+](Cc2ccccc2)C(C)C)c1 ZINC000183371390 1129048022 /nfs/dbraw/zinc/04/80/22/1129048022.db2.gz IHQNDQXWETWCIX-UHFFFAOYSA-N 1 0 285.387 3.811 20 10 CHCDRO C[C@@H]([NH2+]Cc1cccc(F)c1F)c1ccccc1O ZINC000775130827 1122432758 /nfs/dbraw/zinc/43/27/58/1122432758.db2.gz PGDCETMGKZWJGH-SNVBAGLBSA-N 1 0 263.287 3.521 20 10 CHCDRO CCc1ccc(CC[NH2+][C@H](C)c2ccccc2O)cc1 ZINC000775131231 1122436633 /nfs/dbraw/zinc/43/66/33/1122436633.db2.gz UFUWXVQTVGDGKU-CQSZACIVSA-N 1 0 269.388 3.848 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)Cc1ccccc1F)c1ccccc1O ZINC000183438745 1129055024 /nfs/dbraw/zinc/05/50/24/1129055024.db2.gz JDIHTDPETNYSAQ-QWHCGFSZSA-N 1 0 273.351 3.813 20 10 CHCDRO C[C@@H](C[NH2+][C@@H](C)c1ccccc1O)N(C)Cc1ccccc1 ZINC000183506589 1129058465 /nfs/dbraw/zinc/05/84/65/1129058465.db2.gz JRMVWLVLLHTXJL-HOTGVXAUSA-N 1 0 298.430 3.563 20 10 CHCDRO CCCc1cccc(C[NH2+]Cc2ccc(N(C)C)cc2)c1 ZINC000775301122 1122511980 /nfs/dbraw/zinc/51/19/80/1122511980.db2.gz VRFVRNMHHBEMAS-UHFFFAOYSA-N 1 0 282.431 3.995 20 10 CHCDRO CCc1cccc(C[NH2+]C(C)(C2CC2)C2CC2)c1O ZINC000691854340 1129062583 /nfs/dbraw/zinc/06/25/83/1129062583.db2.gz ACRKZOFCRDJKSB-UHFFFAOYSA-N 1 0 259.393 3.623 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]CC[C@H](C)c2ccccc2)c1 ZINC000071409351 1129063148 /nfs/dbraw/zinc/06/31/48/1129063148.db2.gz DKSOKRVBRYDYSS-HNNXBMFYSA-N 1 0 269.388 3.984 20 10 CHCDRO CC[C@H]1C[C@H](C)C[N@@H+]1Cc1ccc(N(C)CC)cc1 ZINC001191232478 1122587247 /nfs/dbraw/zinc/58/72/47/1122587247.db2.gz IAEMVYMARYNBJA-HOCLYGCPSA-N 1 0 260.425 3.763 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1CCCN1CC)c1cc(Cl)ccc1O ZINC000775482814 1122615097 /nfs/dbraw/zinc/61/50/97/1122615097.db2.gz CCIOFTJAYDIHGF-UKRRQHHQSA-N 1 0 296.842 3.571 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccco1)c1cc(Cl)ccc1O ZINC000775483238 1122615522 /nfs/dbraw/zinc/61/55/22/1122615522.db2.gz QENWCZDFISZNBN-AWEZNQCLSA-N 1 0 279.767 3.922 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)CN1CCC[C@H](C)C1)c1ccccc1O ZINC000775488015 1122616266 /nfs/dbraw/zinc/61/62/66/1122616266.db2.gz GAJMGAVRXNMTHJ-UXLLHSPISA-N 1 0 290.451 3.553 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)CN1CCC[C@@H](C)C1)c1ccccc1O ZINC000775488013 1122616923 /nfs/dbraw/zinc/61/69/23/1122616923.db2.gz GAJMGAVRXNMTHJ-INMHGKMJSA-N 1 0 290.451 3.553 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(C)nc1)c1cc(Cl)ccc1O ZINC000775487603 1122618597 /nfs/dbraw/zinc/61/85/97/1122618597.db2.gz LLMZOMKGQWCUTG-HNNXBMFYSA-N 1 0 290.794 3.990 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](C)N1CCCC[C@@H]1C)c1ccccc1O ZINC000775492758 1122622571 /nfs/dbraw/zinc/62/25/71/1122622571.db2.gz QLVIMIPPUIHBDE-ZOBUZTSGSA-N 1 0 290.451 3.696 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](C)N1CCC(C)CC1)c1ccccc1O ZINC000775497158 1122626739 /nfs/dbraw/zinc/62/67/39/1122626739.db2.gz NQZHASXLBDVMOG-DOTOQJQBSA-N 1 0 290.451 3.553 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)CN(CC)CC)c1cc(Cl)ccc1O ZINC000775498051 1122626757 /nfs/dbraw/zinc/62/67/57/1122626757.db2.gz GNGOBCVSVMHQGO-DOMZBBRYSA-N 1 0 298.858 3.817 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](O)CC(C)(C)C)c1cc(Cl)ccc1O ZINC000775507884 1122632261 /nfs/dbraw/zinc/63/22/61/1122632261.db2.gz OVXBOKSZZZUDPO-TZMCWYRMSA-N 1 0 299.842 3.883 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](OC)C(C)C)c1cc(Cl)ccc1O ZINC000775512059 1122633403 /nfs/dbraw/zinc/63/34/03/1122633403.db2.gz JVUDSRXNTLBBPB-HIFRSBDPSA-N 1 0 285.815 3.757 20 10 CHCDRO CC[C@@H]([NH2+]CCNc1ccccc1)c1ccccc1O ZINC000775512897 1122635021 /nfs/dbraw/zinc/63/50/21/1122635021.db2.gz RWJRFFHRQHKELG-MRXNPFEDSA-N 1 0 270.376 3.545 20 10 CHCDRO CC[C@H]([NH2+][C@@H](COC)C1CC1)c1cc(Cl)ccc1O ZINC000775524604 1122642960 /nfs/dbraw/zinc/64/29/60/1122642960.db2.gz SUMNAYVHOBBEDA-KBPBESRZSA-N 1 0 283.799 3.511 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCC[C@@H]1OC)c1cc(Cl)ccc1O ZINC000775532436 1122649317 /nfs/dbraw/zinc/64/93/17/1122649317.db2.gz UNORKLWZGXVEEG-WPGHFRTFSA-N 1 0 297.826 3.901 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCC[C@H]1OC)c1cc(Cl)ccc1O ZINC000775532434 1122649858 /nfs/dbraw/zinc/64/98/58/1122649858.db2.gz UNORKLWZGXVEEG-HZUKXOBISA-N 1 0 297.826 3.901 20 10 CHCDRO CC[C@H]([NH2+]CCOCC1CCC1)c1cc(Cl)ccc1O ZINC000775556281 1122660953 /nfs/dbraw/zinc/66/09/53/1122660953.db2.gz VYMUGXBTIWKAGS-HNNXBMFYSA-N 1 0 297.826 3.903 20 10 CHCDRO CC[C@@H]([NH2+]CC1(CO)CCCC1)c1cc(Cl)ccc1O ZINC000775554113 1122663244 /nfs/dbraw/zinc/66/32/44/1122663244.db2.gz HLGMFGPAIBZDSK-CQSZACIVSA-N 1 0 297.826 3.639 20 10 CHCDRO Cc1ncc([C@@H](C)[NH2+][C@@H](C)c2ccc(N(C)C)cc2)s1 ZINC000775582094 1122682081 /nfs/dbraw/zinc/68/20/81/1122682081.db2.gz LMGDGUPCSJMYEZ-NWDGAFQWSA-N 1 0 289.448 3.929 20 10 CHCDRO CC(C)OC1CCC([NH2+][C@H](C)c2ccccc2O)CC1 ZINC000183627238 1129072620 /nfs/dbraw/zinc/07/26/20/1129072620.db2.gz ULPWRGLQDPNJEL-WLYUNCDWSA-N 1 0 277.408 3.779 20 10 CHCDRO Cc1ccc(C[C@H](C)[NH2+]Cc2ccc3c(c2)CCO3)s1 ZINC000080228316 1129077042 /nfs/dbraw/zinc/07/70/42/1129077042.db2.gz YBIPSHQQMQNIGV-LBPRGKRZSA-N 1 0 287.428 3.712 20 10 CHCDRO Cc1cccc(C[N@H+](C)Cc2ccc(Cl)cc2)c1O ZINC000775643406 1122851871 /nfs/dbraw/zinc/85/18/71/1122851871.db2.gz XHMMBAGVEBKVJO-UHFFFAOYSA-N 1 0 275.779 3.986 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2CCSC(C)(C)C2)c1O ZINC000775707169 1122916381 /nfs/dbraw/zinc/91/63/81/1122916381.db2.gz DUYKLAOLSWJJPK-UHFFFAOYSA-N 1 0 285.840 3.681 20 10 CHCDRO COc1ccc(O)c(C[N@H+](C)[C@@H](C)Cc2ccc(C)cc2)c1 ZINC000775710188 1122917994 /nfs/dbraw/zinc/91/79/94/1122917994.db2.gz JQOSHGMPWNZNDX-HNNXBMFYSA-N 1 0 299.414 3.772 20 10 CHCDRO CC[N@H+](Cc1cc(Br)cc(C)c1O)C1CCC1 ZINC000775713479 1122919211 /nfs/dbraw/zinc/91/92/11/1122919211.db2.gz VDOJAUGJLFDBRN-UHFFFAOYSA-N 1 0 298.224 3.838 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+](C)CCOC(C)(C)C)c1O ZINC000775724825 1122925724 /nfs/dbraw/zinc/92/57/24/1122925724.db2.gz RAIDGNPGISLGID-UHFFFAOYSA-N 1 0 285.815 3.601 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH+]2CC(CC(F)(F)F)C2)cc1 ZINC000839137307 1122996591 /nfs/dbraw/zinc/99/65/91/1122996591.db2.gz DQFHAOSEMDHYDF-ONEGZZNKSA-N 1 0 298.352 3.650 20 10 CHCDRO COc1cc(C)cc(C[NH2+]C[C@@H]2CCCCC2(F)F)c1O ZINC000894873455 1123004405 /nfs/dbraw/zinc/00/44/05/1123004405.db2.gz LXZXHBAEVJQULK-ZDUSSCGKSA-N 1 0 299.361 3.624 20 10 CHCDRO C[C@@H](c1ccccc1)[N@H+](CCF)Cc1ccccc1O ZINC000776004733 1123034535 /nfs/dbraw/zinc/03/45/35/1123034535.db2.gz WSZIBTXKOVQSTH-AWEZNQCLSA-N 1 0 273.351 3.925 20 10 CHCDRO COc1ccc(C[NH2+]CCc2c(C)cccc2C)cc1C ZINC001201025936 1123070325 /nfs/dbraw/zinc/07/03/25/1123070325.db2.gz KORRGJNCLODXLV-UHFFFAOYSA-N 1 0 283.415 3.953 20 10 CHCDRO C[N@H+](Cc1ccc(N2CCCC2)cc1)CC(C)(C)C ZINC001201440252 1123104753 /nfs/dbraw/zinc/10/47/53/1123104753.db2.gz DKSNTHRCTPVWDL-UHFFFAOYSA-N 1 0 260.425 3.765 20 10 CHCDRO CCC1(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)CCOCC1 ZINC000269003578 1129101482 /nfs/dbraw/zinc/10/14/82/1129101482.db2.gz VMEQMVAXNQAESK-OAHLLOKOSA-N 1 0 290.451 3.610 20 10 CHCDRO CC[C@H]([NH2+]C1CC(F)(F)C1)c1cc(Cl)ccc1O ZINC000760041796 1123181880 /nfs/dbraw/zinc/18/18/80/1123181880.db2.gz ZZDFRSPKGLPCFM-NSHDSACASA-N 1 0 275.726 3.884 20 10 CHCDRO C[C@@H]1CC[C@H](C[NH2+]C/C=C\c2ccc(N(C)C)cc2)C1 ZINC001202249936 1123190309 /nfs/dbraw/zinc/19/03/09/1123190309.db2.gz BWLKLEJOTYDSHP-BUZJKLBMSA-N 1 0 272.436 3.792 20 10 CHCDRO CC[C@@](C)([NH2+]Cc1cc2c(cc1O)OCO2)c1ccccc1 ZINC000107717956 1123227056 /nfs/dbraw/zinc/22/70/56/1123227056.db2.gz PEDJQBJTQJWCGS-GOSISDBHSA-N 1 0 299.370 3.536 20 10 CHCDRO CSCC1(CC[NH2+]Cc2c(O)cccc2Cl)CC1 ZINC000850355326 1123255513 /nfs/dbraw/zinc/25/55/13/1123255513.db2.gz DVABOMIWIKKAST-UHFFFAOYSA-N 1 0 285.840 3.669 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+][C@@H]2Cc3ccccc3[C@@H]2C)c1 ZINC000850364270 1123257095 /nfs/dbraw/zinc/25/70/95/1123257095.db2.gz XTFZVPYLLASVJG-SCLBCKFNSA-N 1 0 297.398 3.609 20 10 CHCDRO Cc1cc(C)cc(C[NH2+]Cc2cc(C)c(C)cc2O)c1 ZINC000850367155 1123257177 /nfs/dbraw/zinc/25/71/77/1123257177.db2.gz SSLPOXLDQQGLLK-UHFFFAOYSA-N 1 0 269.388 3.916 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]CCCc2ccco2)cc1 ZINC000850408032 1123264591 /nfs/dbraw/zinc/26/45/91/1123264591.db2.gz VSZCAKVWHMFALA-UTCJRWHESA-N 1 0 284.403 3.581 20 10 CHCDRO CC[C@@H]([NH2+]CCC1CC(OC)C1)c1cc(Cl)ccc1O ZINC000850482386 1123273128 /nfs/dbraw/zinc/27/31/28/1123273128.db2.gz OXPIHVAWFZKFEX-ABIUDSBCSA-N 1 0 297.826 3.901 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H](C)c2ccccn2)c(O)c1 ZINC000850480644 1123273524 /nfs/dbraw/zinc/27/35/24/1123273524.db2.gz BAPLGDIQAGWADC-HUUCEWRRSA-N 1 0 284.403 3.858 20 10 CHCDRO CC[C@@H](COCC1CC1)[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000850492252 1123274223 /nfs/dbraw/zinc/27/42/23/1123274223.db2.gz CFCMKAQSEYPUDQ-FZMZJTMJSA-N 1 0 297.826 3.901 20 10 CHCDRO CC[C@@H](COCC1CC1)[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000850495266 1123275325 /nfs/dbraw/zinc/27/53/25/1123275325.db2.gz ZFHCHTHGKRBXLY-RISCZKNCSA-N 1 0 297.826 3.901 20 10 CHCDRO CCC(C)(C)[C@@H](C)[NH2+][C@@H](C)c1cccc(OC)c1O ZINC000850502144 1123276430 /nfs/dbraw/zinc/27/64/30/1123276430.db2.gz MJCXWRHAKJBFPE-NWDGAFQWSA-N 1 0 265.397 3.876 20 10 CHCDRO Cc1cc(Br)cc([C@@H](C)[NH2+][C@H]2C=CCC2)c1O ZINC000850510677 1123277714 /nfs/dbraw/zinc/27/77/14/1123277714.db2.gz WEXZPLARJXEVSE-PWSUYJOCSA-N 1 0 296.208 3.832 20 10 CHCDRO C[C@H]([NH2+][C@@H]1C[C@@H](O)c2ccccc21)c1ccc(N(C)C)cc1 ZINC000850527626 1123282529 /nfs/dbraw/zinc/28/25/29/1123282529.db2.gz AYPSYUFURNHUMF-MJXNMMHHSA-N 1 0 296.414 3.582 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1C[C@H](O)c2ccccc21)c1ccc(C)cc1O ZINC000850530586 1123285091 /nfs/dbraw/zinc/28/50/91/1123285091.db2.gz ZZQQAKACHAVTQC-SCTDSRPQSA-N 1 0 297.398 3.920 20 10 CHCDRO C[C@@H]1C[C@@H]([NH2+]CCc2ccoc2)c2c1c(F)ccc2O ZINC000850531529 1123285340 /nfs/dbraw/zinc/28/53/40/1123285340.db2.gz LGESARSSHVHUPV-ZWNOBZJWSA-N 1 0 275.323 3.505 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccoc1)c1ccc(N(C)C)cc1 ZINC000850532347 1123285744 /nfs/dbraw/zinc/28/57/44/1123285744.db2.gz SZWDMLJZHADYPL-QGZVFWFLSA-N 1 0 272.392 3.629 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@H]2CCC[C@H](C)O2)c(O)c1 ZINC000850534427 1123285759 /nfs/dbraw/zinc/28/57/59/1123285759.db2.gz JIMDWRPREUHKOV-SOUVJXGZSA-N 1 0 277.408 3.617 20 10 CHCDRO C[C@@H]([NH2+]C[C@]1(C)CC1(F)F)c1cc(Cl)ccc1O ZINC000850537324 1123288125 /nfs/dbraw/zinc/28/81/25/1123288125.db2.gz TUQDCHFCEXEFOX-PELKAZGASA-N 1 0 275.726 3.742 20 10 CHCDRO CC[C@@H]([NH2+]Cc1c(C2CCC2)cnn1C)c1ccccc1O ZINC000850550738 1123288686 /nfs/dbraw/zinc/28/86/86/1123288686.db2.gz NUEWZSPLEAXVKM-MRXNPFEDSA-N 1 0 299.418 3.634 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCc3ccc(O)cc32)c1 ZINC000850543194 1123289118 /nfs/dbraw/zinc/28/91/18/1123289118.db2.gz GJJXAEPDXCGSTH-PXAZEXFGSA-N 1 0 283.371 3.744 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CCc2ccc(O)cc21)c1ccccc1O ZINC000850543760 1123289295 /nfs/dbraw/zinc/28/92/95/1123289295.db2.gz PNLHBYGTCDTURU-IAGOWNOFSA-N 1 0 283.371 3.826 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]C1CCC3(CC3(F)F)CC1)CC2 ZINC000850549358 1123289307 /nfs/dbraw/zinc/28/93/07/1123289307.db2.gz GBSNDZOHNMCLPN-UYJPIKCFSA-N 1 0 293.357 3.937 20 10 CHCDRO C[C@@H]([NH2+]CC1=CCCC1)c1cc(Cl)ccc1O ZINC000850556809 1123291066 /nfs/dbraw/zinc/29/10/66/1123291066.db2.gz JPUFEEZWYOVTSA-SNVBAGLBSA-N 1 0 251.757 3.807 20 10 CHCDRO CC[C@H]([NH2+][C@H](c1ccccc1)[C@H](C)O)c1ccc(C)cc1O ZINC000850583236 1123296077 /nfs/dbraw/zinc/29/60/77/1123296077.db2.gz JYCYHPSEWWHRHB-FNHZYXHNSA-N 1 0 299.414 3.863 20 10 CHCDRO Cc1cccc(C[NH2+]C(C)(C)c2ccccc2)c1O ZINC000271939912 1129116641 /nfs/dbraw/zinc/11/66/41/1129116641.db2.gz WGXKEDUOCDUMTP-UHFFFAOYSA-N 1 0 255.361 3.726 20 10 CHCDRO C[C@@H](c1ccc(F)cc1F)[N@H+](C)Cc1ccccc1O ZINC000109773820 1123326405 /nfs/dbraw/zinc/32/64/05/1123326405.db2.gz DEQVJTDEPKFVFL-NSHDSACASA-N 1 0 277.314 3.863 20 10 CHCDRO C[N@H+](Cc1ccccc1O)Cc1cc(F)cc2cccnc21 ZINC000109772687 1123326579 /nfs/dbraw/zinc/32/65/79/1123326579.db2.gz QYVZVXRRWHUZII-UHFFFAOYSA-N 1 0 296.345 3.712 20 10 CHCDRO CCCC[N@H+](Cc1cc(C)nc(C)n1)Cc1ccccc1O ZINC000852018023 1123392974 /nfs/dbraw/zinc/39/29/74/1123392974.db2.gz IRAASQLDRJYGFO-UHFFFAOYSA-N 1 0 299.418 3.601 20 10 CHCDRO CC(C)n1cc([C@@H](C)[NH2+][C@@H](C)c2ccccc2O)cn1 ZINC000783511467 1123407651 /nfs/dbraw/zinc/40/76/51/1123407651.db2.gz ZPCQXKSGOXYMSD-OLZOCXBDSA-N 1 0 273.380 3.581 20 10 CHCDRO CC[C@H]1C[N@H+](C/C=C/c2ccc(N(C)C)cc2)CCS1 ZINC001204769373 1123425007 /nfs/dbraw/zinc/42/50/07/1123425007.db2.gz SZRHVJWAALEWMG-RTRPANQVSA-N 1 0 290.476 3.593 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccnn1CC)c1cc(Cl)ccc1O ZINC000853241031 1123429130 /nfs/dbraw/zinc/42/91/30/1123429130.db2.gz SAHHDYCYONJCHX-AWEZNQCLSA-N 1 0 293.798 3.503 20 10 CHCDRO C[C@@H]([NH2+]CCc1cscn1)c1ccc2ccccc2c1O ZINC000111627226 1123457222 /nfs/dbraw/zinc/45/72/22/1123457222.db2.gz NXLNIAOONSGBKY-GFCCVEGCSA-N 1 0 298.411 3.895 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCc3cc(N)ccc32)c(O)c1 ZINC000854226889 1123478214 /nfs/dbraw/zinc/47/82/14/1123478214.db2.gz SBDJWBSGYQDJMN-PXAZEXFGSA-N 1 0 282.387 3.621 20 10 CHCDRO CCSc1ccc(C[NH2+]Cc2cc(F)ccc2O)cc1 ZINC000895526270 1123487775 /nfs/dbraw/zinc/48/77/75/1123487775.db2.gz KNMGGODANSCWKA-UHFFFAOYSA-N 1 0 291.391 3.933 20 10 CHCDRO CCc1cccc(C[NH2+]CC(C)(C)CC(F)F)c1O ZINC000895535026 1123488453 /nfs/dbraw/zinc/48/84/53/1123488453.db2.gz NDYVZNUYLNSVOF-UHFFFAOYSA-N 1 0 271.351 3.726 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]CC[C@H]1CCCC1(F)F ZINC000895546038 1123491092 /nfs/dbraw/zinc/49/10/92/1123491092.db2.gz XQEWVSLURJNMEY-GFCCVEGCSA-N 1 0 269.335 3.616 20 10 CHCDRO CCc1cnccc1[C@H](C)[NH2+][C@@H](C)c1ccccc1O ZINC000783526224 1123493416 /nfs/dbraw/zinc/49/34/16/1123493416.db2.gz UQKDSLNOPYZTCO-STQMWFEESA-N 1 0 270.376 3.761 20 10 CHCDRO COc1ccc(CC[C@@H](C)[NH2+]Cc2cc(C)ccc2O)cc1 ZINC000113330275 1123521641 /nfs/dbraw/zinc/52/16/41/1123521641.db2.gz BFFPQQASQNYDES-OAHLLOKOSA-N 1 0 299.414 3.820 20 10 CHCDRO Oc1c(C[N@@H+]2CC[C@H]([C@H]3CCCO3)C2)ccc2ccccc21 ZINC000895848595 1123521637 /nfs/dbraw/zinc/52/16/37/1123521637.db2.gz SEKLUKUBRXQVRZ-MAUKXSAKSA-N 1 0 297.398 3.546 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2cc(-c3ccccc3)on2)c1 ZINC000113332527 1123521822 /nfs/dbraw/zinc/52/18/22/1123521822.db2.gz SXDJROUZACVLJS-UHFFFAOYSA-N 1 0 294.354 3.645 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)[C@H]1COc2ccccc2C1)c1ccccc1O ZINC000895851043 1123521888 /nfs/dbraw/zinc/52/18/88/1123521888.db2.gz IIJUPZQVTPKIFR-OFQRWUPVSA-N 1 0 297.398 3.683 20 10 CHCDRO Cc1nn(C(C)C)c(C)c1C[NH2+][C@H](C)c1ccccc1O ZINC000895852141 1123522853 /nfs/dbraw/zinc/52/28/53/1123522853.db2.gz PURQQHKAKYGPCC-GFCCVEGCSA-N 1 0 287.407 3.637 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]CC[C@@H]1CC1(Cl)Cl ZINC000856806203 1123569520 /nfs/dbraw/zinc/56/95/20/1123569520.db2.gz BVKGEJAGYLSBCY-SECBINFHSA-N 1 0 294.609 3.719 20 10 CHCDRO COc1ccc(C[NH2+]CC[C@@H]2CC2(Cl)Cl)cc1C ZINC000856806807 1123569909 /nfs/dbraw/zinc/56/99/09/1123569909.db2.gz IUUALABODIIXDC-GFCCVEGCSA-N 1 0 288.218 3.677 20 10 CHCDRO Oc1c(C[NH+]2CC(CC3CC3)C2)ccc2ccccc21 ZINC000857066011 1123584168 /nfs/dbraw/zinc/58/41/68/1123584168.db2.gz CUEVBTTTWCZRNO-UHFFFAOYSA-N 1 0 267.372 3.777 20 10 CHCDRO C[C@@H]([NH2+]CC[C@H]1CC1(F)F)c1cc(Cl)ccc1O ZINC000857081690 1123585682 /nfs/dbraw/zinc/58/56/82/1123585682.db2.gz QDOWEUBOKXSDPA-BDAKNGLRSA-N 1 0 275.726 3.742 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)[C@@H]1C[C@H]1C1CC1 ZINC000858094736 1123630793 /nfs/dbraw/zinc/63/07/93/1123630793.db2.gz RQHVSNLWGJOPRR-JVPBZIDWSA-N 1 0 284.447 3.811 20 10 CHCDRO Cc1ccsc1C[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC000858108514 1123632041 /nfs/dbraw/zinc/63/20/41/1123632041.db2.gz HNQCRVDQSOJRIN-UHFFFAOYSA-N 1 0 296.386 3.691 20 10 CHCDRO CC(C)CCO[C@H]1CC[C@H]([NH2+]Cc2ccccc2O)CC1 ZINC000858257583 1123639833 /nfs/dbraw/zinc/63/98/33/1123639833.db2.gz PKGUWNRFHLHVKJ-QAQDUYKDSA-N 1 0 291.435 3.856 20 10 CHCDRO C[C@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)c1ccns1 ZINC000858318161 1123644507 /nfs/dbraw/zinc/64/45/07/1123644507.db2.gz LIOXKFGOLPHPBS-ZFDPJTLLSA-N 1 0 287.432 3.573 20 10 CHCDRO Cc1csc([C@@H](C)[NH2+]CCCSc2nccs2)n1 ZINC000858364925 1123647773 /nfs/dbraw/zinc/64/77/73/1123647773.db2.gz IBIUJHNYAKQLEY-SNVBAGLBSA-N 1 0 299.490 3.741 20 10 CHCDRO CCC[C@@H](C[NH2+][C@@H](C)c1ccc(C)c(C)c1O)OCC ZINC000858451224 1123655238 /nfs/dbraw/zinc/65/52/38/1123655238.db2.gz PJFAZLBSYFKVQG-GJZGRUSLSA-N 1 0 279.424 3.865 20 10 CHCDRO CCC[C@@H](C[NH2+][C@H](C)c1ccc(C)c(C)c1O)OCC ZINC000858451223 1123655361 /nfs/dbraw/zinc/65/53/61/1123655361.db2.gz PJFAZLBSYFKVQG-CABCVRRESA-N 1 0 279.424 3.865 20 10 CHCDRO CCC[C@@H](C[NH2+][C@H](C)c1c(C)cc(C)cc1O)OCC ZINC000858450474 1123655481 /nfs/dbraw/zinc/65/54/81/1123655481.db2.gz DONXQFQLHMZNGL-CABCVRRESA-N 1 0 279.424 3.865 20 10 CHCDRO Cc1ccc(C(C)(C)C[NH2+][C@@H](C)c2ccccc2O)nc1 ZINC000858487590 1123657433 /nfs/dbraw/zinc/65/74/33/1123657433.db2.gz CNLXOPRLLZLDNH-AWEZNQCLSA-N 1 0 284.403 3.724 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@]2(C)C[C@H]3C[C@H]3C2)c(O)c1 ZINC000858536609 1123660688 /nfs/dbraw/zinc/66/06/88/1123660688.db2.gz IDXKISKNXCNCGT-VWPFQQQWSA-N 1 0 259.393 3.787 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1C[C@@H](OC)C1)c1cc(Cl)ccc1O ZINC000858592598 1123665792 /nfs/dbraw/zinc/66/57/92/1123665792.db2.gz GUADRYDTXROLDW-SUHUHFCYSA-N 1 0 283.799 3.511 20 10 CHCDRO CCCN(Cc1cccc(COC)c1)c1ccc(C[NH3+])cc1 ZINC000194980603 1129140347 /nfs/dbraw/zinc/14/03/47/1129140347.db2.gz DBJFKZUNKYYZBB-UHFFFAOYSA-N 1 0 298.430 3.708 20 10 CHCDRO CCCOc1ccc(C[NH2+]C[C@](C)(CC)OC)cc1C ZINC001202505425 1123771906 /nfs/dbraw/zinc/77/19/06/1123771906.db2.gz RAZSXGNGPSGWNZ-KRWDZBQOSA-N 1 0 279.424 3.689 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(C)c(C)n1)c1ccc(C)cc1O ZINC000840782730 1123796705 /nfs/dbraw/zinc/79/67/05/1123796705.db2.gz FAOBVOZDUWTAMI-QGZVFWFLSA-N 1 0 284.403 3.953 20 10 CHCDRO CC[C@H](C)[N@H+](CCO)Cc1cc(-c2ccccc2)ccc1O ZINC000862387238 1123806000 /nfs/dbraw/zinc/80/60/00/1123806000.db2.gz JEOLOMRNQHIMOB-HNNXBMFYSA-N 1 0 299.414 3.652 20 10 CHCDRO Oc1cccc(Br)c1C[N@@H+]1CCC12CCCC2 ZINC000862400797 1123807277 /nfs/dbraw/zinc/80/72/77/1123807277.db2.gz DBNIDRHDHASZIY-UHFFFAOYSA-N 1 0 296.208 3.673 20 10 CHCDRO CCc1cccc(C[N@H+]2C[C@@H](C)C(F)(F)[C@@H](C)C2)c1O ZINC000862442051 1123810015 /nfs/dbraw/zinc/81/00/15/1123810015.db2.gz GHLGZYRQWFVKFG-TXEJJXNPSA-N 1 0 283.362 3.678 20 10 CHCDRO CN(C)c1ccc(/C=C/C[N@@H+]2CCCC(F)(F)CC2)cc1 ZINC000862467136 1123812663 /nfs/dbraw/zinc/81/26/63/1123812663.db2.gz QRBVBKKQNXOOES-HWKANZROSA-N 1 0 294.389 3.887 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]CC1(C(F)(F)F)CCCC1 ZINC000862535983 1123816366 /nfs/dbraw/zinc/81/63/66/1123816366.db2.gz BPGDGMHGZNCHEJ-UHFFFAOYSA-N 1 0 291.288 3.744 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CCC[C@@H]2C[C@@H]21)c1ccc(C)cc1O ZINC000840819126 1123827722 /nfs/dbraw/zinc/82/77/22/1123827722.db2.gz FDJPVAWDBGYCRH-SLBVQIDZSA-N 1 0 259.393 3.930 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCCC[C@H]1F)c1ccccc1O ZINC000840875501 1123880778 /nfs/dbraw/zinc/88/07/78/1123880778.db2.gz HPIAIGLVLVUVKO-HZSPNIEDSA-N 1 0 251.345 3.714 20 10 CHCDRO Cc1nc(C)c(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)s1 ZINC000119825525 1123915486 /nfs/dbraw/zinc/91/54/86/1123915486.db2.gz ZHXWEHNIWSKKCT-LLVKDONJSA-N 1 0 289.448 3.677 20 10 CHCDRO COc1ccc(C[NH2+]C2C[C@@H](C)C[C@H](C)C2)cc1C ZINC000084461626 1129153424 /nfs/dbraw/zinc/15/34/24/1129153424.db2.gz KEVOMAXYHATEMW-STQMWFEESA-N 1 0 261.409 3.918 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@H+]2CC[C@H](C(F)(F)F)[C@H]2C)c1 ZINC000794654509 1123925437 /nfs/dbraw/zinc/92/54/37/1123925437.db2.gz CSDUHSSWUPNHKO-YPMHNXCESA-N 1 0 287.325 3.782 20 10 CHCDRO C[C@@H]1CC([NH2+]Cc2cc(Cl)ccc2O)C[C@@H](C)C1 ZINC000084461686 1129153506 /nfs/dbraw/zinc/15/35/06/1129153506.db2.gz MXSNKLTUFNPRAN-QWRGUYRKSA-N 1 0 267.800 3.960 20 10 CHCDRO CC[N@@H+](Cc1cc2c(cc1O)CCC2)CC1CCC1 ZINC000794688817 1123933169 /nfs/dbraw/zinc/93/31/69/1123933169.db2.gz SOFBNWRLKWJMPR-UHFFFAOYSA-N 1 0 259.393 3.503 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCOC(C)(C)C2)c(O)c1C ZINC000120220196 1123945071 /nfs/dbraw/zinc/94/50/71/1123945071.db2.gz SXXMHFFRFLDXHK-UONOGXRCSA-N 1 0 277.408 3.617 20 10 CHCDRO CC[C@H]([NH2+]CCc1cccc(OC)c1)c1ccc(C)cc1O ZINC000794797038 1123949941 /nfs/dbraw/zinc/94/99/41/1123949941.db2.gz LQYYTFSHFBXVPP-SFHVURJKSA-N 1 0 299.414 3.993 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](O)c1ccc(C)cc1)c1ccc(C)cc1O ZINC000794802485 1123950884 /nfs/dbraw/zinc/95/08/84/1123950884.db2.gz NNWGJFXGCOJDBK-HKUYNNGSSA-N 1 0 299.414 3.783 20 10 CHCDRO CC[C@H]([NH2+]CCN1CCCC[C@@H]1C)c1ccc(C)cc1O ZINC000794794551 1123951727 /nfs/dbraw/zinc/95/17/27/1123951727.db2.gz FCBMHVSCCRMIHL-RDJZCZTQSA-N 1 0 290.451 3.616 20 10 CHCDRO CCCCOCC[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000794803521 1123951990 /nfs/dbraw/zinc/95/19/90/1123951990.db2.gz JNZDPMZFIVSKST-HNNXBMFYSA-N 1 0 265.397 3.558 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccccc1O)c1ccc(C)cc1O ZINC000794803899 1123953223 /nfs/dbraw/zinc/95/32/23/1123953223.db2.gz KYHWGSTZVADGIH-INIZCTEOSA-N 1 0 285.387 3.690 20 10 CHCDRO CC[C@H]([NH2+]C[C@@]1(C)CCCC[C@@H]1O)c1ccc(C)cc1O ZINC000794806282 1123955318 /nfs/dbraw/zinc/95/53/18/1123955318.db2.gz ZSUJAZFQANNXRN-RYQLBKOJSA-N 1 0 291.435 3.683 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[C@H](C)[C@@H](C)C2)c1 ZINC000085040595 1129155817 /nfs/dbraw/zinc/15/58/17/1129155817.db2.gz UALMBNTYYISJFD-XDQVBPFNSA-N 1 0 277.408 3.876 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCCS1)c1ccc(C)cc1O ZINC000794812537 1123959214 /nfs/dbraw/zinc/95/92/14/1123959214.db2.gz XCPIDPKFDAHLGN-JSGCOSHPSA-N 1 0 265.422 3.637 20 10 CHCDRO CC[C@@H](CSC)[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000794818550 1123959495 /nfs/dbraw/zinc/95/94/95/1123959495.db2.gz UIQRLXUGQICYDF-JSGCOSHPSA-N 1 0 267.438 3.883 20 10 CHCDRO CC[C@@H]([NH2+][C@H](CO)CC1CCC1)c1cc(Cl)ccc1O ZINC000794836580 1123971307 /nfs/dbraw/zinc/97/13/07/1123971307.db2.gz UIOBUFADZFQZSH-DZGCQCFKSA-N 1 0 297.826 3.637 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2CC=CC[C@H]2C(F)(F)F)cc1 ZINC000865832199 1124018492 /nfs/dbraw/zinc/01/84/92/1124018492.db2.gz KXWYGBHBDJHDFA-HUUCEWRRSA-N 1 0 298.352 3.739 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCO[C@H]2c2ccccc2)c1 ZINC000866404734 1124064021 /nfs/dbraw/zinc/06/40/21/1124064021.db2.gz PXAJOCXLTFXDOA-BJZITVGISA-N 1 0 297.398 3.881 20 10 CHCDRO COc1cccc(C[NH2+][C@H]2CCC[C@H]2C(C)(C)C)c1O ZINC000840971620 1124067383 /nfs/dbraw/zinc/06/73/83/1124067383.db2.gz QBEZXLMANHGHRG-KGLIPLIRSA-N 1 0 277.408 3.705 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H](C)c2cnc(C)s2)c1O ZINC000866454400 1124067952 /nfs/dbraw/zinc/06/79/52/1124067952.db2.gz BEOMUSVQTAOHMH-VHSXEESVSA-N 1 0 292.404 3.578 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1cnc(C)s1)c1ccccc1O ZINC000866456236 1124068346 /nfs/dbraw/zinc/06/83/46/1124068346.db2.gz XMWMNXGOQHCXJF-GXFFZTMASA-N 1 0 276.405 3.959 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)o1 ZINC000866479094 1124070840 /nfs/dbraw/zinc/07/08/40/1124070840.db2.gz PSMYDFVTNXTZJQ-NOZJJQNGSA-N 1 0 275.323 3.771 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2C[C@H]2C(F)(F)F)c(O)c1C ZINC000866500778 1124073152 /nfs/dbraw/zinc/07/31/52/1124073152.db2.gz WBKKRNGZDMEXCD-MVWJERBFSA-N 1 0 273.298 3.610 20 10 CHCDRO CC(C)(C)[NH2+]CCN(Cc1ccccc1O)C1CCCC1 ZINC000841006658 1124090788 /nfs/dbraw/zinc/09/07/88/1124090788.db2.gz MJSUKOTUDGMFQT-UHFFFAOYSA-N 1 0 290.451 3.525 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C2([C@@H]3CCCCO3)CCC2)c1 ZINC000866623402 1124091314 /nfs/dbraw/zinc/09/13/14/1124091314.db2.gz QLZPFCWRCXSVPA-YOEHRIQHSA-N 1 0 289.419 3.843 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCCn2nccc21)c1ccc(N(C)C)cc1 ZINC000866632720 1124092000 /nfs/dbraw/zinc/09/20/00/1124092000.db2.gz ORMZXCJXQVTDIN-DLBZAZTESA-N 1 0 298.434 3.525 20 10 CHCDRO CC(C)(C)c1cc(O)c(O)c(C[N@@H+]2CCC3(CCC3)C2)c1 ZINC000121967672 1124454564 /nfs/dbraw/zinc/45/45/64/1124454564.db2.gz QGHMONKTJVORQQ-UHFFFAOYSA-N 1 0 289.419 3.771 20 10 CHCDRO C[C@H](Cc1ccc(O)cc1)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000122899945 1124543518 /nfs/dbraw/zinc/54/35/18/1124543518.db2.gz YFIBHIFDDLRGKY-CABCVRRESA-N 1 0 298.430 3.740 20 10 CHCDRO CCCC[C@H](CC)C[NH2+]Cc1cc(OC)ccc1O ZINC000019232158 1124650144 /nfs/dbraw/zinc/65/01/44/1124650144.db2.gz NGXXIAGGIMBMIP-ZDUSSCGKSA-N 1 0 265.397 3.707 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1C[C@H]2CCC[C@@H]2O1)c1ccc(Cl)cc1O ZINC000872108968 1124684810 /nfs/dbraw/zinc/68/48/10/1124684810.db2.gz ZORNIJYGFAYDPJ-DZJQYVJYSA-N 1 0 295.810 3.654 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1cc(C)ccc1O)[C@H](O)c1ccccc1 ZINC000872132215 1124691857 /nfs/dbraw/zinc/69/18/57/1124691857.db2.gz FLSGKQANULUTBT-UCLAIMLFSA-N 1 0 299.414 3.863 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2nccnc2C)c(O)c1C ZINC000872134330 1124692920 /nfs/dbraw/zinc/69/29/20/1124692920.db2.gz RKVKNYSNZZOGPI-GXTWGEPZSA-N 1 0 285.391 3.519 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1nccnc1C)c1ccc(C)cc1O ZINC000872135108 1124693792 /nfs/dbraw/zinc/69/37/92/1124693792.db2.gz VFTHQEHJUVCDNG-ZFWWWQNUSA-N 1 0 285.391 3.601 20 10 CHCDRO CCCOc1ccc(C[NH2+]C2CC(F)(F)C2)cc1C ZINC000873114592 1124738776 /nfs/dbraw/zinc/73/87/76/1124738776.db2.gz MBBAKXVKQGPBIL-UHFFFAOYSA-N 1 0 269.335 3.671 20 10 CHCDRO CCCOc1ccc(C[NH2+]Cc2cccc(F)n2)cc1C ZINC000873092959 1124738881 /nfs/dbraw/zinc/73/88/81/1124738881.db2.gz LOGKTUGNHIEGTP-UHFFFAOYSA-N 1 0 288.366 3.608 20 10 CHCDRO CCCOc1ccc(C[NH2+]Cc2ccnc(C)c2)cc1C ZINC000873129068 1124739784 /nfs/dbraw/zinc/73/97/84/1124739784.db2.gz IJTXQEVDXJBJHW-UHFFFAOYSA-N 1 0 284.403 3.777 20 10 CHCDRO CCCOc1ccc(C[NH2+]Cc2cnccc2C)cc1C ZINC000873131857 1124740172 /nfs/dbraw/zinc/74/01/72/1124740172.db2.gz XTOFEBJJVOOZMK-UHFFFAOYSA-N 1 0 284.403 3.777 20 10 CHCDRO C[C@H]([NH2+]Cc1ccccc1O)c1ccc(C(F)(F)F)nc1 ZINC000873186091 1124747389 /nfs/dbraw/zinc/74/73/89/1124747389.db2.gz DHUGITSTAAYCFN-JTQLQIEISA-N 1 0 296.292 3.657 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@@H](C)CCc2ccccc2)c1 ZINC000020138563 1124809094 /nfs/dbraw/zinc/80/90/94/1124809094.db2.gz LGPAZZBRGIKVFA-AWEZNQCLSA-N 1 0 285.387 3.512 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)C1CCC(OCC)CC1 ZINC000825710405 1124813510 /nfs/dbraw/zinc/81/35/10/1124813510.db2.gz OQZSVMBNGZWLCJ-UHFFFAOYSA-N 1 0 290.451 3.709 20 10 CHCDRO CO[C@@]1(C)CCC[N@H+](Cc2cc(Cl)c(C)cc2O)CC1 ZINC000825748475 1124854012 /nfs/dbraw/zinc/85/40/12/1124854012.db2.gz CDYHTHQGDISBDB-INIZCTEOSA-N 1 0 297.826 3.745 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@H]2CCC(F)(F)C2)cc1Cl ZINC000825752537 1124866067 /nfs/dbraw/zinc/86/60/67/1124866067.db2.gz CHODJAPBXIZWFB-JTQLQIEISA-N 1 0 289.753 3.879 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+](Cc1ccco1)C(C)C ZINC000876567939 1124961036 /nfs/dbraw/zinc/96/10/36/1124961036.db2.gz UHJUUXJVWZYTSA-UHFFFAOYSA-N 1 0 259.349 3.704 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+](C)[C@@H](C)c1cccs1 ZINC000876590139 1124963372 /nfs/dbraw/zinc/96/33/72/1124963372.db2.gz SVCJZELPPWITLT-LBPRGKRZSA-N 1 0 261.390 3.955 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2ccc(OC(F)F)cc2)c(O)c1 ZINC000876886251 1124987345 /nfs/dbraw/zinc/98/73/45/1124987345.db2.gz UHRSBPVNKZBGSW-UHFFFAOYSA-N 1 0 293.313 3.592 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)c2ccccc2C)c(O)c1 ZINC000876889095 1124988681 /nfs/dbraw/zinc/98/86/81/1124988681.db2.gz JAHISXGBYUFQMV-CQSZACIVSA-N 1 0 255.361 3.860 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]Cc1ccc([C@@H]2C[C@@H]2C)o1 ZINC000876945611 1124991747 /nfs/dbraw/zinc/99/17/47/1124991747.db2.gz GLKSEFPUONIZKE-GXTWGEPZSA-N 1 0 271.360 3.707 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H]2c3ccccc3C[C@@H]2C)c(O)c1 ZINC000877008575 1124996359 /nfs/dbraw/zinc/99/63/59/1124996359.db2.gz NCKFWNWPURTFFI-UGSOOPFHSA-N 1 0 267.372 3.724 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)CCc2ccc(O)cc2)c(O)c1 ZINC000877016215 1124998576 /nfs/dbraw/zinc/99/85/76/1124998576.db2.gz DEBISBJSLJMNFZ-CQSZACIVSA-N 1 0 285.387 3.517 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H]2CCc3c2cccc3C)c(O)c1 ZINC000877015261 1124998685 /nfs/dbraw/zinc/99/86/85/1124998685.db2.gz JGOMCGFYQNIQDV-QGZVFWFLSA-N 1 0 267.372 3.786 20 10 CHCDRO Cc1cccc(O)c1C[NH2+][C@H]1CCO[C@@H](c2ccccc2)C1 ZINC000877376542 1125024500 /nfs/dbraw/zinc/02/45/00/1125024500.db2.gz JLMJIBWXKHVIMQ-QFBILLFUSA-N 1 0 297.398 3.711 20 10 CHCDRO COc1ccc(C[NH2+]Cc2cccc(Cl)c2C)c(O)c1 ZINC000877493573 1125035252 /nfs/dbraw/zinc/03/52/52/1125035252.db2.gz LYTYBUOSDKUBTF-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]C[C@@H]1CSc2ccccc21 ZINC000877557516 1125044562 /nfs/dbraw/zinc/04/45/62/1125044562.db2.gz NFKGFTPGYVHLBW-CYBMUJFWSA-N 1 0 285.412 3.680 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)CCCc2cccnc2)c(O)c1 ZINC000877584165 1125048707 /nfs/dbraw/zinc/04/87/07/1125048707.db2.gz PGMUUDUURNMJKM-HNNXBMFYSA-N 1 0 284.403 3.597 20 10 CHCDRO C[C@@H](CCc1cccnc1)[NH2+]Cc1cc(Cl)ccc1O ZINC000877612700 1125053765 /nfs/dbraw/zinc/05/37/65/1125053765.db2.gz MJXXRYKDPPKSEG-LBPRGKRZSA-N 1 0 290.794 3.552 20 10 CHCDRO CCc1cccc(C[NH2+][C@@H]2CCO[C@H]2c2ccccc2)c1O ZINC000877661933 1125059402 /nfs/dbraw/zinc/05/94/02/1125059402.db2.gz JVSBBEWKSHNNQZ-MJGOQNOKSA-N 1 0 297.398 3.574 20 10 CHCDRO Cc1ncc([C@@H](C)[NH2+]Cc2cc(Cl)c(C)cc2O)s1 ZINC000877685233 1125063006 /nfs/dbraw/zinc/06/30/06/1125063006.db2.gz QMHPUXZYPVBZHT-SECBINFHSA-N 1 0 296.823 3.970 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2cc(Cl)cc(C)c2O)o1 ZINC000877697132 1125064185 /nfs/dbraw/zinc/06/41/85/1125064185.db2.gz BUDGKDDZABMJTC-UHFFFAOYSA-N 1 0 265.740 3.545 20 10 CHCDRO Oc1cccc2c1C[N@H+](C[C@H]1C[C@@H]1c1ccccc1)C2 ZINC000877702921 1125065565 /nfs/dbraw/zinc/06/55/65/1125065565.db2.gz JZXKFAAQDQFZOF-HZPDHXFCSA-N 1 0 265.356 3.512 20 10 CHCDRO C[C@@H](CCC(F)(F)F)[NH2+][C@@H](C)c1ccccc1O ZINC000877757140 1125075067 /nfs/dbraw/zinc/07/50/67/1125075067.db2.gz IUYDFVRXPOUCER-UWVGGRQHSA-N 1 0 261.287 3.774 20 10 CHCDRO C[C@H]([NH2+]Cc1ncccc1C(F)(F)F)c1ccccc1O ZINC000877757194 1125075193 /nfs/dbraw/zinc/07/51/93/1125075193.db2.gz MWHLRWVKKMFRJV-JTQLQIEISA-N 1 0 296.292 3.657 20 10 CHCDRO CC(C)[C@@H]1C[C@H]([NH2+][C@@H](C)c2ccccc2O)CS1 ZINC000877758121 1125075553 /nfs/dbraw/zinc/07/55/53/1125075553.db2.gz JRPUOBGIXFNZLH-HUBLWGQQSA-N 1 0 265.422 3.573 20 10 CHCDRO CC(C)c1cc([C@@H]2CCC[N@H+](Cc3ccccc3O)C2)[nH]n1 ZINC000877785378 1125081715 /nfs/dbraw/zinc/08/17/15/1125081715.db2.gz YRZAGCGMCNFDBD-CQSZACIVSA-N 1 0 299.418 3.618 20 10 CHCDRO C[N@@H+](Cc1ccccc1O)C[C@H]1CC[C@@H](c2ccccc2)O1 ZINC000878242897 1125133809 /nfs/dbraw/zinc/13/38/09/1125133809.db2.gz WSHAYIXOLUHZTA-MJGOQNOKSA-N 1 0 297.398 3.744 20 10 CHCDRO C[N@H+](CC[C@H]1CCCC1(F)F)Cc1ccccc1O ZINC000878241045 1125134354 /nfs/dbraw/zinc/13/43/54/1125134354.db2.gz AAEDBQKJNDKFFI-CYBMUJFWSA-N 1 0 269.335 3.650 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]CC[C@H]2CCCC2(F)F)c1 ZINC000878361023 1125145135 /nfs/dbraw/zinc/14/51/35/1125145135.db2.gz VTMGHPYGWZCLCD-NWDGAFQWSA-N 1 0 299.361 3.877 20 10 CHCDRO Cc1cc(C)c(C[NH2+]Cc2cc(Cl)c(C)cc2O)cn1 ZINC000826099685 1125201686 /nfs/dbraw/zinc/20/16/86/1125201686.db2.gz GBSMTXLCBQIXBI-UHFFFAOYSA-N 1 0 290.794 3.656 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C(C)(C)COC(C)C)cc1Cl ZINC000826124057 1125232785 /nfs/dbraw/zinc/23/27/85/1125232785.db2.gz ZPJNXWYTJZSANK-UHFFFAOYSA-N 1 0 285.815 3.647 20 10 CHCDRO CCOc1cccc(C[N@H+](C2CC2)C2CCCC2)c1O ZINC000130216611 1125358305 /nfs/dbraw/zinc/35/83/05/1125358305.db2.gz BKNICKQNJRSRQK-UHFFFAOYSA-N 1 0 275.392 3.698 20 10 CHCDRO COCc1c(C)cc(C)c(C[NH2+]Cc2ccccc2O)c1C ZINC000882955833 1125363883 /nfs/dbraw/zinc/36/38/83/1125363883.db2.gz SZXZXJAPVQOKQN-UHFFFAOYSA-N 1 0 299.414 3.754 20 10 CHCDRO CCOc1ccc(C[NH2+]CC[C@H]2CCCC2(F)F)c(O)c1 ZINC000883265637 1125388749 /nfs/dbraw/zinc/38/87/49/1125388749.db2.gz HCFBOIVPZPNWLS-CYBMUJFWSA-N 1 0 299.361 3.706 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]CC[C@@H]2CCCC2(F)F)c1 ZINC000883266399 1125388883 /nfs/dbraw/zinc/38/88/83/1125388883.db2.gz ZHQFNDNVXDELRL-ZDUSSCGKSA-N 1 0 269.335 3.616 20 10 CHCDRO C[C@@H]([NH2+]C[C@@]1(C)OCCc2ccccc21)c1ccccc1O ZINC000883339969 1125397634 /nfs/dbraw/zinc/39/76/34/1125397634.db2.gz GNGKWDHMLZGUMQ-AUUYWEPGSA-N 1 0 297.398 3.531 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCC3(CCC3)O2)c(O)c1C ZINC000883357103 1125401504 /nfs/dbraw/zinc/40/15/04/1125401504.db2.gz CSPCYCLMSYGZGJ-LSDHHAIUSA-N 1 0 289.419 3.761 20 10 CHCDRO C[C@@H]1C[C@@H](C)C[NH+](Cc2cc(Cl)ccc2O)C1 ZINC000131805586 1125410675 /nfs/dbraw/zinc/41/06/75/1125410675.db2.gz BOROYMXAMWCWCW-GHMZBOCLSA-N 1 0 253.773 3.524 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCCSc2nccs2)o1 ZINC000132304937 1125416780 /nfs/dbraw/zinc/41/67/80/1125416780.db2.gz DMABUDDQRLZUIW-LLVKDONJSA-N 1 0 282.434 3.878 20 10 CHCDRO Cc1cncc([C@@H](C)[NH2+]CCCSc2nccs2)c1 ZINC000184361599 1129187124 /nfs/dbraw/zinc/18/71/24/1129187124.db2.gz DMCNXYXTPUQXNL-GFCCVEGCSA-N 1 0 293.461 3.680 20 10 CHCDRO CC[C@H]([NH2+]CCCC(C)(F)F)c1ccccc1O ZINC000295946739 1129219072 /nfs/dbraw/zinc/21/90/72/1129219072.db2.gz GRVNBOSKQXNSBE-LBPRGKRZSA-N 1 0 257.324 3.868 20 10 CHCDRO Cc1cccc(C[N@H+]2C[C@H](c3ccccc3)OC[C@H]2C)c1O ZINC000245848412 1129229536 /nfs/dbraw/zinc/22/95/36/1129229536.db2.gz LVPSTXSRHAIHQG-CRAIPNDOSA-N 1 0 297.398 3.663 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]Cc2cc(Cl)ccc2O)c1 ZINC000037771076 1129267759 /nfs/dbraw/zinc/26/77/59/1129267759.db2.gz IMKXWWBTSGCJAD-NSHDSACASA-N 1 0 291.778 3.905 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCCC12CCOCC2)c1ccccc1O ZINC000282683814 1129276893 /nfs/dbraw/zinc/27/68/93/1129276893.db2.gz JVGGAMMVGBTEAE-RDJZCZTQSA-N 1 0 289.419 3.782 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)c2cnc(C)s2)cc1C ZINC000090407129 1129287706 /nfs/dbraw/zinc/28/77/06/1129287706.db2.gz CPQLLPZGLDYGTJ-NSHDSACASA-N 1 0 276.405 3.619 20 10 CHCDRO COc1cc(C)cc(C[N@@H+]2C[C@H](C)[C@H]2c2ccccc2)c1O ZINC000246496899 1129287737 /nfs/dbraw/zinc/28/77/37/1129287737.db2.gz KCSZXTFNCPALOS-KSSFIOAISA-N 1 0 297.398 3.902 20 10 CHCDRO CC(C)(C[NH2+]Cc1ccc2c(c1)CCO2)c1ccccc1 ZINC000037934966 1129300515 /nfs/dbraw/zinc/30/05/15/1129300515.db2.gz DGNCPASBTQACGA-UHFFFAOYSA-N 1 0 281.399 3.689 20 10 CHCDRO C[C@@H](Cc1ccccc1Cl)[NH2+]Cc1ccc(N)cc1 ZINC001246167701 1131369538 /nfs/dbraw/zinc/36/95/38/1131369538.db2.gz ABWTVIZPOGCDBV-LBPRGKRZSA-N 1 0 274.795 3.643 20 10 CHCDRO CC(C)(C[NH2+]Cc1ccc2c(c1)CCO2)Cc1ccccc1 ZINC000735323532 1129339081 /nfs/dbraw/zinc/33/90/81/1129339081.db2.gz BWTPLFXAKHGUTD-UHFFFAOYSA-N 1 0 295.426 3.980 20 10 CHCDRO CCCCC[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000735561998 1129351624 /nfs/dbraw/zinc/35/16/24/1129351624.db2.gz GAVZTCUFNNSKPH-UHFFFAOYSA-N 1 0 260.425 3.907 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)[C@@H]2CCCCO2)cc1 ZINC000379300145 1129358489 /nfs/dbraw/zinc/35/84/89/1129358489.db2.gz OYLSWCPZNPUGMR-YJBOKZPZSA-N 1 0 290.451 3.580 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H](C)[C@H]2CCCCO2)cc1 ZINC000379300139 1129358493 /nfs/dbraw/zinc/35/84/93/1129358493.db2.gz OYLSWCPZNPUGMR-CRAIPNDOSA-N 1 0 290.451 3.580 20 10 CHCDRO Cc1cccc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)n1 ZINC000736945584 1129382007 /nfs/dbraw/zinc/38/20/07/1129382007.db2.gz PPTZUVNVRHMTRF-UHFFFAOYSA-N 1 0 297.446 3.867 20 10 CHCDRO CC[C@@H](C)[C@@H]1CCCC[N@@H+]1Cc1cc2c(cc1O)OCO2 ZINC000738056769 1129389734 /nfs/dbraw/zinc/38/97/34/1129389734.db2.gz QCDCZOYKQCPWRK-OCCSQVGLSA-N 1 0 291.391 3.522 20 10 CHCDRO CC[N@H+](Cc1c(O)ccc2ccccc21)C1CCC1 ZINC000738056807 1129389767 /nfs/dbraw/zinc/38/97/67/1129389767.db2.gz ZNWVLHXIJLTFGK-UHFFFAOYSA-N 1 0 255.361 3.920 20 10 CHCDRO CC[C@H](COC)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000738438767 1129393652 /nfs/dbraw/zinc/39/36/52/1129393652.db2.gz CQZQHUSQGLRKJM-QGZVFWFLSA-N 1 0 285.387 3.574 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CCC[C@@H]3CCC[C@@H]32)c1 ZINC000092485805 1129395580 /nfs/dbraw/zinc/39/55/80/1129395580.db2.gz SAQDSZMRMKUTLL-BBRMVZONSA-N 1 0 275.392 3.555 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CCc2ccco2)cc1F ZINC000740001820 1129408755 /nfs/dbraw/zinc/40/87/55/1129408755.db2.gz JHCOLOJQSUOYGB-UHFFFAOYSA-N 1 0 290.382 3.597 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C(C2CC2)C2CC2)cc1F ZINC000740004779 1129409171 /nfs/dbraw/zinc/40/91/71/1129409171.db2.gz WCWVGQONCUXPES-UHFFFAOYSA-N 1 0 290.426 3.950 20 10 CHCDRO COc1ccc(C[NH2+]CC2(c3cccc(F)c3)CC2)cc1C ZINC000740014861 1129410563 /nfs/dbraw/zinc/41/05/63/1129410563.db2.gz WZPKGYORBIIWOB-UHFFFAOYSA-N 1 0 299.389 3.964 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1[C@@H]2Cc3ccccc3[C@H]12)c1cc(F)ccc1O ZINC000248528992 1129421125 /nfs/dbraw/zinc/42/11/25/1129421125.db2.gz WKWWROGTILRYND-XNKSSIQNSA-N 1 0 297.373 3.768 20 10 CHCDRO C[C@H]1CC[N@H+](Cc2cc(C(C)(C)C)cc(O)c2O)[C@H]1C ZINC000751941288 1129422810 /nfs/dbraw/zinc/42/28/10/1129422810.db2.gz MTSRPTSJPUYNGN-RYUDHWBXSA-N 1 0 277.408 3.626 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCO[C@@H](c3ccccc3C)C2)c1 ZINC000093478531 1129424742 /nfs/dbraw/zinc/42/47/42/1129424742.db2.gz KSXFFSPAJXJTGP-LJQANCHMSA-N 1 0 297.398 3.583 20 10 CHCDRO CC[C@H]1CCCCC[N@@H+]1Cc1cccc(OC)c1O ZINC000093530209 1129425545 /nfs/dbraw/zinc/42/55/45/1129425545.db2.gz FLAVMZWKMGAGKA-AWEZNQCLSA-N 1 0 263.381 3.555 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCC[C@@H](Nc3ccccc3)C2)c1 ZINC000093704419 1129427219 /nfs/dbraw/zinc/42/72/19/1129427219.db2.gz WSKTVNDOMKYPFF-GOSISDBHSA-N 1 0 296.414 3.777 20 10 CHCDRO CCSCC[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000741153497 1129430389 /nfs/dbraw/zinc/43/03/89/1129430389.db2.gz VKETWQLSIZQODO-UHFFFAOYSA-N 1 0 292.492 3.862 20 10 CHCDRO C[C@H](Cc1cccs1)[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000094617296 1129448130 /nfs/dbraw/zinc/44/81/30/1129448130.db2.gz HLCODAGVIVTZCQ-MNOVXSKESA-N 1 0 279.380 3.875 20 10 CHCDRO C[C@@H](C[NH2+][C@@H](C)c1cc(F)ccc1O)c1ccccc1 ZINC000094616905 1129448178 /nfs/dbraw/zinc/44/81/78/1129448178.db2.gz WKEMXMMNQUXFMF-STQMWFEESA-N 1 0 273.351 3.986 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCc2ccccc2C1)c1cc(F)ccc1O ZINC000094618067 1129448277 /nfs/dbraw/zinc/44/82/77/1129448277.db2.gz VUKXPMSTGKLXQJ-BLLLJJGKSA-N 1 0 285.362 3.739 20 10 CHCDRO C[C@H](C[NH2+][C@@H](C)c1cc(F)ccc1O)c1ccccc1 ZINC000094616906 1129448357 /nfs/dbraw/zinc/44/83/57/1129448357.db2.gz WKEMXMMNQUXFMF-OLZOCXBDSA-N 1 0 273.351 3.986 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCc2ccccc21)c1cc(F)ccc1O ZINC000094616884 1129448597 /nfs/dbraw/zinc/44/85/97/1129448597.db2.gz UPTQAGQNQKBYRI-BDJLRTHQSA-N 1 0 271.335 3.869 20 10 CHCDRO C[C@@]1(c2ccc(F)cc2)CC[N@H+](Cc2ccccc2O)C1 ZINC000796048051 1129464827 /nfs/dbraw/zinc/46/48/27/1129464827.db2.gz VQFDGAYZDHHQFM-GOSISDBHSA-N 1 0 285.362 3.695 20 10 CHCDRO Cc1cc(C[N@@H+](C)C2CCC2)c(O)c(C(C)(C)C)c1 ZINC000742170414 1129468422 /nfs/dbraw/zinc/46/84/22/1129468422.db2.gz SYPWIFNIYAUPLF-UHFFFAOYSA-N 1 0 261.409 3.982 20 10 CHCDRO CCCN(CCC)c1ccc(C[NH2+][C@H]2CCSC2)cc1 ZINC000742383032 1129473209 /nfs/dbraw/zinc/47/32/09/1129473209.db2.gz RVEWOBJKHSSSPA-INIZCTEOSA-N 1 0 292.492 3.908 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H]2C[C@@H]2Cc2ccccc2)cc1F ZINC000742375695 1129475292 /nfs/dbraw/zinc/47/52/92/1129475292.db2.gz VRGTVGBAIYLAGI-WMZOPIPTSA-N 1 0 298.405 3.613 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)C1CCCCC1 ZINC000742373176 1129475511 /nfs/dbraw/zinc/47/55/11/1129475511.db2.gz GXFGYVSEZKALNM-ZDUSSCGKSA-N 1 0 278.415 3.950 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2CC[C@H]3CCC[C@H]3C2)cc1F ZINC000742378737 1129476304 /nfs/dbraw/zinc/47/63/04/1129476304.db2.gz LNZLVEWAPZEFNL-OWCLPIDISA-N 1 0 290.426 3.950 20 10 CHCDRO C[C@H](C[NH2+]Cc1c(O)cccc1Cl)C(C)(C)C ZINC000096610173 1129545130 /nfs/dbraw/zinc/54/51/30/1129545130.db2.gz RGZYDOGTWGTLDZ-SNVBAGLBSA-N 1 0 255.789 3.817 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2CC[C@H](CC(C)C)C2)cc1C ZINC000744437385 1129578080 /nfs/dbraw/zinc/57/80/80/1129578080.db2.gz RBQDRRULHBSSKV-OAHLLOKOSA-N 1 0 261.409 3.877 20 10 CHCDRO CC(C)C1([NH2+]Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000379743484 1129652517 /nfs/dbraw/zinc/65/25/17/1129652517.db2.gz VZJBMZHRMGYQJL-UHFFFAOYSA-N 1 0 272.436 3.955 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)Cc1ccncc1)c1ccc(N(C)C)cc1 ZINC000766487956 1129669408 /nfs/dbraw/zinc/66/94/08/1129669408.db2.gz IXPBQVVSGYCWPZ-KXBFYZLASA-N 1 0 297.446 3.820 20 10 CHCDRO CO[C@H](C[N@H+](Cc1ccccc1O)C1CCCC1)C1CC1 ZINC000822622180 1131389509 /nfs/dbraw/zinc/38/95/09/1131389509.db2.gz UNLXDIFHIVVDEX-GOSISDBHSA-N 1 0 289.419 3.562 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2C[C@@H](OC)C2(C)C)cc1 ZINC000766531197 1129684318 /nfs/dbraw/zinc/68/43/18/1129684318.db2.gz ZQNWCPHIJDKYFY-IAOVAPTHSA-N 1 0 290.451 3.607 20 10 CHCDRO Cc1ccc([C@H](O)[C@@H](C)[NH2+]Cc2cc(C)c(C)cc2O)cc1 ZINC000796484424 1129748852 /nfs/dbraw/zinc/74/88/52/1129748852.db2.gz YGZBPXYVAUNJHL-DNVCBOLYSA-N 1 0 299.414 3.529 20 10 CHCDRO CCC[C@H](C)[C@@H]1CCC[N@@H+]1Cc1cc2c(cc1O)OCO2 ZINC000767763301 1129813352 /nfs/dbraw/zinc/81/33/52/1129813352.db2.gz LKDVNYCTUQFQIN-JSGCOSHPSA-N 1 0 291.391 3.522 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2c(O)ccc3ccccc32)[C@H]1C ZINC000380743039 1129832071 /nfs/dbraw/zinc/83/20/71/1129832071.db2.gz ULFUALDIZOPRGY-OLZOCXBDSA-N 1 0 255.361 3.776 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+]([C@H](C)C(C)C)C2CC2)c1 ZINC000768138186 1129834729 /nfs/dbraw/zinc/83/47/29/1129834729.db2.gz PPGHPKKYAXBKDX-CYBMUJFWSA-N 1 0 277.408 3.800 20 10 CHCDRO Cc1ccccc1C[N@@H+](C)Cc1cc(Cl)ccc1O ZINC000768160002 1129837925 /nfs/dbraw/zinc/83/79/25/1129837925.db2.gz KFFHOUXLSGWMAR-UHFFFAOYSA-N 1 0 275.779 3.986 20 10 CHCDRO COc1cccc(C[NH2+][C@H]2c3cc(C)ccc3C[C@@H]2C)c1O ZINC000272576379 1129838364 /nfs/dbraw/zinc/83/83/64/1129838364.db2.gz XEOROCQNWJYYLP-SCLBCKFNSA-N 1 0 297.398 3.732 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2cc(C)ccc2O)cc1 ZINC000768172529 1129839037 /nfs/dbraw/zinc/83/90/37/1129839037.db2.gz QMNKGPVDZQZEEE-UHFFFAOYSA-N 1 0 255.361 3.641 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)Cc2ccco2)cc1F ZINC000768183214 1129840134 /nfs/dbraw/zinc/84/01/34/1129840134.db2.gz BAFVRABCORBKKI-UHFFFAOYSA-N 1 0 290.382 3.897 20 10 CHCDRO C[C@H]([NH2+]CC[C@H]1CC1(Cl)Cl)c1ccccc1O ZINC000822812691 1131400973 /nfs/dbraw/zinc/40/09/73/1131400973.db2.gz KOOYSADABAENAR-UWVGGRQHSA-N 1 0 274.191 3.627 20 10 CHCDRO Cc1ccoc1C[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000768256295 1129847449 /nfs/dbraw/zinc/84/74/49/1129847449.db2.gz BBZBPKCNSYYHTH-UHFFFAOYSA-N 1 0 284.403 3.819 20 10 CHCDRO Oc1ccc(-c2ccccc2)cc1C[NH+]1CCSCC1 ZINC000768237913 1129847527 /nfs/dbraw/zinc/84/75/27/1129847527.db2.gz VQVXWKDXIFEVIJ-UHFFFAOYSA-N 1 0 285.412 3.608 20 10 CHCDRO CCOc1ccc(C[N@H+](C)[C@@H](C)c2ccco2)c(O)c1 ZINC000768261311 1129848660 /nfs/dbraw/zinc/84/86/60/1129848660.db2.gz AWFJHXDMNRNZLL-LBPRGKRZSA-N 1 0 275.348 3.577 20 10 CHCDRO CCC(CC)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000020566755 1129849117 /nfs/dbraw/zinc/84/91/17/1129849117.db2.gz KFOKREBZCALLGL-UHFFFAOYSA-N 1 0 260.425 3.955 20 10 CHCDRO CCCC[N@H+](Cc1ccc(OCC)cc1O)C1CC1 ZINC000768290146 1129849452 /nfs/dbraw/zinc/84/94/52/1129849452.db2.gz BUTZMXCRYTWLNC-UHFFFAOYSA-N 1 0 263.381 3.555 20 10 CHCDRO CCc1cccc(C[NH2+][C@@H](C)c2ncc(C)s2)c1O ZINC000691446357 1129850145 /nfs/dbraw/zinc/85/01/45/1129850145.db2.gz NRJIVNBXDLXVSA-NSHDSACASA-N 1 0 276.405 3.570 20 10 CHCDRO CCC[C@@H](C)[N@H+](C)Cc1ccc(N(C)C)c(F)c1 ZINC000768338702 1129852125 /nfs/dbraw/zinc/85/21/25/1129852125.db2.gz OROXAWDMACBKBT-GFCCVEGCSA-N 1 0 252.377 3.512 20 10 CHCDRO COc1cc(C[N@H+](Cc2ccccc2)C2CC2)c(O)cc1C ZINC000768442355 1129856305 /nfs/dbraw/zinc/85/63/05/1129856305.db2.gz SSCNTLSQFWZNKO-UHFFFAOYSA-N 1 0 297.398 3.874 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC000800276623 1129862081 /nfs/dbraw/zinc/86/20/81/1129862081.db2.gz MVUVOEHWIVVRNA-SNVBAGLBSA-N 1 0 289.753 3.961 20 10 CHCDRO CCOCc1cc(C[NH2+][C@H]2CCC(C)(C)C2)ccc1OC ZINC000768662078 1129867401 /nfs/dbraw/zinc/86/74/01/1129867401.db2.gz PHVNMOWUQPMBHC-INIZCTEOSA-N 1 0 291.435 3.900 20 10 CHCDRO Cc1csc(C[NH2+][C@@H]2CCc3cccc(O)c32)c1 ZINC000394120653 1129873758 /nfs/dbraw/zinc/87/37/58/1129873758.db2.gz WOQNARLKMJWGFD-CYBMUJFWSA-N 1 0 259.374 3.539 20 10 CHCDRO c1csc(SCCC[NH2+][C@H]2CCC23CCC3)n1 ZINC000800479726 1129876743 /nfs/dbraw/zinc/87/67/43/1129876743.db2.gz IOVUKVDBZMYSGG-NSHDSACASA-N 1 0 268.451 3.548 20 10 CHCDRO Cc1cc([C@H]2CCC[N@@H+]2Cc2c(O)cccc2Cl)on1 ZINC000768876994 1129879832 /nfs/dbraw/zinc/87/98/32/1129879832.db2.gz FMFGYKPGUCMBPD-CYBMUJFWSA-N 1 0 292.766 3.679 20 10 CHCDRO C[C@H]([NH2+][C@@H]1Cc2ccc(Cl)cc2C1)c1ccccc1O ZINC000800496241 1129880330 /nfs/dbraw/zinc/88/03/30/1129880330.db2.gz UMPACILOIJIFRV-XHDPSFHLSA-N 1 0 287.790 3.864 20 10 CHCDRO CCOCC[N@H+](CC)Cc1cc(-c2ccccc2)ccc1O ZINC000769141323 1129892850 /nfs/dbraw/zinc/89/28/50/1129892850.db2.gz RBNXCNPXVDKVOA-UHFFFAOYSA-N 1 0 299.414 3.918 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC[C@H](c3ccccc3C)C2)c1 ZINC000769231406 1129895819 /nfs/dbraw/zinc/89/58/19/1129895819.db2.gz ATJHJUMJZBJLTF-INIZCTEOSA-N 1 0 281.399 3.999 20 10 CHCDRO COc1cccc(C[N@@H+]2CC[C@@H](c3ccccc3C)C2)c1O ZINC000769232246 1129897447 /nfs/dbraw/zinc/89/74/47/1129897447.db2.gz JIBVBZJTKDPFJD-OAHLLOKOSA-N 1 0 297.398 3.699 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H](O)c2cc(C)cc(C)c2)c1 ZINC000800992884 1129903024 /nfs/dbraw/zinc/90/30/24/1129903024.db2.gz UUUAMNOHZURSEE-DNVCBOLYSA-N 1 0 299.414 3.702 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CC[C@H](c3cccc(F)c3)C2)cc1 ZINC000769341195 1129903755 /nfs/dbraw/zinc/90/37/55/1129903755.db2.gz ZQLIKAGXWRPYGN-KRWDZBQOSA-N 1 0 298.405 3.881 20 10 CHCDRO CCC[N@@H+](Cc1c(O)cccc1Cl)C[C@H]1CCCCO1 ZINC000769337642 1129903921 /nfs/dbraw/zinc/90/39/21/1129903921.db2.gz GQRUTMXOBIZAST-CYBMUJFWSA-N 1 0 297.826 3.827 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CC[C@H](CC(C)C)C2)c1 ZINC000769402552 1129906348 /nfs/dbraw/zinc/90/63/48/1129906348.db2.gz JIYSSPGJJUGDTD-CQSZACIVSA-N 1 0 277.408 3.659 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)CCC1CC1 ZINC000769410979 1129906997 /nfs/dbraw/zinc/90/69/97/1129906997.db2.gz CLCYUDNOFKRLRZ-CQSZACIVSA-N 1 0 260.425 3.729 20 10 CHCDRO C[C@@H]1C[NH+](Cc2ccc(N3CCCCC3)cc2)C[C@H]1C ZINC000769448501 1129911373 /nfs/dbraw/zinc/91/13/73/1129911373.db2.gz SRPOZHBIVYTDHG-HZPDHXFCSA-N 1 0 272.436 3.765 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC[C@H]2Cc2ccccc2)c1 ZINC000769505529 1129915099 /nfs/dbraw/zinc/91/50/99/1129915099.db2.gz CXVMCQKRLIELFR-KRWDZBQOSA-N 1 0 267.372 3.518 20 10 CHCDRO CCC[C@H](C)[C@@H]1CCC[N@@H+]1Cc1cccc(OC)c1O ZINC000769537612 1129916669 /nfs/dbraw/zinc/91/66/69/1129916669.db2.gz MSRKAEYMFXUEEJ-ZFWWWQNUSA-N 1 0 277.408 3.801 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C2CC(OC(C)C)C2)cc1 ZINC000769936421 1129933598 /nfs/dbraw/zinc/93/35/98/1129933598.db2.gz FWWNYQQLDCEJOB-UHFFFAOYSA-N 1 0 290.451 3.578 20 10 CHCDRO COc1cccc(O)c1C[NH2+]CC1CC(c2ccccc2)C1 ZINC000801729907 1129940540 /nfs/dbraw/zinc/94/05/40/1129940540.db2.gz CAENJKCNGLBXBF-UHFFFAOYSA-N 1 0 297.398 3.684 20 10 CHCDRO CS[C@@H]1CCCC[N@H+](Cc2ccc(N(C)C)c(F)c2)C1 ZINC000770348834 1129945942 /nfs/dbraw/zinc/94/59/42/1129945942.db2.gz LOCKKZMHRSPZBU-CQSZACIVSA-N 1 0 296.455 3.609 20 10 CHCDRO CC(C)[N@H+](Cc1cccc(F)c1)Cc1ccccc1O ZINC000770509772 1129948809 /nfs/dbraw/zinc/94/88/09/1129948809.db2.gz TVDUBDXZBUCXOU-UHFFFAOYSA-N 1 0 273.351 3.942 20 10 CHCDRO COc1cccc(C[NH2+][C@H]2CC[C@H](c3ccccc3)C2)c1O ZINC000770740561 1129958086 /nfs/dbraw/zinc/95/80/86/1129958086.db2.gz JAKDNRVROOBBOU-RDJZCZTQSA-N 1 0 297.398 3.827 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCO[C@H](C)C1)c1ccc(N(C)C)cc1 ZINC000771388840 1129979501 /nfs/dbraw/zinc/97/95/01/1129979501.db2.gz PPNQZJDQLHAEAK-VKJFTORMSA-N 1 0 290.451 3.608 20 10 CHCDRO CNc1ccccc1C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000902487806 1130015390 /nfs/dbraw/zinc/01/53/90/1130015390.db2.gz FAILJMIONDEWLB-AWEZNQCLSA-N 1 0 283.419 3.645 20 10 CHCDRO CCOC1(C[NH2+][C@H](C)c2cc(F)ccc2O)CCCC1 ZINC000383718256 1130020179 /nfs/dbraw/zinc/02/01/79/1130020179.db2.gz FRDMQUOAEIFWQQ-GFCCVEGCSA-N 1 0 281.371 3.531 20 10 CHCDRO CCc1cccc(C[NH2+][C@H](C)c2ccccc2)c1O ZINC000691509542 1130020283 /nfs/dbraw/zinc/02/02/83/1130020283.db2.gz WWNIPDMIGYZQBI-CYBMUJFWSA-N 1 0 255.361 3.805 20 10 CHCDRO COc1ccc(C[NH2+]CCc2ccc(F)c(F)c2)cc1C ZINC000786817713 1130119297 /nfs/dbraw/zinc/11/92/97/1130119297.db2.gz CFYRPNRJZLOTKR-UHFFFAOYSA-N 1 0 291.341 3.614 20 10 CHCDRO CN(C)c1ccc(C[N@H+](CC2(C)CC2)C2CC2)cc1 ZINC000787085971 1130128954 /nfs/dbraw/zinc/12/89/54/1130128954.db2.gz CYFAOMXGJWOYJT-UHFFFAOYSA-N 1 0 258.409 3.517 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC[C@@H]2CCCC[C@@H]2O)c(O)c1C ZINC000903265785 1130140552 /nfs/dbraw/zinc/14/05/52/1130140552.db2.gz SSNFLEYNGQHHDZ-ZOBUZTSGSA-N 1 0 291.435 3.601 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C2CC3(C2)CO[C@@H](C)C3)c(O)c1C ZINC000903283109 1130146079 /nfs/dbraw/zinc/14/60/79/1130146079.db2.gz OJXSFPZPDMGBLQ-DPWBBVDGSA-N 1 0 289.419 3.617 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C2CC3(C2)COC(C)(C)C3)c1 ZINC000903325903 1130155012 /nfs/dbraw/zinc/15/50/12/1130155012.db2.gz XJNOLXWSUSOVIC-VNSJNIRKSA-N 1 0 289.419 3.699 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H](c2ccccn2)C2CC2)c1O ZINC000903335282 1130160398 /nfs/dbraw/zinc/16/03/98/1130160398.db2.gz NJLGPUAOJORIRM-SJCJKPOMSA-N 1 0 298.386 3.598 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H](c2ccccn2)C2CC2)c1 ZINC000903334764 1130160738 /nfs/dbraw/zinc/16/07/38/1130160738.db2.gz FZZYHFHVSCBEIK-ACJLOTCBSA-N 1 0 282.387 3.898 20 10 CHCDRO C[C@@H]([NH2+][C@@H](c1ccccn1)C1CC1)c1cc(F)ccc1O ZINC000903335408 1130160869 /nfs/dbraw/zinc/16/08/69/1130160869.db2.gz OTKCLGUPCIYOIV-PIGZYNQJSA-N 1 0 286.350 3.728 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@@H](c1ccccn1)C1CC1)CC2 ZINC000903336507 1130161750 /nfs/dbraw/zinc/16/17/50/1130161750.db2.gz ZOBFKWQQPDZTQY-RDTXWAMCSA-N 1 0 280.371 3.515 20 10 CHCDRO Oc1cc2c(cc1C[N@@H+]1CC[C@@H](c3ccccc3)C1)CCC2 ZINC000746716708 1130167342 /nfs/dbraw/zinc/16/73/42/1130167342.db2.gz RBBZUBYOGQWKAZ-GOSISDBHSA-N 1 0 293.410 3.870 20 10 CHCDRO Cc1ncccc1CC[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000903416137 1130173664 /nfs/dbraw/zinc/17/36/64/1130173664.db2.gz QCRCPMLIUVMGJT-GFCCVEGCSA-N 1 0 290.794 3.642 20 10 CHCDRO C[C@H]([NH2+][C@@H](c1ccncc1)C1CC1)c1ccccc1O ZINC000903430051 1130176738 /nfs/dbraw/zinc/17/67/38/1130176738.db2.gz XGVUJECQWKQHGR-YVEFUNNKSA-N 1 0 268.360 3.589 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CCC(O)(CC)CC)cc1 ZINC000788264039 1130179500 /nfs/dbraw/zinc/17/95/00/1130179500.db2.gz WRJMWACWZYXRPM-HNNXBMFYSA-N 1 0 292.467 3.735 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H](CC(C)C)N(C)C)c(O)c1 ZINC000788505292 1130191050 /nfs/dbraw/zinc/19/10/50/1130191050.db2.gz FYARVPHKFOICRS-HZPDHXFCSA-N 1 0 292.467 3.636 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2cccc(C)n2)c(O)c1 ZINC000788557955 1130194731 /nfs/dbraw/zinc/19/47/31/1130194731.db2.gz RUXCEYGDTFUKQS-AWEZNQCLSA-N 1 0 270.376 3.563 20 10 CHCDRO CC1=CC[C@@H]([NH2+]Cc2ccc3c(c2)CCCN3C)CC1 ZINC000788582581 1130195410 /nfs/dbraw/zinc/19/54/10/1130195410.db2.gz HOMVTMLVZYGDAV-QGZVFWFLSA-N 1 0 270.420 3.657 20 10 CHCDRO CSC1(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)CCC1 ZINC000788604470 1130197559 /nfs/dbraw/zinc/19/75/59/1130197559.db2.gz AUQDBBVFBAGDDV-CMPLNLGQSA-N 1 0 295.423 3.955 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@H]2CCO[C@@H](C(C)C)C2)c(O)c1 ZINC000788652985 1130198226 /nfs/dbraw/zinc/19/82/26/1130198226.db2.gz UREWTZPVQNENES-YQQAZPJKSA-N 1 0 291.435 3.863 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)C1CCC(F)(F)CC1 ZINC000788983115 1130221130 /nfs/dbraw/zinc/22/11/30/1130221130.db2.gz BEIPENFHHJKWFG-GFCCVEGCSA-N 1 0 295.373 3.925 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)C[C@H]2CC[C@H](C)O2)cc1 ZINC000789307255 1130242439 /nfs/dbraw/zinc/24/24/39/1130242439.db2.gz VGIIASMZLPQVJC-MAUKXSAKSA-N 1 0 290.451 3.532 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]C[C@H]1CCC2(CCCCC2)O1 ZINC000792192855 1130437368 /nfs/dbraw/zinc/43/73/68/1130437368.db2.gz RLPVWJFTRZQHAQ-OAHLLOKOSA-N 1 0 293.382 3.503 20 10 CHCDRO CCOCc1cc(C[NH2+]CCC2(C)CC2)ccc1OC ZINC000793200185 1130526568 /nfs/dbraw/zinc/52/65/68/1130526568.db2.gz DMCBBDLQLLJDJL-UHFFFAOYSA-N 1 0 277.408 3.512 20 10 CHCDRO C[C@@H]1CCC[C@@H](C[NH2+]Cc2ccc3ccccc3c2O)O1 ZINC000827251702 1130529575 /nfs/dbraw/zinc/52/95/75/1130529575.db2.gz LGFNZJHJDUMGJS-CJNGLKHVSA-N 1 0 285.387 3.593 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@](C)(OC)C2)cc1 ZINC000793215587 1130530966 /nfs/dbraw/zinc/53/09/66/1130530966.db2.gz CDTJALPZASBKRF-SFHVURJKSA-N 1 0 290.451 3.534 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2CC[C@H](C(F)(F)F)[C@H]2C)cc1C ZINC000793231274 1130532811 /nfs/dbraw/zinc/53/28/11/1130532811.db2.gz LXVWIFMHYQCPIC-YPMHNXCESA-N 1 0 287.325 3.782 20 10 CHCDRO CCOCc1cc(C[NH2+][C@H]2CC23CCCC3)ccc1OC ZINC000758524803 1130543178 /nfs/dbraw/zinc/54/31/78/1130543178.db2.gz KQFIMVRXFDEBMJ-KRWDZBQOSA-N 1 0 289.419 3.654 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)CCc2ccc(C)cc2)c(O)c1 ZINC000793388087 1130552453 /nfs/dbraw/zinc/55/24/53/1130552453.db2.gz LQBILPNJINEMOU-HNNXBMFYSA-N 1 0 299.414 3.820 20 10 CHCDRO CC1=C[C@H](C)C[C@@H](C[N@H+](C)Cc2ccccc2O)C1 ZINC000811458063 1130610700 /nfs/dbraw/zinc/61/07/00/1130610700.db2.gz TXCROBIXTJNZCR-DZGCQCFKSA-N 1 0 259.393 3.816 20 10 CHCDRO CCOCc1cc(C[NH2+]CC(C)(C)CC)ccc1OC ZINC000758478346 1130614332 /nfs/dbraw/zinc/61/43/32/1130614332.db2.gz HDKBQSNCIQOHMW-UHFFFAOYSA-N 1 0 279.424 3.758 20 10 CHCDRO Oc1ccccc1C[NH2+][C@H]1CC[C@H](Cc2ccccc2)C1 ZINC000780520388 1130683009 /nfs/dbraw/zinc/68/30/09/1130683009.db2.gz OMVJJOBLOXKYJU-AEFFLSMTSA-N 1 0 281.399 3.893 20 10 CHCDRO CC[N@H+](Cc1cc(C)cc(C(C)(C)C)c1O)[C@H]1CCOC1 ZINC000812298421 1130684274 /nfs/dbraw/zinc/68/42/74/1130684274.db2.gz MPCWKCFENVQOLB-HNNXBMFYSA-N 1 0 291.435 3.609 20 10 CHCDRO Cc1ccc(O)c(C[N@H+]2C[C@H](C(F)(F)F)CC[C@@H]2C)c1 ZINC000780793937 1130692753 /nfs/dbraw/zinc/69/27/53/1130692753.db2.gz YXIMDSQOQOJZMW-WCQYABFASA-N 1 0 287.325 3.863 20 10 CHCDRO CCCOC1C[NH+](Cc2cccc(-c3ccccc3)c2O)C1 ZINC001234996206 1130701073 /nfs/dbraw/zinc/70/10/73/1130701073.db2.gz WJRIKFKQOSFDMN-UHFFFAOYSA-N 1 0 297.398 3.670 20 10 CHCDRO Oc1c(C[NH+]2CC(C(F)F)C2)cccc1-c1ccccc1 ZINC001235000005 1130701774 /nfs/dbraw/zinc/70/17/74/1130701774.db2.gz OEVPLDNZPUEANR-UHFFFAOYSA-N 1 0 289.325 3.756 20 10 CHCDRO C=Cc1ccc(CC[NH2+][C@@H](C)c2ccccc2O)cc1 ZINC000812733868 1130709951 /nfs/dbraw/zinc/70/99/51/1130709951.db2.gz COIPANGHZAHWDC-AWEZNQCLSA-N 1 0 267.372 3.929 20 10 CHCDRO CO[C@@](C)(C[NH2+][C@H](C)c1cc(Cl)cc(C)c1O)C1CC1 ZINC000812734886 1130710445 /nfs/dbraw/zinc/71/04/45/1130710445.db2.gz UIXVXDAJTBWKFK-BZNIZROVSA-N 1 0 297.826 3.820 20 10 CHCDRO Cc1cccc(CNc2cc3c(c[nH+]2)CCCC3)c1O ZINC000812781834 1130713794 /nfs/dbraw/zinc/71/37/94/1130713794.db2.gz IHJBAUBDQHGNMR-UHFFFAOYSA-N 1 0 268.360 3.587 20 10 CHCDRO CCSC1(C[NH2+][C@@H](C)c2cc(C)ccc2O)CC1 ZINC000691786979 1130717709 /nfs/dbraw/zinc/71/77/09/1130717709.db2.gz GTEXTDXQWBPBEL-LBPRGKRZSA-N 1 0 265.422 3.637 20 10 CHCDRO COc1cc(C)cc(C[N@@H+]2CC[C@]3(CC[C@H](C)C3)C2)c1O ZINC000781585433 1130728467 /nfs/dbraw/zinc/72/84/67/1130728467.db2.gz FTNSDNQVCLYOME-UGSOOPFHSA-N 1 0 289.419 3.721 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[NH2+][C@H]1CCCSCC1 ZINC000692468825 1130740259 /nfs/dbraw/zinc/74/02/59/1130740259.db2.gz PIAYOKRTGHVMBC-INIZCTEOSA-N 1 0 290.476 3.662 20 10 CHCDRO C[C@H]1C[N@H+](Cc2cc3oc4ccccc4c3cc2O)CCO1 ZINC000813169648 1130741203 /nfs/dbraw/zinc/74/12/03/1130741203.db2.gz QLUZLDWALBZKDS-LBPRGKRZSA-N 1 0 297.354 3.512 20 10 CHCDRO Cc1cc(Br)c([O-])c(C[NH+]2[C@H](C)CC[C@H]2C)c1 ZINC000781910015 1130747289 /nfs/dbraw/zinc/74/72/89/1130747289.db2.gz SXBSFUKYNFDDNZ-GHMZBOCLSA-N 1 0 298.224 3.836 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CC[C@@]3(CC[C@@H](C)C3)C2)c1O ZINC000781929326 1130749906 /nfs/dbraw/zinc/74/99/06/1130749906.db2.gz PXLYQZLUYPCNCL-RDTXWAMCSA-N 1 0 289.419 3.803 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CC[C@@]3(CC[C@H](C)C3)C2)c1O ZINC000781929144 1130750516 /nfs/dbraw/zinc/75/05/16/1130750516.db2.gz PXLYQZLUYPCNCL-KBXCAEBGSA-N 1 0 289.419 3.803 20 10 CHCDRO C[C@H]1C[C@@H](CF)[N@H+](Cc2ccc(C(C)(C)C)cc2O)C1 ZINC001235676781 1130766319 /nfs/dbraw/zinc/76/63/19/1130766319.db2.gz UUPHALOQYKJJTG-WFASDCNBSA-N 1 0 279.399 3.870 20 10 CHCDRO CC(C)(C)c1ccc(C[NH+]2C[C@H]3CCC[C@@H]3C2)c(O)c1 ZINC001235674875 1130766661 /nfs/dbraw/zinc/76/66/61/1130766661.db2.gz HKYPVEHVQNOLCD-ZIAGYGMSSA-N 1 0 273.420 3.922 20 10 CHCDRO C[N@H+](CCc1cccnc1)Cc1ccc(C(C)(C)C)cc1O ZINC001235685341 1130768791 /nfs/dbraw/zinc/76/87/91/1130768791.db2.gz OYQISKXVHRKMSA-UHFFFAOYSA-N 1 0 298.430 3.759 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Cc1cc(C)c([C@@H](C)[NH2+][C@H](C)Cc2ccc(O)cc2)c(O)c1 ZINC000815576438 1131008209 /nfs/dbraw/zinc/00/82/09/1131008209.db2.gz QHXNNJRSJXABJR-HUUCEWRRSA-N 1 0 299.414 3.996 20 10 CHCDRO CCc1ccc(C[N@H+](C)CCc2ccc(F)cc2)c(O)c1 ZINC001236795672 1131009500 /nfs/dbraw/zinc/00/95/00/1131009500.db2.gz YORFOFOYMAWICX-UHFFFAOYSA-N 1 0 287.378 3.768 20 10 CHCDRO COc1cc(O)c(C[N@H+](C)CC(C)(C)C)c(Cl)c1 ZINC001236799766 1131010018 /nfs/dbraw/zinc/01/00/18/1131010018.db2.gz QGVKQXPVBZPOGB-UHFFFAOYSA-N 1 0 271.788 3.532 20 10 CHCDRO COc1cc(C)c(C[N@@H+]2CCC[C@H](C)[C@@H](C)C2)c(O)c1 ZINC001236808420 1131010665 /nfs/dbraw/zinc/01/06/65/1131010665.db2.gz PHWPBLZZCYKVMW-JSGCOSHPSA-N 1 0 277.408 3.577 20 10 CHCDRO CCC[C@H]1CCCC[N@@H+]1Cc1c(C)cc(OC)cc1O ZINC001236812246 1131011024 /nfs/dbraw/zinc/01/10/24/1131011024.db2.gz BAOYVTRRASUMCQ-AWEZNQCLSA-N 1 0 277.408 3.864 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[NH2+][C@H]1CC[C@H]1C1CC1 ZINC000797905583 1131013815 /nfs/dbraw/zinc/01/38/15/1131013815.db2.gz 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ZINC001237050137 1131041740 /nfs/dbraw/zinc/04/17/40/1131041740.db2.gz PZFARKQHNXYWCE-GFCCVEGCSA-N 1 0 299.361 3.658 20 10 CHCDRO CC(C)c1ccc(C[N@@H+]2CC[C@@H](c3ccccn3)C2)c(O)c1 ZINC001237053106 1131042722 /nfs/dbraw/zinc/04/27/22/1131042722.db2.gz GSKPIHQFHSVQBV-MRXNPFEDSA-N 1 0 296.414 3.900 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](CO)CC1CCCC1)c1ccccc1O ZINC000798938301 1131062950 /nfs/dbraw/zinc/06/29/50/1131062950.db2.gz WIUOMNMBENMJQL-WBVHZDCISA-N 1 0 291.435 3.622 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](CO)CC2CCCC2)c(O)c1 ZINC000798938540 1131063505 /nfs/dbraw/zinc/06/35/05/1131063505.db2.gz YQEKCCGPTWOUDK-HOCLYGCPSA-N 1 0 291.435 3.540 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]C[C@H](C)CC(C)C)c1 ZINC000799158255 1131072571 /nfs/dbraw/zinc/07/25/71/1131072571.db2.gz ZQXCTBSWRJKGHD-CHWSQXEVSA-N 1 0 265.397 3.734 20 10 CHCDRO Cc1cc(F)cc(C)c1C[N@@H+]1CCc2cccc(O)c2C1 ZINC001237325276 1131083427 /nfs/dbraw/zinc/08/34/27/1131083427.db2.gz IVPVDDWICJLVAX-UHFFFAOYSA-N 1 0 285.362 3.706 20 10 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C[C@@H]1CC[N@H+](Cc2cc(F)cc(Cl)c2[O-])[C@@H](C)C1 ZINC001237798441 1131141603 /nfs/dbraw/zinc/14/16/03/1131141603.db2.gz FNHVHSHUHITTEJ-ZJUUUORDSA-N 1 0 271.763 3.805 20 10 CHCDRO CC(C)[N@H+](Cc1ccc(N2CCCC2)cc1)C1CC1 ZINC001116441155 1131145160 /nfs/dbraw/zinc/14/51/60/1131145160.db2.gz LMGPVDAISYJKNN-UHFFFAOYSA-N 1 0 258.409 3.660 20 10 CHCDRO CC[C@@]1(C)CC[N@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001116444991 1131146547 /nfs/dbraw/zinc/14/65/47/1131146547.db2.gz KQPFNUKPTNVNRO-SFHVURJKSA-N 1 0 272.436 3.909 20 10 CHCDRO Oc1cc(OCc2ccccc2)ccc1C[NH2+]C1CC=CC1 ZINC000817408153 1131158968 /nfs/dbraw/zinc/15/89/68/1131158968.db2.gz FMSOKCALALVVGQ-UHFFFAOYSA-N 1 0 295.382 3.779 20 10 CHCDRO CC[C@H]1C[C@@H]([NH2+]Cc2ccc3ccccc3c2O)CCO1 ZINC000817415769 1131160012 /nfs/dbraw/zinc/16/00/12/1131160012.db2.gz YPTWIOPPXNGZQZ-HOTGVXAUSA-N 1 0 285.387 3.593 20 10 CHCDRO Cc1cc(C[NH2+]C/C=C\c2ccc(N(C)C)cc2)cc(C)n1 ZINC000817410096 1131160447 /nfs/dbraw/zinc/16/04/47/1131160447.db2.gz 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C[C@@H]([NH2+][C@@H]1CCCc2cc(N)ccc21)c1ccccc1O ZINC000817967013 1131194199 /nfs/dbraw/zinc/19/41/99/1131194199.db2.gz CGMFKKMTGLBWLD-SJKOYZFVSA-N 1 0 282.387 3.703 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C)[C@@H](O)C(C)C ZINC001117945671 1131205926 /nfs/dbraw/zinc/20/59/26/1131205926.db2.gz VRQDSGARLKINCJ-FLTUCWPJSA-N 1 0 291.435 3.634 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@@H]1C[C@H](C)O[C@@H]1C ZINC001118005824 1131207794 /nfs/dbraw/zinc/20/77/94/1131207794.db2.gz CRVDQFJJBISXOI-SEBNEYGDSA-N 1 0 289.419 3.652 20 10 CHCDRO Cc1cc(N)cc(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)c1 ZINC001118058853 1131208414 /nfs/dbraw/zinc/20/84/14/1131208414.db2.gz ICWBLGQDKJRKQT-CJNGLKHVSA-N 1 0 296.414 3.929 20 10 CHCDRO C[C@H]([NH2+]CCCCF)c1ccc(Br)cc1O ZINC000390427084 1131219691 /nfs/dbraw/zinc/21/96/91/1131219691.db2.gz MZNRBJYMAOVMSN-VIFPVBQESA-N 1 0 290.176 3.555 20 10 CHCDRO c1csc(SCCC[NH2+][C@H]2CCCC23CCC3)n1 ZINC000823937629 1131448861 /nfs/dbraw/zinc/44/88/61/1131448861.db2.gz DYOOJPINXKFKTR-LBPRGKRZSA-N 1 0 282.478 3.938 20 10 CHCDRO C[N@H+](Cc1cc(-c2ccccc2)ccc1O)CC(C)(C)CO ZINC000824630041 1131477560 /nfs/dbraw/zinc/47/75/60/1131477560.db2.gz ILXSOOGAFRQMPG-UHFFFAOYSA-N 1 0 299.414 3.510 20 10 CHCDRO CC1CC[NH+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC001138213927 1131477722 /nfs/dbraw/zinc/47/77/22/1131477722.db2.gz HLVWQNKVNBMEFW-UHFFFAOYSA-N 1 0 272.436 3.909 20 10 CHCDRO Oc1c(C[N@@H+]2CC[C@@H]2C2CC2)ccc2ccccc21 ZINC000824653359 1131478064 /nfs/dbraw/zinc/47/80/64/1131478064.db2.gz AHWRRGKAXICGBP-MRXNPFEDSA-N 1 0 253.345 3.530 20 10 CHCDRO c1cc(N2CCCCC2)ccc1C[NH+]1CC2(CCC2)C1 ZINC001138215835 1131478234 /nfs/dbraw/zinc/47/82/34/1131478234.db2.gz XBSUSSBLSFUMFF-UHFFFAOYSA-N 1 0 270.420 3.663 20 10 CHCDRO C[C@@]1(CF)CC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC001138215580 1131478248 /nfs/dbraw/zinc/47/82/48/1131478248.db2.gz JZQDGRPCLFYFPU-SFHVURJKSA-N 1 0 290.426 3.858 20 10 CHCDRO Cc1c(C[N@@H+]2C[C@@H]3CCC[C@@H]3C2)c2ccccc2n1C ZINC001138252862 1131482435 /nfs/dbraw/zinc/48/24/35/1131482435.db2.gz XBLCNRRCEGWOPG-GASCZTMLSA-N 1 0 268.404 3.719 20 10 CHCDRO C[C@@]1(C[NH2+]Cc2c(O)cccc2Cl)CC1(Cl)Cl ZINC000824765852 1131482517 /nfs/dbraw/zinc/48/25/17/1131482517.db2.gz PTFJLWHPWLRIDQ-NSHDSACASA-N 1 0 294.609 3.719 20 10 CHCDRO Cc1c(C[N@@H+]2CCC(C)(C)C2)c2ccccc2n1C ZINC001138256976 1131482972 /nfs/dbraw/zinc/48/29/72/1131482972.db2.gz QYIQDDYLLLTOMW-UHFFFAOYSA-N 1 0 256.393 3.719 20 10 CHCDRO Cc1c(C[N@@H+]2CC[C@@]3(CC3(F)F)C2)c2ccccc2n1C ZINC001138256911 1131483254 /nfs/dbraw/zinc/48/32/54/1131483254.db2.gz PAWSCUCPMYIYLB-MRXNPFEDSA-N 1 0 290.357 3.718 20 10 CHCDRO CO[C@@H]1CC[N@H+](Cc2cc(Cl)cc(C)c2O)CC1(C)C ZINC000824821300 1131485929 /nfs/dbraw/zinc/48/59/29/1131485929.db2.gz XWENKISOBFXSFX-CQSZACIVSA-N 1 0 297.826 3.601 20 10 CHCDRO CN1CCCc2cc(C[N@@H+]3CCC[C@@H](C(F)F)C3)ccc21 ZINC001138358680 1131494269 /nfs/dbraw/zinc/49/42/69/1131494269.db2.gz XKJAKPSTQNHCOX-OAHLLOKOSA-N 1 0 294.389 3.546 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CC2(CCC2)[C@@H]1c1ccco1 ZINC000825104291 1131495497 /nfs/dbraw/zinc/49/54/97/1131495497.db2.gz SRBKMBWEOTXLAJ-INIZCTEOSA-N 1 0 269.344 3.712 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)C2CC(C)C2)c(OC)c1 ZINC001138386397 1131497472 /nfs/dbraw/zinc/49/74/72/1131497472.db2.gz LTNNGCHJSHTBRF-UHFFFAOYSA-N 1 0 290.451 3.772 20 10 CHCDRO CCOCCC1(C[NH2+]Cc2cc(Cl)c(C)cc2O)CC1 ZINC000825371205 1131509527 /nfs/dbraw/zinc/50/95/27/1131509527.db2.gz UXIZEGKAVSHODI-UHFFFAOYSA-N 1 0 297.826 3.650 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CC[C@@H]2CCO[C@@H](C)C2)cc1Cl ZINC000825497235 1131513272 /nfs/dbraw/zinc/51/32/72/1131513272.db2.gz DWGOMZGQGUYSCP-QWHCGFSZSA-N 1 0 297.826 3.649 20 10 CHCDRO Cc1cc(C[NH+]2CCC3(CC3(F)F)CC2)ccc1N(C)C ZINC000844410614 1131559311 /nfs/dbraw/zinc/55/93/11/1131559311.db2.gz UCGSQVDSSZZYCA-UHFFFAOYSA-N 1 0 294.389 3.682 20 10 CHCDRO CN(C)c1ccc(C[NH2+]Cc2cccc3c2CCC3)cc1 ZINC000845921843 1131668024 /nfs/dbraw/zinc/66/80/24/1131668024.db2.gz RFPMRTDMYVFWPM-UHFFFAOYSA-N 1 0 280.415 3.531 20 10 CHCDRO COc1cccc(CC[N@H+](C)Cc2c(C)ccc(C)c2O)c1 ZINC001140182071 1131672926 /nfs/dbraw/zinc/67/29/26/1131672926.db2.gz HTXCDLLIDVAKEN-UHFFFAOYSA-N 1 0 299.414 3.692 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCC[C@H]2Cc2ccccn2)c1O ZINC001140182495 1131672992 /nfs/dbraw/zinc/67/29/92/1131672992.db2.gz SJVDYPKSWFVWSH-KRWDZBQOSA-N 1 0 296.414 3.611 20 10 CHCDRO Cc1ccc2c(c1)C[N@@H+](Cc1c(C)ccc(C)c1O)CC2 ZINC001140178366 1131673137 /nfs/dbraw/zinc/67/31/37/1131673137.db2.gz JPUYHASONVJOEQ-UHFFFAOYSA-N 1 0 281.399 3.876 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)C2CCSCC2)c1 ZINC000845972760 1131673453 /nfs/dbraw/zinc/67/34/53/1131673453.db2.gz UCXDCZULFYURFC-NEPJUHHUSA-N 1 0 295.448 3.583 20 10 CHCDRO Cc1cccc(CC[N@@H+](C)Cc2c(C)ccc(C)c2O)c1 ZINC001140182225 1131673532 /nfs/dbraw/zinc/67/35/32/1131673532.db2.gz LIZYULBUSGUZLQ-UHFFFAOYSA-N 1 0 283.415 3.992 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cc(Cl)cs2)c1 ZINC000845970883 1131673599 /nfs/dbraw/zinc/67/35/99/1131673599.db2.gz FDLVTVLRAHDKBT-VIFPVBQESA-N 1 0 297.807 3.967 20 10 CHCDRO COC[C@@H](CC(C)(C)C)[NH2+][C@H](C)c1cc(OC)ccc1O ZINC000845970840 1131673668 /nfs/dbraw/zinc/67/36/68/1131673668.db2.gz DBEZWYLXMNTUDI-CHWSQXEVSA-N 1 0 295.423 3.503 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)CCC(F)(F)F)c1 ZINC000845970867 1131673753 /nfs/dbraw/zinc/67/37/53/1131673753.db2.gz DUWRINQLHSTIFN-UWVGGRQHSA-N 1 0 291.313 3.782 20 10 CHCDRO Cc1cc(F)c(C[NH2+][C@H](C)c2ccccc2O)c(F)c1 ZINC000845989365 1131674884 /nfs/dbraw/zinc/67/48/84/1131674884.db2.gz GPJJUCVHSFVRKY-LLVKDONJSA-N 1 0 277.314 3.830 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCCC[C@H]2SC)c1 ZINC000846009627 1131677785 /nfs/dbraw/zinc/67/77/85/1131677785.db2.gz GCONUZKKIICBDZ-DJSGYFEHSA-N 1 0 295.448 3.726 20 10 CHCDRO CC(C)c1ncc(C[NH2+]Cc2cc(Cl)ccc2O)s1 ZINC000846057276 1131678779 /nfs/dbraw/zinc/67/87/79/1131678779.db2.gz GIAJNQOWYJCTIT-UHFFFAOYSA-N 1 0 296.823 3.915 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H]2C[C@H]2c2ccccc2C)c1 ZINC000846025002 1131679259 /nfs/dbraw/zinc/67/92/59/1131679259.db2.gz DLPMQPRBBZZPGH-JEBQAFNWSA-N 1 0 297.398 3.916 20 10 CHCDRO C[C@@H]1CCCC[C@H]1OCC[NH2+][C@H]1CCc2cccc(O)c21 ZINC000834522362 1131680593 /nfs/dbraw/zinc/68/05/93/1131680593.db2.gz AOKDFOJHLCEYBX-UKPHBRMFSA-N 1 0 289.419 3.564 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CC[C@]2(C)C[C@@]2(F)Cl)cc1C ZINC000846032534 1131680911 /nfs/dbraw/zinc/68/09/11/1131680911.db2.gz AQENRVKWZAVGMS-CABCVRRESA-N 1 0 285.790 3.803 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CC[C@]2(C)C[C@]2(F)Cl)cc1C ZINC000846032542 1131681201 /nfs/dbraw/zinc/68/12/01/1131681201.db2.gz AQENRVKWZAVGMS-HUUCEWRRSA-N 1 0 285.790 3.803 20 10 CHCDRO C[C@H](Cc1ccccc1F)[NH2+][C@H]1CCc2cccc(O)c21 ZINC000834526340 1131682005 /nfs/dbraw/zinc/68/20/05/1131682005.db2.gz GYKOGXZEJWQVAM-WBMJQRKESA-N 1 0 285.362 3.739 20 10 CHCDRO C[C@@H]([NH2+]Cc1cc(Cl)ccc1O)C1CCSCC1 ZINC000846055877 1131685174 /nfs/dbraw/zinc/68/51/74/1131685174.db2.gz RBTBGLODWYNRFV-SNVBAGLBSA-N 1 0 285.840 3.667 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000834590831 1131685970 /nfs/dbraw/zinc/68/59/70/1131685970.db2.gz ZIBHQDCQVZNPQD-QGZVFWFLSA-N 1 0 296.414 3.544 20 10 CHCDRO COc1cccc2c1CC[C@@H]2[NH2+][C@H]1CCc2cccc(O)c21 ZINC000834625157 1131688202 /nfs/dbraw/zinc/68/82/02/1131688202.db2.gz UUPOPYUCSXIRLM-HOTGVXAUSA-N 1 0 295.382 3.665 20 10 CHCDRO CCc1cccc(C[NH2+]Cc2cc(C)c(C)cc2O)c1 ZINC000846100960 1131689090 /nfs/dbraw/zinc/68/90/90/1131689090.db2.gz WKDUVFRGBPNHAA-UHFFFAOYSA-N 1 0 269.388 3.861 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]C(C(C)C)C(C)C)c1O ZINC000846158042 1131692378 /nfs/dbraw/zinc/69/23/78/1131692378.db2.gz ZKWLIWUTXSCUSK-GFCCVEGCSA-N 1 0 265.397 3.732 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]C[C@H](SC)C(C)(C)C)c1O ZINC000846166554 1131692747 /nfs/dbraw/zinc/69/27/47/1131692747.db2.gz ZEFLOADQTGBTOV-FZMZJTMJSA-N 1 0 297.464 3.829 20 10 CHCDRO CC[C@@H](CC(F)(F)F)[NH2+][C@H](C)c1cccc(OC)c1O ZINC000846161700 1131693009 /nfs/dbraw/zinc/69/30/09/1131693009.db2.gz BBGINCUXKLHNCM-ZJUUUORDSA-N 1 0 291.313 3.782 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@H](C)c2ccccc2)c1O ZINC000846136535 1131693644 /nfs/dbraw/zinc/69/36/44/1131693644.db2.gz JVZXGRGCWSRFKB-CHWSQXEVSA-N 1 0 271.360 3.813 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CCC2=CCCCC2)c1O ZINC000846138780 1131693656 /nfs/dbraw/zinc/69/36/56/1131693656.db2.gz UBEZVSHUDZVJDE-ZDUSSCGKSA-N 1 0 275.392 3.942 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]Cc2ccccc2C)c1O ZINC000846137793 1131693676 /nfs/dbraw/zinc/69/36/76/1131693676.db2.gz QNORKZXHVDDZQG-ZDUSSCGKSA-N 1 0 271.360 3.560 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]C[C@H]2C[C@@H]2c2ccccc2)c1O ZINC000846171770 1131693683 /nfs/dbraw/zinc/69/36/83/1131693683.db2.gz HLQLCSBZRYHPFF-FRFSOERESA-N 1 0 297.398 3.855 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H](C)c2ccccc2)c1O ZINC000846136537 1131693831 /nfs/dbraw/zinc/69/38/31/1131693831.db2.gz JVZXGRGCWSRFKB-OLZOCXBDSA-N 1 0 271.360 3.813 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@@H](C)C2CCCC2)c1O ZINC000846144844 1131694787 /nfs/dbraw/zinc/69/47/87/1131694787.db2.gz MINVRIHSPWSSHZ-NWDGAFQWSA-N 1 0 263.381 3.630 20 10 CHCDRO COc1ccc(C2([NH2+][C@H]3CCc4cccc(O)c43)CC2)cc1 ZINC000834718419 1131697012 /nfs/dbraw/zinc/69/70/12/1131697012.db2.gz VBNTWOXUALELCP-INIZCTEOSA-N 1 0 295.382 3.667 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)[C@@](C)(O)c2ccccc2)c1 ZINC000846188672 1131697520 /nfs/dbraw/zinc/69/75/20/1131697520.db2.gz OGDPAMVRULKMGR-YZVOILCLSA-N 1 0 299.414 3.647 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C2CC2)C2CCOCC2)c1 ZINC000846187593 1131697705 /nfs/dbraw/zinc/69/77/05/1131697705.db2.gz LDWNUOCXJKMDMT-SCLBCKFNSA-N 1 0 289.419 3.556 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](C)COCC2CC2)cc1 ZINC000846203059 1131700199 /nfs/dbraw/zinc/70/01/99/1131700199.db2.gz DQCHRHRCYIMNGU-LSDHHAIUSA-N 1 0 290.451 3.608 20 10 CHCDRO Cc1cccc2c1CC[N@H+](Cc1c(O)cccc1Cl)C2 ZINC001140338035 1131702621 /nfs/dbraw/zinc/70/26/21/1131702621.db2.gz SADRUWMPRQHYDO-UHFFFAOYSA-N 1 0 287.790 3.912 20 10 CHCDRO Oc1cccc(Cl)c1C[NH+]1CCC2(CC(F)C2)CC1 ZINC001140338006 1131702670 /nfs/dbraw/zinc/70/26/70/1131702670.db2.gz QPQIKKQHKSPOCJ-UHFFFAOYSA-N 1 0 283.774 3.760 20 10 CHCDRO C[C@]1(F)CCC[N@H+](Cc2c(O)cccc2Cl)CC1 ZINC001140338126 1131702712 /nfs/dbraw/zinc/70/27/12/1131702712.db2.gz VYNGKGTYJDPFQP-AWEZNQCLSA-N 1 0 271.763 3.760 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CC[C@H]2CCC[C@H]2C1 ZINC001140339491 1131702894 /nfs/dbraw/zinc/70/28/94/1131702894.db2.gz VNMPEGHADDFPAQ-NEPJUHHUSA-N 1 0 265.784 3.668 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CCC[C@@H](C(F)F)C1 ZINC001140341509 1131703778 /nfs/dbraw/zinc/70/37/78/1131703778.db2.gz SATIVZHQRPWNDB-SECBINFHSA-N 1 0 275.726 3.523 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@H]1C[C@H](c3ccccc3)C1)CC2 ZINC000834790727 1131705216 /nfs/dbraw/zinc/70/52/16/1131705216.db2.gz VDEFTRSLHISLCA-BRWVUGGUSA-N 1 0 279.383 3.915 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)CC2 ZINC000834811901 1131707718 /nfs/dbraw/zinc/70/77/18/1131707718.db2.gz YUXLIZPAFGFEDC-ULQDDVLXSA-N 1 0 279.383 3.773 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CCOC1(C)C)c1cc(Cl)ccc1O ZINC000834875798 1131716217 /nfs/dbraw/zinc/71/62/17/1131716217.db2.gz UMCLNSXXVCXAQJ-OCCSQVGLSA-N 1 0 283.799 3.654 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCOC2(CCC2)C1)c1cc(F)ccc1O ZINC000834881799 1131716640 /nfs/dbraw/zinc/71/66/40/1131716640.db2.gz BHIHEXYMKJSEEJ-CHWSQXEVSA-N 1 0 293.382 3.531 20 10 CHCDRO CC[C@](C)(C[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O)OC ZINC000834882552 1131716861 /nfs/dbraw/zinc/71/68/61/1131716861.db2.gz ROUOEGHWQHFCSU-XHDPSFHLSA-N 1 0 285.815 3.820 20 10 CHCDRO CC[C@H]([NH2+]C[C@](C)(CC)OC)c1ccc(N(C)C)cc1 ZINC000834881955 1131717542 /nfs/dbraw/zinc/71/75/42/1131717542.db2.gz GVQKYSZTDJMOFO-IRXDYDNUSA-N 1 0 278.440 3.608 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCO[C@@H](C(C)C)C2)c(O)c1 ZINC000834886220 1131718396 /nfs/dbraw/zinc/71/83/96/1131718396.db2.gz QXKSNJNGMKIPTJ-RLFYNMQTSA-N 1 0 291.435 3.802 20 10 CHCDRO CCn1ccnc1[C@H](C)[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000834893294 1131720769 /nfs/dbraw/zinc/72/07/69/1131720769.db2.gz FHOBCAYPTALJMO-MNOVXSKESA-N 1 0 293.798 3.674 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CC(C)(C)C(C)(C)O)cc1 ZINC000834902962 1131727051 /nfs/dbraw/zinc/72/70/51/1131727051.db2.gz MGDDLXMOZUXLIR-CQSZACIVSA-N 1 0 292.467 3.590 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2cnc(C)cc2C)c(O)c1 ZINC000834903986 1131728499 /nfs/dbraw/zinc/72/84/99/1131728499.db2.gz UPXXEZCAJKRDMN-HNNXBMFYSA-N 1 0 284.403 3.872 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccc(C)cn1)c1ccc(C)cc1O ZINC000834909076 1131729878 /nfs/dbraw/zinc/72/98/78/1131729878.db2.gz KHMSGOWULFSKBD-KRWDZBQOSA-N 1 0 284.403 3.687 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCOC(C)(C)C1)c1ccc(N(C)C)cc1 ZINC000834912138 1131731700 /nfs/dbraw/zinc/73/17/00/1131731700.db2.gz WHBMKKODEINOCR-GJZGRUSLSA-N 1 0 290.451 3.608 20 10 CHCDRO Oc1cc(Cl)ccc1C[NH+]1C[C@H]2CCCC[C@@H]2C1 ZINC001140463109 1131748564 /nfs/dbraw/zinc/74/85/64/1131748564.db2.gz SOMMIQVHWMQHPV-VXGBXAGGSA-N 1 0 265.784 3.668 20 10 CHCDRO C[C@@H]1CCCC[N@H+](Cc2ccc(Cl)cc2O)C1 ZINC001140461631 1131749223 /nfs/dbraw/zinc/74/92/23/1131749223.db2.gz OFVVENBTEZXYMC-LLVKDONJSA-N 1 0 253.773 3.668 20 10 CHCDRO CC(C)C1CC[NH+](Cc2ccc(Cl)cc2O)CC1 ZINC001140465054 1131750180 /nfs/dbraw/zinc/75/01/80/1131750180.db2.gz GJQYQNSAZDUXDN-UHFFFAOYSA-N 1 0 267.800 3.914 20 10 CHCDRO Oc1cc(Cl)ccc1C[NH+]1CCCCCCC1 ZINC001140466962 1131753069 /nfs/dbraw/zinc/75/30/69/1131753069.db2.gz NQEHGVHVVAPHQR-UHFFFAOYSA-N 1 0 253.773 3.812 20 10 CHCDRO CN(C)c1ccc(/C=C/C[N@@H+]2CCC[C@H]2c2ccc[nH]2)cc1 ZINC000835025437 1131758736 /nfs/dbraw/zinc/75/87/36/1131758736.db2.gz VJSMIJQBRIRMEH-OQBYNLHGSA-N 1 0 295.430 3.931 20 10 CHCDRO C[C@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)c1ccccn1 ZINC000835033104 1131760653 /nfs/dbraw/zinc/76/06/53/1131760653.db2.gz CKCMZHQIOZXXDL-LFAOLKIESA-N 1 0 281.403 3.512 20 10 CHCDRO C[C@H](Cc1ccco1)[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC000835036646 1131761225 /nfs/dbraw/zinc/76/12/25/1131761225.db2.gz PSMNLMIZQNZCMZ-ZDTYVGOBSA-N 1 0 284.403 3.580 20 10 CHCDRO C[C@@H]1CC[N@H+](C/C=C/c2ccc(N(C)C)cc2)CCS1 ZINC000835049786 1131765581 /nfs/dbraw/zinc/76/55/81/1131765581.db2.gz STKOCIBOBBUGLU-MBVDDHJVSA-N 1 0 290.476 3.593 20 10 CHCDRO C[C@H]1C[N@H+](C/C=C/c2ccc(N(C)C)cc2)CCC1(F)F ZINC000835052566 1131766701 /nfs/dbraw/zinc/76/67/01/1131766701.db2.gz HGIPBKOSEGXUTD-NNTXTVRGSA-N 1 0 294.389 3.743 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+][C@H]2CCC2(C)C)cc1 ZINC000835052589 1131767133 /nfs/dbraw/zinc/76/71/33/1131767133.db2.gz GXOGBVHYDZSGBI-JFDDCEBESA-N 1 0 258.409 3.544 20 10 CHCDRO Cc1cccc(CC[N@@H+](C)Cc2cc(C)ccc2O)c1 ZINC001140621064 1131831450 /nfs/dbraw/zinc/83/14/50/1131831450.db2.gz NQRHGWYTVZUKQG-UHFFFAOYSA-N 1 0 269.388 3.684 20 10 CHCDRO Cc1ccc(O)c(C[NH+]2CCC3(CC[C@H](F)C3)CC2)c1 ZINC001140622955 1131831532 /nfs/dbraw/zinc/83/15/32/1131831532.db2.gz IIQJUBHAWDURFL-HNNXBMFYSA-N 1 0 277.383 3.805 20 10 CHCDRO Cc1c(O)ccc(C[N@@H+]2Cc3ccccc3[C@H](C)C2)c1O ZINC001140742178 1131905380 /nfs/dbraw/zinc/90/53/80/1131905380.db2.gz JLWUIYNQCNUAFS-GFCCVEGCSA-N 1 0 283.371 3.526 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)C1CCC1)c1ccc(N(C)C)cc1 ZINC000773102069 1131945512 /nfs/dbraw/zinc/94/55/12/1131945512.db2.gz FLGJCKREUJYDOY-SUMWQHHRSA-N 1 0 260.425 3.982 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H](C)[C@H]2C)c(O)c1 ZINC001140855227 1131948107 /nfs/dbraw/zinc/94/81/07/1131948107.db2.gz SKADXVOFYZGION-HUUCEWRRSA-N 1 0 290.451 3.859 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2C[C@@H](C)CC23CC3)c(O)c1 ZINC001140857579 1131948889 /nfs/dbraw/zinc/94/88/89/1131948889.db2.gz ROZZWFHLXMSDKV-AWEZNQCLSA-N 1 0 288.435 3.613 20 10 CHCDRO CC[C@H]1CCC[N@@H+]1Cc1ccc(N(CC)CC)cc1O ZINC001140855439 1131949110 /nfs/dbraw/zinc/94/91/10/1131949110.db2.gz YZUPGOUQBZFLTJ-HNNXBMFYSA-N 1 0 276.424 3.613 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H](C)c2ccc[nH]2)cc1 ZINC000773118336 1131951108 /nfs/dbraw/zinc/95/11/08/1131951108.db2.gz OBJVLKUDMMBYEO-ZIAGYGMSSA-N 1 0 271.408 3.883 20 10 CHCDRO C[C@@H]1CCN(Cc2ccc(N(C)C)cc2Cl)C[C@H]1F ZINC001140921432 1131963144 /nfs/dbraw/zinc/96/31/44/1131963144.db2.gz CTKMARGCBGTEPT-IAQYHMDHSA-N 1 0 284.806 3.586 20 10 CHCDRO [NH3+]Cc1cccc(NCc2cc3ccccc3cc2O)c1 ZINC001171404525 1131970017 /nfs/dbraw/zinc/97/00/17/1131970017.db2.gz FETMYGVJGWTEBI-UHFFFAOYSA-N 1 0 278.355 3.616 20 10 CHCDRO Cc1ccc(C[N@@H+]2CCC[C@@H](Oc3ccccc3)C2)c(O)c1 ZINC001140949538 1131970411 /nfs/dbraw/zinc/97/04/11/1131970411.db2.gz CZNXNIUBLISWRE-GOSISDBHSA-N 1 0 297.398 3.744 20 10 CHCDRO CC[C@@H]([NH2+]CC[C@@H]1CCCS1)c1ccccc1O ZINC000715697801 1131989833 /nfs/dbraw/zinc/98/98/33/1131989833.db2.gz QLFKQEPUCUHSHK-GXTWGEPZSA-N 1 0 265.422 3.719 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1ccns1)c1ccccc1O ZINC000715968423 1132000281 /nfs/dbraw/zinc/00/02/81/1132000281.db2.gz VKPYEYKNWFLKFY-PWSUYJOCSA-N 1 0 262.378 3.651 20 10 CHCDRO CC[C@@H]1CCC[N@@H+]1Cc1cc2c3c(c1)CCCN3CCC2 ZINC001141076466 1132005969 /nfs/dbraw/zinc/00/59/69/1132005969.db2.gz SLSVPWFKPZCTHN-GOSISDBHSA-N 1 0 284.447 3.760 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)c1ccc(N(C)C)cc1)c1ccncc1 ZINC000037217758 1132023229 /nfs/dbraw/zinc/02/32/29/1132023229.db2.gz KNWMIJWVRKVFFE-ZIAGYGMSSA-N 1 0 269.392 3.559 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccncc1)c1ccc(N(C)C)cc1 ZINC000037217756 1132023678 /nfs/dbraw/zinc/02/36/78/1132023678.db2.gz KNWMIJWVRKVFFE-KGLIPLIRSA-N 1 0 269.392 3.559 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]CC2CCCCC2)c1 ZINC000037259488 1132024630 /nfs/dbraw/zinc/02/46/30/1132024630.db2.gz BSLJJXLNCMIKKV-LBPRGKRZSA-N 1 0 263.381 3.632 20 10 CHCDRO c1cc(C[NH2+]C23CC4CC(CC(C4)C2)C3)cc2c1OCC2 ZINC000037362365 1132030395 /nfs/dbraw/zinc/03/03/95/1132030395.db2.gz JYOZIPZIGWLIKZ-UHFFFAOYSA-N 1 0 283.415 3.680 20 10 CHCDRO c1ccc2c(c1)CCC[C@H]2[NH2+]Cc1ccc2c(c1)CCO2 ZINC000037362819 1132030708 /nfs/dbraw/zinc/03/07/08/1132030708.db2.gz WMRRZGUCVSBQSG-GOSISDBHSA-N 1 0 279.383 3.789 20 10 CHCDRO Cc1cccc2c1CC[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)C2 ZINC001171557952 1132054290 /nfs/dbraw/zinc/05/42/90/1132054290.db2.gz XVKFRPBYWIRDKP-GOSISDBHSA-N 1 0 294.442 3.708 20 10 CHCDRO Cc1cccc2c1CC[C@@H]([N@H+](C)Cc1ccccc1O)C2 ZINC001171574871 1132061264 /nfs/dbraw/zinc/06/12/64/1132061264.db2.gz QMJIFDATIWHGSX-QGZVFWFLSA-N 1 0 281.399 3.690 20 10 CHCDRO Cc1ccc(CC[C@H](C)[NH2+]Cc2cccc(O)c2O)cc1 ZINC001171664074 1132072020 /nfs/dbraw/zinc/07/20/20/1132072020.db2.gz REOZTTWDHGVNJZ-AWEZNQCLSA-N 1 0 285.387 3.517 20 10 CHCDRO CC[C@H](C)OCC[C@H](C)[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001172349564 1132181894 /nfs/dbraw/zinc/18/18/94/1132181894.db2.gz VKCSJVVPXLNKQT-HOTGVXAUSA-N 1 0 292.467 3.778 20 10 CHCDRO CC[C@H](C)OCC[C@@H](C)[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001172349563 1132182089 /nfs/dbraw/zinc/18/20/89/1132182089.db2.gz VKCSJVVPXLNKQT-CVEARBPZSA-N 1 0 292.467 3.778 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH+]2CC(CC(F)(F)F)C2)cc1 ZINC000839137306 1132182841 /nfs/dbraw/zinc/18/28/41/1132182841.db2.gz DQFHAOSEMDHYDF-ARJAWSKDSA-N 1 0 298.352 3.650 20 10 CHCDRO Oc1ccc(C[NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)cc1O ZINC001172552514 1132265779 /nfs/dbraw/zinc/26/57/79/1132265779.db2.gz FQRKADLZVQMFMS-HZPDHXFCSA-N 1 0 283.371 3.524 20 10 CHCDRO CC[C@@H]([NH2+]C1CCC(OC)CC1)c1ccc(N(C)C)cc1 ZINC000840791787 1132287966 /nfs/dbraw/zinc/28/79/66/1132287966.db2.gz BTKXMUQXMWNZNP-VMWRSERWSA-N 1 0 290.451 3.751 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)[C@@](C)(OC)C1CC1)c1ccc(C)cc1O ZINC000840858839 1132296270 /nfs/dbraw/zinc/29/62/70/1132296270.db2.gz GZHIPPALFDWLBD-QANKJYHBSA-N 1 0 291.435 3.945 20 10 CHCDRO COc1cccc(C[NH2+]Cc2c(O)cc(C)cc2Cl)c1 ZINC000840877023 1132300175 /nfs/dbraw/zinc/30/01/75/1132300175.db2.gz RVRNJPGILVBIOI-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO COCC1CCC([NH2+][C@H](C)c2c(C)cc(C)cc2O)CC1 ZINC000840875840 1132300718 /nfs/dbraw/zinc/30/07/18/1132300718.db2.gz JMOZRVBVKLUPLV-QQFBHYJXSA-N 1 0 291.435 3.865 20 10 CHCDRO COC1([C@H](C)[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)CCC1 ZINC000840883489 1132302925 /nfs/dbraw/zinc/30/29/25/1132302925.db2.gz DIZCIWZZYRJFPR-NEPJUHHUSA-N 1 0 297.826 3.962 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC(C)(C)c2cccnc2)c(O)c1 ZINC000840892476 1132303824 /nfs/dbraw/zinc/30/38/24/1132303824.db2.gz UBFLVIQEATVXBD-AWEZNQCLSA-N 1 0 284.403 3.724 20 10 CHCDRO CCn1cc[nH+]c1NCc1ccc(N2CCCCC2)cc1 ZINC000840887016 1132304842 /nfs/dbraw/zinc/30/48/42/1132304842.db2.gz RXBDPIFYNRKHLP-UHFFFAOYSA-N 1 0 284.407 3.505 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CC(C)(C)c2cccnc2)c1 ZINC000840890364 1132304881 /nfs/dbraw/zinc/30/48/81/1132304881.db2.gz ADEFYVVJCKHIOX-AWEZNQCLSA-N 1 0 284.403 3.724 20 10 CHCDRO Cc1cc([C@@H]2CCC[N@H+]2Cc2ccc(N(C)C)cc2C)no1 ZINC000840910512 1132307536 /nfs/dbraw/zinc/30/75/36/1132307536.db2.gz ONERFAMQHXNKKQ-SFHVURJKSA-N 1 0 299.418 3.695 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@H](C)c2ccncc2)c(Cl)c1 ZINC000840903520 1132307625 /nfs/dbraw/zinc/30/76/25/1132307625.db2.gz ONISRWLYVGVCLA-LBPRGKRZSA-N 1 0 290.794 3.642 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H]2CCO[C@@H](C(C)C)C2)c(Cl)c1 ZINC000840908857 1132307753 /nfs/dbraw/zinc/30/77/53/1132307753.db2.gz YLZDAPYLVGZNDS-BLLLJJGKSA-N 1 0 297.826 3.647 20 10 CHCDRO CO[C@@H](C[NH2+]Cc1ccc(N(C)C)cc1C)c1ccccc1 ZINC000840929491 1132310229 /nfs/dbraw/zinc/31/02/29/1132310229.db2.gz MKCJQHYLCFMTPT-IBGZPJMESA-N 1 0 298.430 3.538 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@H+]1CC=C(C(F)(F)F)CC1 ZINC000840918273 1132310390 /nfs/dbraw/zinc/31/03/90/1132310390.db2.gz YXSDEOGFMUGRCJ-UHFFFAOYSA-N 1 0 298.352 3.755 20 10 CHCDRO COCC[C@@H](C)C[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000840955865 1132313842 /nfs/dbraw/zinc/31/38/42/1132313842.db2.gz YVWLWEHGRMXDIQ-OAHLLOKOSA-N 1 0 299.414 3.821 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@@H]2CCOC(C)(C)C2)c(Cl)c1 ZINC000840953814 1132314179 /nfs/dbraw/zinc/31/41/79/1132314179.db2.gz ZPDXVCMNYQCWOQ-GFCCVEGCSA-N 1 0 297.826 3.649 20 10 CHCDRO O=C1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1c(O)ccc2ccccc21 ZINC001231590155 1132318065 /nfs/dbraw/zinc/31/80/65/1132318065.db2.gz NHDWMXBTAITENA-GASCZTMLSA-N 1 0 295.382 3.631 20 10 CHCDRO C[C@@H](CCc1ccccc1F)[NH2+]CCc1ccc(N)cc1 ZINC000841037240 1132323522 /nfs/dbraw/zinc/32/35/22/1132323522.db2.gz ZHIPGVVPLLRBNZ-AWEZNQCLSA-N 1 0 286.394 3.561 20 10 CHCDRO Cc1ccc2c(c1)C[C@@H]([NH2+]Cc1ccc3c(c1)CCO3)CC2 ZINC001172834721 1132327145 /nfs/dbraw/zinc/32/71/45/1132327145.db2.gz ISXDRSBRGWDMSX-IBGZPJMESA-N 1 0 293.410 3.577 20 10 CHCDRO CO[C@H]1CCC[C@@H]([NH2+]Cc2cc3ccccc3cc2O)C1 ZINC001172922627 1132362694 /nfs/dbraw/zinc/36/26/94/1132362694.db2.gz IYRVPKZMEBZPGQ-SJORKVTESA-N 1 0 285.387 3.593 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCc3ccccc3C2)c(O)c1 ZINC001231842053 1132375823 /nfs/dbraw/zinc/37/58/23/1132375823.db2.gz NRNIJUFIKMMFRB-UHFFFAOYSA-N 1 0 267.372 3.567 20 10 CHCDRO Cc1cc(C)c(C[NH+]2CCC(C(F)(F)F)CC2)c(O)c1 ZINC001231841697 1132376435 /nfs/dbraw/zinc/37/64/35/1132376435.db2.gz DGROCZIQFKCDAK-UHFFFAOYSA-N 1 0 287.325 3.783 20 10 CHCDRO Cc1cc(C)c(C[N@H+](C)Cc2ccccc2)c(O)c1 ZINC001231842661 1132376503 /nfs/dbraw/zinc/37/65/03/1132376503.db2.gz WWPPPXCOOGFULD-UHFFFAOYSA-N 1 0 255.361 3.641 20 10 CHCDRO Cc1cc(C)c(C[N@H+](C)Cc2cccc(F)c2)c(O)c1 ZINC001231843361 1132376661 /nfs/dbraw/zinc/37/66/61/1132376661.db2.gz WWUJACIFRPRKMP-UHFFFAOYSA-N 1 0 273.351 3.780 20 10 CHCDRO COc1ccccc1CC[N@H+](C)Cc1c(C)cc(C)cc1O ZINC001231846741 1132378500 /nfs/dbraw/zinc/37/85/00/1132378500.db2.gz OFUTVBGRCAJBEW-UHFFFAOYSA-N 1 0 299.414 3.692 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCC[C@@H]2c2ccccn2)c(O)c1 ZINC001231844149 1132378696 /nfs/dbraw/zinc/37/86/96/1132378696.db2.gz HMNNXTMSTFXALG-QGZVFWFLSA-N 1 0 282.387 3.741 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCO[C@H](c3ccccc3)C2)c(O)c1 ZINC001231846861 1132379006 /nfs/dbraw/zinc/37/90/06/1132379006.db2.gz RHJITDDVCYEMOU-IBGZPJMESA-N 1 0 297.398 3.583 20 10 CHCDRO Cc1ccc2c(c1)CC[N@@H+](Cc1c(C)cc(C)cc1O)C2 ZINC001231847685 1132379803 /nfs/dbraw/zinc/37/98/03/1132379803.db2.gz CDDHLBZVSXLYJY-UHFFFAOYSA-N 1 0 281.399 3.876 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2CC[C@H](C)C[C@H]2C)cc1Cl ZINC001231870791 1132383724 /nfs/dbraw/zinc/38/37/24/1132383724.db2.gz UFQOUVPCTDFWLR-CMPLNLGQSA-N 1 0 267.800 3.974 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)CC2CC(F)(F)C2)cc1Cl ZINC001231870587 1132384794 /nfs/dbraw/zinc/38/47/94/1132384794.db2.gz KTCACYGMJMKODN-UHFFFAOYSA-N 1 0 289.753 3.831 20 10 CHCDRO Cc1cc(O)c(C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1Cl ZINC001231870713 1132384929 /nfs/dbraw/zinc/38/49/29/1132384929.db2.gz PKTZHBOMZVUJQF-GHMZBOCLSA-N 1 0 267.800 3.832 20 10 CHCDRO Cc1csc(CC[NH2+][C@H](C)c2ccc(Cl)cc2O)n1 ZINC000841744117 1132388523 /nfs/dbraw/zinc/38/85/23/1132388523.db2.gz FEGSIILCBUXREL-SNVBAGLBSA-N 1 0 296.823 3.704 20 10 CHCDRO Cc1ncc(C[NH2+][C@H](C)c2ccc(Cl)cc2O)s1 ZINC000841747000 1132389085 /nfs/dbraw/zinc/38/90/85/1132389085.db2.gz MPYWLFHWVWMELM-MRVPVSSYSA-N 1 0 282.796 3.661 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCC(F)(F)C1)c1ccc(Cl)cc1O ZINC000841749898 1132389447 /nfs/dbraw/zinc/38/94/47/1132389447.db2.gz JMPCZQXMDCFORQ-SCZZXKLOSA-N 1 0 275.726 3.884 20 10 CHCDRO Oc1c(C[N@@H+]2CC[C@@H](C(F)(F)F)C2)ccc2ccccc21 ZINC001231882735 1132390139 /nfs/dbraw/zinc/39/01/39/1132390139.db2.gz UAOZWPWEFVDEHQ-CYBMUJFWSA-N 1 0 295.304 3.930 20 10 CHCDRO CO[C@H]1CC[N@H+](Cc2ccc3ccccc3c2O)[C@@H](C)C1 ZINC001231884009 1132390804 /nfs/dbraw/zinc/39/08/04/1132390804.db2.gz UGSCSKHXFNDNBV-BBRMVZONSA-N 1 0 285.387 3.545 20 10 CHCDRO CCn1cc([C@@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2O)cn1 ZINC000841755523 1132392624 /nfs/dbraw/zinc/39/26/24/1132392624.db2.gz IHNDGUOIAAIRLV-MNOVXSKESA-N 1 0 293.798 3.674 20 10 CHCDRO CO[C@@H](C[NH2+][C@H](C)c1ccc(Cl)cc1O)C(C)(C)C ZINC000841756180 1132393101 /nfs/dbraw/zinc/39/31/01/1132393101.db2.gz USXCGUDSGUMFEM-YGRLFVJLSA-N 1 0 285.815 3.757 20 10 CHCDRO C[C@H]([NH2+][C@H]1C[C@@H](C)n2ccnc21)c1ccc(Cl)cc1O ZINC000841759244 1132393200 /nfs/dbraw/zinc/39/32/00/1132393200.db2.gz XSDTWPFEIRBTOC-NRUUGDAUSA-N 1 0 291.782 3.599 20 10 CHCDRO COC1(C[NH2+][C@H](C)c2ccc(Cl)cc2O)CCCC1 ZINC000841758051 1132394206 /nfs/dbraw/zinc/39/42/06/1132394206.db2.gz RNPGBWZELBAAAU-LLVKDONJSA-N 1 0 283.799 3.655 20 10 CHCDRO CCc1nc(C)c(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)o1 ZINC000841759275 1132395227 /nfs/dbraw/zinc/39/52/27/1132395227.db2.gz XZILBEABJUFLTG-VIFPVBQESA-N 1 0 294.782 3.755 20 10 CHCDRO C[C@H]([NH2+][C@H](CO)CC1CCCCC1)c1cc(F)ccc1O ZINC000841761319 1132395832 /nfs/dbraw/zinc/39/58/32/1132395832.db2.gz IGVABUIPPXECBW-WFASDCNBSA-N 1 0 295.398 3.513 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H](CO)CC2CCCCC2)c1 ZINC000841762218 1132396673 /nfs/dbraw/zinc/39/66/73/1132396673.db2.gz NWQLRMNWHHMIHA-ZBFHGGJFSA-N 1 0 291.435 3.683 20 10 CHCDRO CCN(Cc1ccccc1O)Cc1cc(Cl)cnc1F ZINC001231998563 1132407413 /nfs/dbraw/zinc/40/74/13/1132407413.db2.gz NRQKHNPUABMCBU-UHFFFAOYSA-N 1 0 294.757 3.602 20 10 CHCDRO CC[C@H](C[N@H+](C)Cc1ccc(N2CCCCC2)cc1)OC ZINC000842147765 1132410072 /nfs/dbraw/zinc/41/00/72/1132410072.db2.gz NARFILLVBRYHMQ-GOSISDBHSA-N 1 0 290.451 3.534 20 10 CHCDRO CC[C@@H]1CC[C@H]([NH2+]Cc2cc(Br)ccc2O)C1 ZINC001173269553 1132433762 /nfs/dbraw/zinc/43/37/62/1132433762.db2.gz XHPKJESXGIZMAX-MFKMUULPSA-N 1 0 298.224 3.823 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2CC[C@@H](OC(C)C)C2)cc1C(C)C ZINC000842612927 1132443892 /nfs/dbraw/zinc/44/38/92/1132443892.db2.gz RNSTYBSYYVMSHM-MRXNPFEDSA-N 1 0 291.435 3.823 20 10 CHCDRO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1cc(Cl)c(O)cc1O ZINC001232257680 1132444986 /nfs/dbraw/zinc/44/49/86/1132444986.db2.gz GPMCZIQJLDWSJI-AOOOYVTPSA-N 1 0 269.772 3.514 20 10 CHCDRO COc1cc(O)c(C[N@H+](C)Cc2cccs2)cc1Cl ZINC001232264308 1132445466 /nfs/dbraw/zinc/44/54/66/1132445466.db2.gz HTTYRXIJEHJTHN-UHFFFAOYSA-N 1 0 297.807 3.748 20 10 CHCDRO CCCCC[N@H+](C)Cc1cc(Cl)c(OC)cc1O ZINC001232264994 1132447389 /nfs/dbraw/zinc/44/73/89/1132447389.db2.gz MVWCTQWNJSSHLG-UHFFFAOYSA-N 1 0 271.788 3.676 20 10 CHCDRO CC[N@H+](Cc1ccc(COC)cc1)Cc1ccccc1O ZINC001232302979 1132450591 /nfs/dbraw/zinc/45/05/91/1132450591.db2.gz WWCDEXJVEXOSJG-UHFFFAOYSA-N 1 0 285.387 3.561 20 10 CHCDRO C[C@@H](C[NH2+]C/C=C/c1ccc(N(C)C)cc1)CC(F)F ZINC000842730405 1132455037 /nfs/dbraw/zinc/45/50/37/1132455037.db2.gz XWZIHSJOIXXTJZ-MUBLQREKSA-N 1 0 282.378 3.647 20 10 CHCDRO Oc1ccccc1C[NH2+]C1(c2cccc(F)c2)CCC1 ZINC000842744549 1132456082 /nfs/dbraw/zinc/45/60/82/1132456082.db2.gz XVNPRUNYASDTSS-UHFFFAOYSA-N 1 0 271.335 3.700 20 10 CHCDRO Cc1cccc(C2([NH2+]Cc3ccccc3O)CCC2)c1 ZINC000842745238 1132456716 /nfs/dbraw/zinc/45/67/16/1132456716.db2.gz HDKSBIZSALLFNC-UHFFFAOYSA-N 1 0 267.372 3.870 20 10 CHCDRO Fc1cccc(C2([NH2+]Cc3ccc4c(c3)CCO4)CCC2)c1 ZINC000842743303 1132456976 /nfs/dbraw/zinc/45/69/76/1132456976.db2.gz DHXQLIJUBSZLGU-UHFFFAOYSA-N 1 0 297.373 3.930 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@H](C)CC(F)F)c(O)c1 ZINC000842892784 1132474226 /nfs/dbraw/zinc/47/42/26/1132474226.db2.gz FFNPPZVBTOXSBV-ZYHUDNBSSA-N 1 0 271.351 3.951 20 10 CHCDRO C[C@H](C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F)CC(F)F ZINC000842891141 1132474395 /nfs/dbraw/zinc/47/43/95/1132474395.db2.gz 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ZINC000560232813 327291856 /nfs/dbraw/zinc/29/18/56/327291856.db2.gz GSBFBAMNMVDLPQ-UHFFFAOYSA-N 1 0 256.393 3.765 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]Cc2cccc(C)c2)c1O ZINC000228670301 329058919 /nfs/dbraw/zinc/05/89/19/329058919.db2.gz ONNWBYFOFWVFIJ-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO COCCC1CC[NH+]([C@H](C)c2cc(C)ccc2O)CC1 ZINC000527931103 330297399 /nfs/dbraw/zinc/29/73/99/330297399.db2.gz BLQVLCFROGWVRX-CQSZACIVSA-N 1 0 277.408 3.510 20 10 CHCDRO CC[C@@H]([NH2+]CC[C@@H]1CCCOC1)c1ccc(C)cc1O ZINC000527935763 330298057 /nfs/dbraw/zinc/29/80/57/330298057.db2.gz ZAMULROARGXSMU-GOEBONIOSA-N 1 0 277.408 3.558 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cccnc1C)c1cc(Cl)ccc1O ZINC000527985701 330298699 /nfs/dbraw/zinc/29/86/99/330298699.db2.gz IESVWMQBVPQCRH-OAHLLOKOSA-N 1 0 290.794 3.990 20 10 CHCDRO C[C@H]([NH2+][C@@H]1[C@H](C)O[C@H](C)[C@H]1C)c1cc(Cl)ccc1O ZINC000528003897 330300416 /nfs/dbraw/zinc/30/04/16/330300416.db2.gz PBUSEUASCXHYLF-QSJCVTFJSA-N 1 0 283.799 3.508 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1CCC1(C)C ZINC000381844143 336074091 /nfs/dbraw/zinc/07/40/91/336074091.db2.gz KPTIKGKEGQHFPS-MRXNPFEDSA-N 1 0 256.393 3.765 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C2CC(F)(F)C2)cc1 ZINC000277046455 520286496 /nfs/dbraw/zinc/28/64/96/520286496.db2.gz GPDOYCBAOVMOTQ-NSHDSACASA-N 1 0 268.351 3.591 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+][C@@H]2CCCc3occc32)c1 ZINC000237088704 521154103 /nfs/dbraw/zinc/15/41/03/521154103.db2.gz AKAHIWCBVRNWSV-OAHLLOKOSA-N 1 0 287.359 3.551 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)cc1)[C@@H]1CCOC(C)(C)C1 ZINC000289975691 521320912 /nfs/dbraw/zinc/32/09/12/521320912.db2.gz XHHXCZCJIWNQFV-QGZVFWFLSA-N 1 0 290.451 3.532 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H](C)c2ccc(C)cc2O)c1 ZINC000037679467 521370773 /nfs/dbraw/zinc/37/07/73/521370773.db2.gz CGAVFTBJFUHISM-AWEZNQCLSA-N 1 0 285.387 3.950 20 10 CHCDRO CCC(O)(CC)C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000087014082 521657623 /nfs/dbraw/zinc/65/76/23/521657623.db2.gz HZJNLJXBUTYDIS-CYBMUJFWSA-N 1 0 287.403 3.747 20 10 CHCDRO CCC[N@H+](Cc1ccccc1O)Cc1cccnc1Cl ZINC000068973558 521690209 /nfs/dbraw/zinc/69/02/09/521690209.db2.gz DQRLQYXGCXMEFJ-UHFFFAOYSA-N 1 0 290.794 3.853 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCO[C@@H](C)C1)c1ccc(C)cc1O ZINC000280299736 522631825 /nfs/dbraw/zinc/63/18/25/522631825.db2.gz ZUVUGYZEDHBEHZ-DZKIICNBSA-N 1 0 277.408 3.556 20 10 CHCDRO CC[C@H]([NH2+]C[C@]1(C)CCO[C@H]1C1CC1)c1ccccc1O ZINC000365077517 522637999 /nfs/dbraw/zinc/63/79/99/522637999.db2.gz KRIMDFAGQXSYCM-SZMVWBNQSA-N 1 0 289.419 3.638 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)[C@@H](O)c1ccccc1)c1ccccc1O ZINC000290192291 522691890 /nfs/dbraw/zinc/69/18/90/522691890.db2.gz GADHXXDAFZINNR-QANKJYHBSA-N 1 0 285.387 3.555 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)[C@H](O)c1ccccc1)c1ccccc1O ZINC000290192296 522735129 /nfs/dbraw/zinc/73/51/29/522735129.db2.gz GADHXXDAFZINNR-SKDZVZGDSA-N 1 0 285.387 3.555 20 10 CHCDRO CC[C@@H]([NH2+]CCCc1ccccn1)c1ccc(C)cc1O ZINC000280130237 522831013 /nfs/dbraw/zinc/83/10/13/522831013.db2.gz OWVACXFWYLZUAC-QGZVFWFLSA-N 1 0 284.403 3.769 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CCOC(C)(C)C1)c1ccc(C)cc1O ZINC000280075634 522927526 /nfs/dbraw/zinc/92/75/26/522927526.db2.gz LJMHBNUNYGGRNA-UKRRQHHQSA-N 1 0 277.408 3.699 20 10 CHCDRO COCc1cccc(C[NH2+][C@H](C)c2cc(F)ccc2O)c1 ZINC000094617742 523056187 /nfs/dbraw/zinc/05/61/87/523056187.db2.gz YYJKPXCJYPOYIP-GFCCVEGCSA-N 1 0 289.350 3.529 20 10 CHCDRO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1cc(C)ccc1O ZINC000071407391 523853376 /nfs/dbraw/zinc/85/33/76/523853376.db2.gz IUQIHBMVDAUUDJ-CQSZACIVSA-N 1 0 285.387 3.868 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2ccc(Cl)nc2)c(O)c1 ZINC000293252024 524333966 /nfs/dbraw/zinc/33/39/66/524333966.db2.gz BPSBDXZWYRCACN-LBPRGKRZSA-N 1 0 290.794 3.908 20 10 CHCDRO COc1ccc(O)c(C[NH2+]C(C)(C)c2ccccc2F)c1 ZINC000292835839 524749368 /nfs/dbraw/zinc/74/93/68/524749368.db2.gz RSQWGLUBIFDVEY-UHFFFAOYSA-N 1 0 289.350 3.565 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@@H](C)c2cc(C)sc2C)c1 ZINC000037122791 524753297 /nfs/dbraw/zinc/75/32/97/524753297.db2.gz KXVRSURSVHCOKB-NSHDSACASA-N 1 0 291.416 3.930 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)cc1C ZINC000127445509 525314887 /nfs/dbraw/zinc/31/48/87/525314887.db2.gz UXAGYJRFKCGBCP-MRXNPFEDSA-N 1 0 270.376 3.674 20 10 CHCDRO C[C@H]([NH2+]CCCC(F)(F)F)c1ccc(N(C)C)cc1 ZINC000211108039 525330442 /nfs/dbraw/zinc/33/04/42/525330442.db2.gz VHUKWZGLTPXUNS-NSHDSACASA-N 1 0 274.330 3.746 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCCCO1)c1ccc2ccccc2c1O ZINC000042812034 525479422 /nfs/dbraw/zinc/47/94/22/525479422.db2.gz RRPOGFUDVOIKIR-HIFRSBDPSA-N 1 0 285.387 3.765 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)c1ccccn1)c1ccc(N(C)C)cc1 ZINC000037218843 525536278 /nfs/dbraw/zinc/53/62/78/525536278.db2.gz GJDMBMGVBMYBJA-KBPBESRZSA-N 1 0 269.392 3.559 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCC(F)(F)C2)c(O)c1 ZINC000281074177 525732274 /nfs/dbraw/zinc/73/22/74/525732274.db2.gz IOIMNMCHAAOMLS-NEPJUHHUSA-N 1 0 269.335 3.787 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(F)c(F)c2)c(O)c1 ZINC000049577366 525927561 /nfs/dbraw/zinc/92/75/61/525927561.db2.gz SXWHPEUAXXTUQG-NSHDSACASA-N 1 0 277.314 3.830 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCO[C@H](C(C)(C)C)C2)c(O)c1 ZINC000273503370 525938457 /nfs/dbraw/zinc/93/84/57/525938457.db2.gz QMXILWBGWYPVMH-VBQJREDUSA-N 1 0 291.435 3.945 20 10 CHCDRO CSc1ccc(C[NH2+]Cc2ccc(N(C)C)cc2)cc1 ZINC000020146135 526003893 /nfs/dbraw/zinc/00/38/93/526003893.db2.gz YNWSGZKAOXMLMP-UHFFFAOYSA-N 1 0 286.444 3.764 20 10 CHCDRO COc1cccc(C[NH2+][C@H](C)c2cc(C)ccc2O)c1 ZINC000037680358 526036785 /nfs/dbraw/zinc/03/67/85/526036785.db2.gz SICCFRDAAXWHPS-CYBMUJFWSA-N 1 0 271.360 3.560 20 10 CHCDRO COc1cccc(C[NH2+][C@H](c2ccccc2)C(C)C)c1O ZINC000036967631 526040137 /nfs/dbraw/zinc/04/01/37/526040137.db2.gz GVQVECYXKLDKBR-KRWDZBQOSA-N 1 0 285.387 3.888 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@H]1c1ccncc1 ZINC000367721909 526347293 /nfs/dbraw/zinc/34/72/93/526347293.db2.gz ABODDPZPFPCXEE-HNNXBMFYSA-N 1 0 288.778 3.778 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000127427864 526363541 /nfs/dbraw/zinc/36/35/41/526363541.db2.gz QKFHNVMMTFPMDZ-CQSZACIVSA-N 1 0 276.767 3.711 20 10 CHCDRO Oc1ccccc1C[NH2+][C@H]1CCCc2ccc(F)cc21 ZINC000279936481 526374630 /nfs/dbraw/zinc/37/46/30/526374630.db2.gz YMHSRCOTQQERMV-INIZCTEOSA-N 1 0 271.335 3.699 20 10 CHCDRO c1cc2c(s1)CCC[C@@H]2[NH2+]Cc1ccc2c(c1)CCO2 ZINC000061360212 526444770 /nfs/dbraw/zinc/44/47/70/526444770.db2.gz PQNHNZVWMMFUFX-HNNXBMFYSA-N 1 0 285.412 3.850 20 10 CHCDRO Cc1n[nH]c(C)c1[C@H]1CCCCC[N@@H+]1Cc1ccccc1O ZINC000290340333 526521522 /nfs/dbraw/zinc/52/15/22/526521522.db2.gz FJCDBQSYCBLQDD-MRXNPFEDSA-N 1 0 299.418 3.849 20 10 CHCDRO CCC[C@H]1CCC[N@H+](Cc2cc(F)ccc2O)C1 ZINC000708466419 1121464328 /nfs/dbraw/zinc/46/43/28/1121464328.db2.gz HSDTULNTLZNRRT-LBPRGKRZSA-N 1 0 251.345 3.543 20 10 CHCDRO CC[C@H](CSC)[NH2+][C@@H](CC)c1ccc(N(C)C)cc1 ZINC000775424711 1122562061 /nfs/dbraw/zinc/56/20/61/1122562061.db2.gz XLJHFXUZIICTRV-ZBFHGGJFSA-N 1 0 280.481 3.935 20 10 CHCDRO CC[C@H]1CC[C@H](C)[N@@H+]1Cc1ccc(N(C)CC)cc1 ZINC001192645541 1122655087 /nfs/dbraw/zinc/65/50/87/1122655087.db2.gz OJSPZLDCYYXLOD-HOCLYGCPSA-N 1 0 260.425 3.906 20 10 CHCDRO CCOCc1cc(C[NH2+][C@H](CC)C2CC2)ccc1OC ZINC000850382467 1123260848 /nfs/dbraw/zinc/26/08/48/1123260848.db2.gz VIVNXKSHJQBFNM-MRXNPFEDSA-N 1 0 277.408 3.510 20 10 CHCDRO CCCC[C@H](COC)[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000794801678 1123950258 /nfs/dbraw/zinc/95/02/58/1123950258.db2.gz KDKMYNOKASONGL-ZBFHGGJFSA-N 1 0 279.424 3.947 20 10 CHCDRO CCc1ccc(C[NH2+]Cc2c(C)cccc2O)s1 ZINC000876930588 1124991759 /nfs/dbraw/zinc/99/17/59/1124991759.db2.gz BKWCOAQPUVRYOQ-UHFFFAOYSA-N 1 0 261.390 3.614 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CC[C@H]2CCCS2)c1 ZINC000715700257 1131990809 /nfs/dbraw/zinc/99/08/09/1131990809.db2.gz XWDUTNBMDOUBKP-CHWSQXEVSA-N 1 0 265.422 3.637 20 10 CHCDRO CC[C@@H]1CC[C@H]([N@H+](C)Cc2ccc(N(C)C)cc2)C1 ZINC001173297190 1132445975 /nfs/dbraw/zinc/44/59/75/1132445975.db2.gz XJWFQEVVYIGLPU-PBHICJAKSA-N 1 0 260.425 3.763 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CCC[C@@H](C)[C@H]2C)cc1Cl ZINC001232264946 1132447133 /nfs/dbraw/zinc/44/71/33/1132447133.db2.gz PDNGOFVVJKSUEY-GHMZBOCLSA-N 1 0 283.799 3.675 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCS[C@@H]1C)c1cc(Cl)ccc1O ZINC000842927037 1132477311 /nfs/dbraw/zinc/47/73/11/1132477311.db2.gz CHVPWNPJFPNAIE-ICCXJUOJSA-N 1 0 285.840 3.980 20 10 CHCDRO Oc1cc(C(F)(F)F)ccc1C[NH+]1CCC(F)(F)CC1 ZINC001233451494 1132625774 /nfs/dbraw/zinc/62/57/74/1132625774.db2.gz MRIWERYXRHMPTK-UHFFFAOYSA-N 1 0 295.251 3.642 20 10 CHCDRO CCc1ccc(C[NH2+]Cc2ccc(N(C)C)cc2C)o1 ZINC000134133674 1125536814 /nfs/dbraw/zinc/53/68/14/1125536814.db2.gz JLMWNGCRVJIHPJ-UHFFFAOYSA-N 1 0 272.392 3.506 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]CCCCC(C)C)c1 ZINC000134287324 1125551942 /nfs/dbraw/zinc/55/19/42/1125551942.db2.gz XKCQKEBJJLKWJZ-ZDUSSCGKSA-N 1 0 265.397 3.878 20 10 CHCDRO Oc1ccccc1C[NH2+]C1CC(c2ccccc2F)C1 ZINC000134483871 1125563515 /nfs/dbraw/zinc/56/35/15/1125563515.db2.gz XCWZCJLRIRLVMI-UHFFFAOYSA-N 1 0 271.335 3.567 20 10 CHCDRO CC1CC([NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000135564833 1125591715 /nfs/dbraw/zinc/59/17/15/1125591715.db2.gz PUCMDSZBMUFUMW-UHFFFAOYSA-N 1 0 258.409 3.565 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)c1cc[nH]c(=O)c1 ZINC000841757258 1125597185 /nfs/dbraw/zinc/59/71/85/1125597185.db2.gz MWEJKWMZYRUSLJ-UWVGGRQHSA-N 1 0 292.766 3.558 20 10 CHCDRO COc1ccc(C[N@@H+]2CCC[C@H]3CCCC[C@H]32)c(O)c1 ZINC000093480741 1125610724 /nfs/dbraw/zinc/61/07/24/1125610724.db2.gz WYOFZMLOLXOPHQ-CZUORRHYSA-N 1 0 275.392 3.555 20 10 CHCDRO CCOCc1cc(C[NH2+]C2(C3CC3)CCC2)ccc1OC ZINC000886392039 1125676505 /nfs/dbraw/zinc/67/65/05/1125676505.db2.gz PLHYMMYHKMZGSB-UHFFFAOYSA-N 1 0 289.419 3.654 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCC2(CCC2)CO1)c1cc(F)ccc1O ZINC000886731100 1125715179 /nfs/dbraw/zinc/71/51/79/1125715179.db2.gz UZTVSOKTRJJNEM-JSGCOSHPSA-N 1 0 293.382 3.531 20 10 CHCDRO COc1ccccc1[C@H]1CC[N@H+](Cc2cc(C)ccc2O)C1 ZINC000093593586 1125771378 /nfs/dbraw/zinc/77/13/78/1125771378.db2.gz FCPSDBRQDRZNHQ-HNNXBMFYSA-N 1 0 297.398 3.699 20 10 CHCDRO COc1cc(C[N@H+](C)[C@@H](C)C(C)(C)C)c(O)cc1C ZINC000768442739 1129857685 /nfs/dbraw/zinc/85/76/85/1129857685.db2.gz ZWMBVVIRFDQFOD-LBPRGKRZSA-N 1 0 265.397 3.576 20 10 CHCDRO C[N@H+](CCc1cccs1)Cc1cc(Cl)ccc1O ZINC000769497817 1129914146 /nfs/dbraw/zinc/91/41/46/1129914146.db2.gz BXPHKYRSFIHFCL-UHFFFAOYSA-N 1 0 281.808 3.782 20 10 CHCDRO CCOc1cccc(C[NH2+]CC(C)(C)C(C)(F)F)c1O ZINC000696569484 1126799730 /nfs/dbraw/zinc/79/97/30/1126799730.db2.gz WTLNDOKPKHTHLL-UHFFFAOYSA-N 1 0 287.350 3.562 20 10 CHCDRO CN(C)c1ccc(C[NH+]2CCC(C(F)(F)F)CC2)cc1 ZINC000179962449 1126836470 /nfs/dbraw/zinc/83/64/70/1126836470.db2.gz QBDGEKKCSKPJPB-UHFFFAOYSA-N 1 0 286.341 3.527 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCCCC[C@@H]1c1ccncc1 ZINC000183292285 1126884747 /nfs/dbraw/zinc/88/47/47/1126884747.db2.gz OZHJUSXATHSIIS-QGZVFWFLSA-N 1 0 282.387 3.905 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cccc(NC(C)=O)c1)c1ccccc1O ZINC000183345231 1126885455 /nfs/dbraw/zinc/88/54/55/1126885455.db2.gz XTLADCMNRDSMEZ-QGZVFWFLSA-N 1 0 298.386 3.592 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCc2cc(F)ccc21)c1ccccc1O ZINC000183466056 1126887685 /nfs/dbraw/zinc/88/76/85/1126887685.db2.gz LDOXOMPBHXQCNG-MEDUHNTESA-N 1 0 271.335 3.869 20 10 CHCDRO COc1ccc(O)c(C[NH2+]Cc2ccc(C(F)F)cc2)c1 ZINC000184990082 1126897805 /nfs/dbraw/zinc/89/78/05/1126897805.db2.gz SKOGCYJATSJOPM-UHFFFAOYSA-N 1 0 293.313 3.628 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2cn3c(cccc3C)n2)c1 ZINC000185412370 1126899674 /nfs/dbraw/zinc/89/96/74/1126899674.db2.gz GYQOTCVJKPIETN-CQSZACIVSA-N 1 0 295.386 3.508 20 10 CHCDRO COC(C)(C)C[C@@H](C)[NH2+][C@H](C)c1cc(C)ccc1O ZINC000185564320 1126900431 /nfs/dbraw/zinc/90/04/31/1126900431.db2.gz MQONWBZYBFYEOM-CHWSQXEVSA-N 1 0 265.397 3.555 20 10 CHCDRO COCCC1(C[NH2+][C@H](C)c2cc(C)ccc2O)CCCC1 ZINC000185747386 1126902070 /nfs/dbraw/zinc/90/20/70/1126902070.db2.gz UXPKSZKKMSVKTL-OAHLLOKOSA-N 1 0 291.435 3.948 20 10 CHCDRO CC[C@@H]([NH2+]CC[C@@](C)(O)c1ccccc1)c1ccccc1O ZINC000187889937 1126916684 /nfs/dbraw/zinc/91/66/84/1126916684.db2.gz JIFSWMOEHAFFKU-IEBWSBKVSA-N 1 0 299.414 3.731 20 10 CHCDRO CCO[C@@H](C[NH2+]Cc1cccc(C)c1O)c1ccccc1 ZINC000195190858 1126979404 /nfs/dbraw/zinc/97/94/04/1126979404.db2.gz VWERMYQANOUQMV-KRWDZBQOSA-N 1 0 285.387 3.568 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CC[C@H](c3ccccc3)C2)c1O ZINC000156006538 1127092963 /nfs/dbraw/zinc/09/29/63/1127092963.db2.gz JFSRRRJONGAJNE-INIZCTEOSA-N 1 0 297.398 3.780 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCC(C)(C)C1)c1ccc(N(C)C)cc1 ZINC000163632850 1127126724 /nfs/dbraw/zinc/12/67/24/1127126724.db2.gz HSJCDVAXXVIWIX-DZGCQCFKSA-N 1 0 260.425 3.982 20 10 CHCDRO CC[C@@H](CC(F)(F)F)[NH2+]Cc1ccc(OC)c(C)c1 ZINC000760662699 1127154873 /nfs/dbraw/zinc/15/48/73/1127154873.db2.gz YAUGJXCGUGZXBH-LBPRGKRZSA-N 1 0 275.314 3.824 20 10 CHCDRO Cc1cc(C)c(O)c(C[NH+]2CCC(OCC(C)C)CC2)c1 ZINC000164193115 1127156928 /nfs/dbraw/zinc/15/69/28/1127156928.db2.gz CAMXRIKXVZKANH-UHFFFAOYSA-N 1 0 291.435 3.646 20 10 CHCDRO Cc1cc(Cl)cc(C[NH+]2CCC(CF)CC2)c1O ZINC001237685154 1131126340 /nfs/dbraw/zinc/12/63/40/1131126340.db2.gz AOULRHLOCGZVQQ-UHFFFAOYSA-N 1 0 271.763 3.536 20 10 CHCDRO COC[C@H]([NH2+]Cc1ccc(N(C)C)c(C)c1)c1ccccc1 ZINC000287675552 1127312029 /nfs/dbraw/zinc/31/20/29/1127312029.db2.gz MLGDCQMKQOACDS-SFHVURJKSA-N 1 0 298.430 3.538 20 10 CHCDRO C[C@@H]1CC[C@@H]([NH2+]Cc2ccc3c(c2)CCO3)[C@@H](C)C1 ZINC000226174573 1127379473 /nfs/dbraw/zinc/37/94/73/1127379473.db2.gz OPIGJTGXGYEGKP-DVOMOZLQSA-N 1 0 259.393 3.536 20 10 CHCDRO CC[C@@H]1CCC[N@H+](Cc2cc(F)ccc2O)CC1 ZINC000226565490 1127411838 /nfs/dbraw/zinc/41/18/38/1127411838.db2.gz MICXBYINGAQXOB-GFCCVEGCSA-N 1 0 251.345 3.543 20 10 CHCDRO CCN(C)c1ccc(C[N@H+](C)C[C@H]2CC=CCC2)cc1 ZINC001168405347 1127426851 /nfs/dbraw/zinc/42/68/51/1127426851.db2.gz XJTRPQLFRSDJBL-INIZCTEOSA-N 1 0 272.436 3.931 20 10 CHCDRO Cc1cccc(C[NH+]2CCC(Cc3cccnc3)CC2)c1O ZINC000360637537 1127503154 /nfs/dbraw/zinc/50/31/54/1127503154.db2.gz MCDKFXCVPAPSFB-UHFFFAOYSA-N 1 0 296.414 3.550 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@H]2CCCSC2)c(O)c1 ZINC000294008514 1127541979 /nfs/dbraw/zinc/54/19/79/1127541979.db2.gz DENOTHUTCZRINO-UONOGXRCSA-N 1 0 279.449 3.803 20 10 CHCDRO CCc1nc(C)c(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)o1 ZINC000294050250 1127545617 /nfs/dbraw/zinc/54/56/17/1127545617.db2.gz GQJTWTRJUYBYQV-ZDUSSCGKSA-N 1 0 288.391 3.719 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]CC2CCCCC2)c1O ZINC000228669033 1127582697 /nfs/dbraw/zinc/58/26/97/1127582697.db2.gz DCEASULXEKRZEI-UHFFFAOYSA-N 1 0 283.799 3.724 20 10 CHCDRO CC[C@@H]([NH2+]CCCc1ncccc1C)c1ccccc1O ZINC000295087199 1127619785 /nfs/dbraw/zinc/61/97/85/1127619785.db2.gz SQZMINFDYJKZTK-MRXNPFEDSA-N 1 0 284.403 3.769 20 10 CHCDRO C[C@@H]1C[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ccccc1O ZINC000295094373 1127619824 /nfs/dbraw/zinc/61/98/24/1127619824.db2.gz UFQDSKBQSVPTJX-PWSUYJOCSA-N 1 0 273.298 3.555 20 10 CHCDRO Cc1csc([C@@H](C)C[NH2+][C@@H]2CCc3cccc(O)c32)n1 ZINC000295783843 1127652587 /nfs/dbraw/zinc/65/25/87/1127652587.db2.gz ADELAVWGYDJSFU-GXFFZTMASA-N 1 0 288.416 3.538 20 10 CHCDRO CCOc1ccccc1C[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000295877587 1127656480 /nfs/dbraw/zinc/65/64/80/1127656480.db2.gz HNJDATDHVBFFHR-OAHLLOKOSA-N 1 0 283.371 3.568 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)C1CC1 ZINC000323916415 1127661099 /nfs/dbraw/zinc/66/10/99/1127661099.db2.gz TXZFLUIVTUHZLB-SFHVURJKSA-N 1 0 272.436 3.955 20 10 CHCDRO Cc1cnc([C@@H](C)C[NH2+][C@H]2CCc3cccc(O)c32)s1 ZINC000296275598 1127667363 /nfs/dbraw/zinc/66/73/63/1127667363.db2.gz CKIFILYDWWRDMR-GWCFXTLKSA-N 1 0 288.416 3.538 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]Cc1ccc(Cl)cc1F)CC2 ZINC000296409351 1127671079 /nfs/dbraw/zinc/67/10/79/1127671079.db2.gz KVFRRFHFSFVPCZ-AWEZNQCLSA-N 1 0 291.753 3.962 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCCc2ncccc2C)c(O)c1 ZINC000296530631 1127674602 /nfs/dbraw/zinc/67/46/02/1127674602.db2.gz QIYGVQYHQYLARJ-OAHLLOKOSA-N 1 0 284.403 3.687 20 10 CHCDRO CC(C)C[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3cccc(O)c32)CCO1 ZINC000296800215 1127683173 /nfs/dbraw/zinc/68/31/73/1127683173.db2.gz LMSXLKQUJIULNX-ARFHVFGLSA-N 1 0 289.419 3.563 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@@H]1CCCOc3ccccc31)CC2 ZINC000297728162 1127705588 /nfs/dbraw/zinc/70/55/88/1127705588.db2.gz NMWDDQPQDXLONA-CVEARBPZSA-N 1 0 295.382 3.883 20 10 CHCDRO CSc1ccc(C[N@H+](C)Cc2ccccc2O)cc1 ZINC000171926600 1127734821 /nfs/dbraw/zinc/73/48/21/1127734821.db2.gz MYRLGHDIABVAKY-UHFFFAOYSA-N 1 0 273.401 3.746 20 10 CHCDRO CO[C@]1(C)CCC[N@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000230300065 1127751187 /nfs/dbraw/zinc/75/11/87/1127751187.db2.gz DSFLHUOTDLQUBX-GOSISDBHSA-N 1 0 285.387 3.546 20 10 CHCDRO C[C@@H]([NH2+]CC1(C)CC1)c1ccc2ccccc2c1O ZINC000230668014 1127770886 /nfs/dbraw/zinc/77/08/86/1127770886.db2.gz TVBBUVGLIRLKOB-GFCCVEGCSA-N 1 0 255.361 3.996 20 10 CHCDRO CC(C)C[C@@H](O)C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000230660044 1127771828 /nfs/dbraw/zinc/77/18/28/1127771828.db2.gz SYCVKNABKBPLRG-DZGCQCFKSA-N 1 0 287.403 3.603 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC(C2CC2)C2CC2)c(O)c1 ZINC000088455750 1127938364 /nfs/dbraw/zinc/93/83/64/1127938364.db2.gz BGCXUJPTRLIXNB-GFCCVEGCSA-N 1 0 259.393 3.787 20 10 CHCDRO CC(C)[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)C1CC1 ZINC000324091960 1128075402 /nfs/dbraw/zinc/07/54/02/1128075402.db2.gz HITRGPQCOZBISL-GOSISDBHSA-N 1 0 272.436 3.811 20 10 CHCDRO CC(C)[C@@H]1C[C@H]([NH2+]Cc2ccc(N(C)C)c(F)c2)CS1 ZINC000754120416 1128196844 /nfs/dbraw/zinc/19/68/44/1128196844.db2.gz HVKMZNXGGMGXLV-BBRMVZONSA-N 1 0 296.455 3.511 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]([C@H](C)C2CC2)C2CC2)cc1C ZINC000914850614 1128253966 /nfs/dbraw/zinc/25/39/66/1128253966.db2.gz MUGIUFXBHBPHTG-CYBMUJFWSA-N 1 0 259.393 3.772 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCS[C@H](C)C2)c(O)c1C ZINC000927030371 1128209794 /nfs/dbraw/zinc/20/97/94/1128209794.db2.gz ICTRDBMQYNTQAK-XBFCOCLRSA-N 1 0 279.449 3.944 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCCc2cccnc21)c1ccc(N(C)C)cc1 ZINC000927056759 1128212198 /nfs/dbraw/zinc/21/21/98/1128212198.db2.gz WZXVEDDHPSITEE-KBXCAEBGSA-N 1 0 295.430 3.876 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CCCc2cccnc21)c1ccccc1O ZINC000927063274 1128213046 /nfs/dbraw/zinc/21/30/46/1128213046.db2.gz BQANYLZZEHAJLR-CVEARBPZSA-N 1 0 282.387 3.906 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C1CC1)[C@H]1CCCOC1)c1ccccc1O ZINC000927069901 1128215513 /nfs/dbraw/zinc/21/55/13/1128215513.db2.gz ODOTZMVWJSCACP-ZVZYQTTQSA-N 1 0 289.419 3.638 20 10 CHCDRO CC[C@@H]([NH2+][C@H](c1cnn(C)c1)C(C)C)c1ccccc1O ZINC000927071352 1128215774 /nfs/dbraw/zinc/21/57/74/1128215774.db2.gz RUWOGLPKVKMNEG-WBVHZDCISA-N 1 0 287.407 3.564 20 10 CHCDRO CC1(C)C[C@H](C[NH2+][C@@H]2CCc3cccc(O)c32)C(C)(C)O1 ZINC000927099381 1128217489 /nfs/dbraw/zinc/21/74/89/1128217489.db2.gz NDIIRQDXZMNLKY-ZIAGYGMSSA-N 1 0 289.419 3.563 20 10 CHCDRO CCc1onc(C)c1C[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000927133155 1128220762 /nfs/dbraw/zinc/22/07/62/1128220762.db2.gz AGIXYSBVIQDHQV-HNNXBMFYSA-N 1 0 288.391 3.800 20 10 CHCDRO C[C@@H]([NH2+]CC[C@H]1CCC2(CCC2)O1)c1cc(F)ccc1O ZINC000927127211 1128220971 /nfs/dbraw/zinc/22/09/71/1128220971.db2.gz GOAVHEHNQXMPRE-TZMCWYRMSA-N 1 0 293.382 3.674 20 10 CHCDRO C[C@@H]1C[C@@H]([NH2+]C2Cc3ccccc3C2)c2c1c(F)ccc2O ZINC000762776127 1128317665 /nfs/dbraw/zinc/31/76/65/1128317665.db2.gz CWGSATOMNRNBJG-BDJLRTHQSA-N 1 0 297.373 3.837 20 10 CHCDRO CC[C@H]([NH2+]C1Cc2ccccc2C1)c1ccc(N(C)C)cc1 ZINC000762775544 1128317896 /nfs/dbraw/zinc/31/78/96/1128317896.db2.gz AQKULVQBRVAGQZ-FQEVSTJZSA-N 1 0 294.442 3.961 20 10 CHCDRO CS[C@H](C[NH2+]Cc1cc(C)ccc1O)C(C)(C)C ZINC000784626384 1128330697 /nfs/dbraw/zinc/33/06/97/1128330697.db2.gz RXSXJTXRRGIMKP-CQSZACIVSA-N 1 0 267.438 3.568 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC[C@@H](COc3ccccc3)C2)c1 ZINC000780788918 1128358925 /nfs/dbraw/zinc/35/89/25/1128358925.db2.gz DCDAKUWDDLSIKE-MRXNPFEDSA-N 1 0 297.398 3.602 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+][C@@H](C(C)C)C2CC2)c1O ZINC000324570092 1128386949 /nfs/dbraw/zinc/38/69/49/1128386949.db2.gz VAEYBPIZIWWYOF-AWEZNQCLSA-N 1 0 283.799 3.578 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CC[C@@H](C2CC2)C1 ZINC000763333720 1128392416 /nfs/dbraw/zinc/39/24/16/1128392416.db2.gz SCOVHAGUFADMAG-OAHLLOKOSA-N 1 0 267.372 3.777 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CC[C@H](C2CC2)C1 ZINC000763333716 1128392456 /nfs/dbraw/zinc/39/24/56/1128392456.db2.gz SCOVHAGUFADMAG-HNNXBMFYSA-N 1 0 267.372 3.777 20 10 CHCDRO C[C@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1cc(F)ccc1O ZINC000780792574 1128420990 /nfs/dbraw/zinc/42/09/90/1128420990.db2.gz HPAIRVOVCTYCRM-GXSJLCMTSA-N 1 0 291.288 3.694 20 10 CHCDRO C[C@H]([NH2+]CC(C)(C)C(C)(F)F)c1cc(F)ccc1O ZINC000699962103 1128537228 /nfs/dbraw/zinc/53/72/28/1128537228.db2.gz VWCYQXNBOGUOPT-VIFPVBQESA-N 1 0 275.314 3.863 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)c2ccc3c(c2)OCO3)cc1C ZINC000042203105 1128568560 /nfs/dbraw/zinc/56/85/60/1128568560.db2.gz PMTMNZBINNEUDQ-ZDUSSCGKSA-N 1 0 299.370 3.583 20 10 CHCDRO CCOc1cccc(C[NH2+]C[C@H]2CCCC[C@H]2C)c1O ZINC000042857220 1128587823 /nfs/dbraw/zinc/58/78/23/1128587823.db2.gz PYMOMRGWASGQAJ-ZIAGYGMSSA-N 1 0 277.408 3.707 20 10 CHCDRO CCO[C@H](CC[NH2+][C@H](CC)c1ccccc1O)C(C)C ZINC000156164837 1128628752 /nfs/dbraw/zinc/62/87/52/1128628752.db2.gz MOOSWOKYJLMMEE-NVXWUHKLSA-N 1 0 279.424 3.884 20 10 CHCDRO Cc1ccc(C2=CC[N@H+](Cc3ccccc3O)CC2)cc1 ZINC000778994048 1128674769 /nfs/dbraw/zinc/67/47/69/1128674769.db2.gz GKYBHQZXYPXBKF-UHFFFAOYSA-N 1 0 279.383 3.990 20 10 CHCDRO CCOC(C)(C)C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000159154682 1128675367 /nfs/dbraw/zinc/67/53/67/1128675367.db2.gz OFRKOONMGBCENE-UHFFFAOYSA-N 1 0 290.451 3.582 20 10 CHCDRO COc1cccc(C[C@H]2CCC[N@@H+]2Cc2ccccc2O)c1 ZINC000779000418 1128675503 /nfs/dbraw/zinc/67/55/03/1128675503.db2.gz VJTRIJDFFQEVOJ-QGZVFWFLSA-N 1 0 297.398 3.608 20 10 CHCDRO CC[C@]1(C)CCC[N@H+](Cc2cc(F)ccc2O)C1 ZINC000779019864 1128683552 /nfs/dbraw/zinc/68/35/52/1128683552.db2.gz IYQUAMUGJPOUQG-OAHLLOKOSA-N 1 0 251.345 3.543 20 10 CHCDRO Cc1cc(Br)cc([C@H](C)[NH2+]C2CC=CC2)c1O ZINC000779026836 1128688470 /nfs/dbraw/zinc/68/84/70/1128688470.db2.gz GQKOFKQISRHRBQ-JTQLQIEISA-N 1 0 296.208 3.832 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H]2CCCSC2)cc1 ZINC000159547821 1128707968 /nfs/dbraw/zinc/70/79/68/1128707968.db2.gz XPPYVOAACQBALM-UKRRQHHQSA-N 1 0 278.465 3.689 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]Cc1coc2ccccc12 ZINC000779081343 1128723924 /nfs/dbraw/zinc/72/39/24/1128723924.db2.gz SAYMGXOLGJFZPA-UHFFFAOYSA-N 1 0 271.291 3.567 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](C2CC2)C2CCC2)c(O)c1 ZINC000325009456 1117782559 /nfs/dbraw/zinc/78/25/59/1117782559.db2.gz CEFXDSTWFCIBTE-YVEFUNNKSA-N 1 0 259.393 3.930 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCOc3ccccc32)c(O)c1 ZINC000185405176 1117818500 /nfs/dbraw/zinc/81/85/00/1117818500.db2.gz NRMDKDGYETVXCZ-HUUCEWRRSA-N 1 0 297.398 3.918 20 10 CHCDRO C[C@H]([NH2+]C/C=C/c1ccccc1)c1ccc(F)cc1[O-] ZINC000185440042 1117824355 /nfs/dbraw/zinc/82/43/55/1117824355.db2.gz VGOUTUNTUFIFJH-LJLILKBBSA-N 1 0 271.335 3.895 20 10 CHCDRO CCO[C@@H]1C[C@H]([NH2+][C@@H](C)c2cc(C)ccc2O)C12CCC2 ZINC000185551237 1117845118 /nfs/dbraw/zinc/84/51/18/1117845118.db2.gz MEUYGPXPIFYTHH-RRQGHBQHSA-N 1 0 289.419 3.699 20 10 CHCDRO Cc1nc(CC[NH2+][C@H](C)c2cc(C)ccc2O)sc1C ZINC000185797355 1117896663 /nfs/dbraw/zinc/89/66/63/1117896663.db2.gz GKIFOKYEBCFIJF-GFCCVEGCSA-N 1 0 290.432 3.667 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2C[C@@H]2c2ccccc2)c1 ZINC000186017714 1117968750 /nfs/dbraw/zinc/96/87/50/1117968750.db2.gz ULOXNRDAIYBAJR-DDUZABMNSA-N 1 0 297.398 3.855 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H](C)Oc2ccccc2)c1 ZINC000186040744 1117974540 /nfs/dbraw/zinc/97/45/40/1117974540.db2.gz MEHZLGYVBGWSBL-CABCVRRESA-N 1 0 285.387 3.819 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H](C)Oc2ccccc2)c1 ZINC000186040775 1117974873 /nfs/dbraw/zinc/97/48/73/1117974873.db2.gz MEHZLGYVBGWSBL-GJZGRUSLSA-N 1 0 285.387 3.819 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCCO[C@@H]2C(C)C)c1 ZINC000186093331 1117990736 /nfs/dbraw/zinc/99/07/36/1117990736.db2.gz DJJZFMUCDPPXBW-RLFYNMQTSA-N 1 0 291.435 3.802 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCCC[C@H]2SC)c1 ZINC000300418866 1118027756 /nfs/dbraw/zinc/02/77/56/1118027756.db2.gz GCONUZKKIICBDZ-SGIREYDYSA-N 1 0 295.448 3.726 20 10 CHCDRO Cn1ccc(C[NH2+]Cc2cc(-c3ccccc3)ccc2O)c1 ZINC000748099437 1118059923 /nfs/dbraw/zinc/05/99/23/1118059923.db2.gz VRHDHRIJDMNGKI-UHFFFAOYSA-N 1 0 292.382 3.688 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)c2ccccc2O)cc1Cl ZINC000179889335 1118080670 /nfs/dbraw/zinc/08/06/70/1118080670.db2.gz QBOAQYLTYKYSJF-NSHDSACASA-N 1 0 291.778 3.905 20 10 CHCDRO CO[C@H](C[NH2+][C@@H](C)c1ccc2ccccc2c1O)C(C)C ZINC000381772522 1118090747 /nfs/dbraw/zinc/09/07/47/1118090747.db2.gz JSJFABCDZQQAGY-SUMWQHHRSA-N 1 0 287.403 3.867 20 10 CHCDRO CCC[C@H](C)[NH2+][C@@H](C)c1ccc(N2CCOCC2)c(F)c1 ZINC000764435451 1118091403 /nfs/dbraw/zinc/09/14/03/1118091403.db2.gz NGHFHPFTYZHFQJ-KBPBESRZSA-N 1 0 294.414 3.502 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CCOc2ccccc2)cc1 ZINC000764583228 1118100598 /nfs/dbraw/zinc/10/05/98/1118100598.db2.gz JNQVXXIWOGZDPB-INIZCTEOSA-N 1 0 298.430 3.872 20 10 CHCDRO C[C@H](CSC(C)(C)C)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000764635834 1118103904 /nfs/dbraw/zinc/10/39/04/1118103904.db2.gz RDSTYVOGHDEDQN-CYBMUJFWSA-N 1 0 280.481 3.762 20 10 CHCDRO COc1cccc(O)c1C[NH2+]Cc1ccc(C(F)F)cc1 ZINC000764979623 1118127996 /nfs/dbraw/zinc/12/79/96/1118127996.db2.gz HILWVLMUIDOIFV-UHFFFAOYSA-N 1 0 293.313 3.628 20 10 CHCDRO CC[C@@H](C)[C@H](C)[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000765080164 1118134263 /nfs/dbraw/zinc/13/42/63/1118134263.db2.gz LMGXPORZTGLHCT-CABCVRRESA-N 1 0 292.492 3.764 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](C)C1CC1)c1ccc(N(C)C)cc1 ZINC000765397147 1118148560 /nfs/dbraw/zinc/14/85/60/1118148560.db2.gz ZQJCDOHRNVPCKK-GUYCJALGSA-N 1 0 260.425 3.839 20 10 CHCDRO CO[C@@H](C)C[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000188127939 1128760010 /nfs/dbraw/zinc/76/00/10/1128760010.db2.gz YGLUGWNKOJFBIY-UONOGXRCSA-N 1 0 294.414 3.502 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCS[C@@H]1C)c1ccc(C)cc1O ZINC000842929647 1118170241 /nfs/dbraw/zinc/17/02/41/1118170241.db2.gz PLRZZYMKWXPDDU-KWCYVHTRSA-N 1 0 265.422 3.635 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCS[C@H]1C)c1ccc(C)cc1O ZINC000842929648 1118170421 /nfs/dbraw/zinc/17/04/21/1118170421.db2.gz PLRZZYMKWXPDDU-UBHSHLNASA-N 1 0 265.422 3.635 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCS[C@@H]1C)c1cc2c(cc1O)CCCC2 ZINC000842927863 1118171194 /nfs/dbraw/zinc/17/11/94/1118171194.db2.gz GEXHKSIDGOQYSA-OZVIIMIRSA-N 1 0 291.460 3.816 20 10 CHCDRO Cc1ccsc1[C@H](C)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000765608705 1118182020 /nfs/dbraw/zinc/18/20/20/1118182020.db2.gz JKTUKZINXIWXBX-LBPRGKRZSA-N 1 0 273.401 3.842 20 10 CHCDRO CC[N@H+](Cc1cc(Br)ccc1O)C1CCC1 ZINC000179829576 1128761294 /nfs/dbraw/zinc/76/12/94/1128761294.db2.gz ZDZOYCWZLAHWJP-UHFFFAOYSA-N 1 0 284.197 3.529 20 10 CHCDRO COc1cccc(C[NH2+][C@H]2CCCCC23CCCC3)c1O ZINC000386978844 1118188828 /nfs/dbraw/zinc/18/88/28/1118188828.db2.gz SCHRKCLEAVTCCP-INIZCTEOSA-N 1 0 289.419 3.993 20 10 CHCDRO CCOc1ccccc1C[N@H+](CC)Cc1ccccc1O ZINC001203543878 1118189371 /nfs/dbraw/zinc/18/93/71/1118189371.db2.gz JFEDLDCJQYYRFT-UHFFFAOYSA-N 1 0 285.387 3.813 20 10 CHCDRO Cc1ccsc1C[NH2+]Cc1ccc2c(c1)CCCO2 ZINC000921598835 1118204759 /nfs/dbraw/zinc/20/47/59/1118204759.db2.gz PJHTTZALSZTTLM-UHFFFAOYSA-N 1 0 273.401 3.671 20 10 CHCDRO CC(C)=CC[NH2+][C@@H](C)c1ccc(Br)cc1O ZINC000188444458 1128762721 /nfs/dbraw/zinc/76/27/21/1128762721.db2.gz OFVZNOQDTYFSLJ-JTQLQIEISA-N 1 0 284.197 3.772 20 10 CHCDRO CCOC(C)(C)C[NH2+][C@H](CC)c1ccc(N(C)C)cc1 ZINC000188684812 1128764416 /nfs/dbraw/zinc/76/44/16/1128764416.db2.gz VGNOQMAYRIRGIG-MRXNPFEDSA-N 1 0 278.440 3.608 20 10 CHCDRO C[C@@H]1CC(C)(C)C[N@@H+]1Cc1cccc(Cl)c1[O-] ZINC001652674274 1118273347 /nfs/dbraw/zinc/27/33/47/1118273347.db2.gz BGYILUKQMKVIAA-SNVBAGLBSA-N 1 0 253.773 3.666 20 10 CHCDRO CC[C@H]([NH2+]C1CCSCC1)c1ccc(N(C)C)cc1 ZINC000180510506 1118321550 /nfs/dbraw/zinc/32/15/50/1118321550.db2.gz SJELHHCGIHQXJK-INIZCTEOSA-N 1 0 278.465 3.689 20 10 CHCDRO CC(C)[C@H]1CCC[N@@H+]1Cc1cc(Br)ccc1O ZINC000211671287 1118332103 /nfs/dbraw/zinc/33/21/03/1118332103.db2.gz LEFWWMRNNJAJIH-CYBMUJFWSA-N 1 0 298.224 3.775 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CC[C@@H](CC(C)C)C2)c1O ZINC000307782520 1118452247 /nfs/dbraw/zinc/45/22/47/1118452247.db2.gz VRAXMJZOBILRKY-AWEZNQCLSA-N 1 0 277.408 3.659 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccccc1 ZINC000050285768 1118475025 /nfs/dbraw/zinc/47/50/25/1118475025.db2.gz FYNYRDXQHCGSNZ-HNNXBMFYSA-N 1 0 280.415 3.920 20 10 CHCDRO CCC1CCC(C[NH2+]Cc2ccc3c(c2)CCO3)CC1 ZINC000109917488 1118586865 /nfs/dbraw/zinc/58/68/65/1118586865.db2.gz RSNCNYVYBIPMIE-UHFFFAOYSA-N 1 0 273.420 3.928 20 10 CHCDRO CN(C)c1ccc(C[NH2+]CC2CCC(F)(F)CC2)cc1 ZINC000693392166 1118616251 /nfs/dbraw/zinc/61/62/51/1118616251.db2.gz KYDUCCSXZFNYRV-UHFFFAOYSA-N 1 0 282.378 3.668 20 10 CHCDRO CCC[NH+](CCC)Cc1c(O)cccc1Br ZINC000707140188 1118643515 /nfs/dbraw/zinc/64/35/15/1118643515.db2.gz BYLWGDOUCKWPPA-UHFFFAOYSA-N 1 0 286.213 3.777 20 10 CHCDRO C[C@@H]1CCCCC[N@@H+]1Cc1c(O)cccc1Br ZINC000707146648 1118648087 /nfs/dbraw/zinc/64/80/87/1118648087.db2.gz PDYHPGVUHXHYLP-LLVKDONJSA-N 1 0 298.224 3.919 20 10 CHCDRO CC[C@H]([NH2+]CCCOC(C)C)c1ccc(N(C)C)cc1 ZINC000178192493 1118719382 /nfs/dbraw/zinc/71/93/82/1118719382.db2.gz HEFXUKUDAAAQKM-KRWDZBQOSA-N 1 0 278.440 3.608 20 10 CHCDRO CCC(CC)[N@H+](Cc1ccc(OC)c(OC)c1O)C1CC1 ZINC000891596813 1118719864 /nfs/dbraw/zinc/71/98/64/1118719864.db2.gz XTTMTPRVWQONKN-UHFFFAOYSA-N 1 0 293.407 3.562 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1ccc(C)cc1O)[C@H]1CCCOC1 ZINC000723990762 1118797149 /nfs/dbraw/zinc/79/71/49/1118797149.db2.gz TYMHFOXNBRNMEA-YCPHGPKFSA-N 1 0 277.408 3.556 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CC)c1ccccc1O)[C@H]1CCCOC1 ZINC000723990991 1118797969 /nfs/dbraw/zinc/79/79/69/1118797969.db2.gz YGNUPKRMNGBRLX-IMJJTQAJSA-N 1 0 277.408 3.638 20 10 CHCDRO CCC(C)(C)OCC[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000308764870 1118898157 /nfs/dbraw/zinc/89/81/57/1118898157.db2.gz ZXICWGYDPKQRAI-ZDUSSCGKSA-N 1 0 265.397 3.556 20 10 CHCDRO Oc1ccccc1C[NH2+][C@@H](c1ccco1)c1ccccc1 ZINC000041640174 1118949632 /nfs/dbraw/zinc/94/96/32/1118949632.db2.gz NEYHBCBFELWCRO-GOSISDBHSA-N 1 0 279.339 3.864 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H]1CC=CCC1 ZINC000226512100 1119074911 /nfs/dbraw/zinc/07/49/11/1119074911.db2.gz CKTJWYOUHVQFLN-MCIONIFRSA-N 1 0 257.377 3.947 20 10 CHCDRO COc1ccc(C[NH2+]CCc2cccc(C)c2)cc1C ZINC000051669404 1119078564 /nfs/dbraw/zinc/07/85/64/1119078564.db2.gz UFCJADNGDYMBAA-UHFFFAOYSA-N 1 0 269.388 3.644 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CC[C@H]2CCCC[C@@H]2C1 ZINC000226561858 1119157398 /nfs/dbraw/zinc/15/73/98/1119157398.db2.gz LPMLKPNHKOSOPK-CHWSQXEVSA-N 1 0 263.356 3.543 20 10 CHCDRO C[C@@H]1CCC[C@@H](C[NH2+]Cc2c(O)cccc2Cl)C1 ZINC000226646772 1119255689 /nfs/dbraw/zinc/25/56/89/1119255689.db2.gz KJJDTBUTIJDDQR-VXGBXAGGSA-N 1 0 267.800 3.962 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccc(C)nc1)c1ccc(N(C)C)cc1 ZINC000161587731 1119314339 /nfs/dbraw/zinc/31/43/39/1119314339.db2.gz QUMBVQIJTHXWHU-IBGZPJMESA-N 1 0 297.446 3.739 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCC2SCCS2)c1 ZINC000693774654 1119332856 /nfs/dbraw/zinc/33/28/56/1119332856.db2.gz BQQJTJYDTISEGP-NSHDSACASA-N 1 0 283.462 3.547 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(F)cc1F)c1ccccc1O ZINC000051016584 1119361074 /nfs/dbraw/zinc/36/10/74/1119361074.db2.gz ZEMUNUIEIIEOCT-OAHLLOKOSA-N 1 0 277.314 3.911 20 10 CHCDRO COc1cc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)ccc1C ZINC000161780942 1119379873 /nfs/dbraw/zinc/37/98/73/1119379873.db2.gz ZDEGTFTZFYOQCC-HNNXBMFYSA-N 1 0 298.430 3.920 20 10 CHCDRO C[C@@H]1CCC[C@H](C[NH2+]Cc2ccc3c(c2)CCO3)C1 ZINC000219471169 1119472037 /nfs/dbraw/zinc/47/20/37/1119472037.db2.gz BJSBRMLGPDMRTL-KGLIPLIRSA-N 1 0 259.393 3.537 20 10 CHCDRO CSC[C@H](C)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000168786564 1119478074 /nfs/dbraw/zinc/47/80/74/1119478074.db2.gz NRIBYLOGNHYPPK-RYUDHWBXSA-N 1 0 275.417 3.948 20 10 CHCDRO C[C@H]1CC[C@H]([NH2+]Cc2c(O)cccc2Cl)CC1 ZINC000252954269 1119578446 /nfs/dbraw/zinc/57/84/46/1119578446.db2.gz HJFSWUKYDRNURD-XYPYZODXSA-N 1 0 253.773 3.714 20 10 CHCDRO Cc1cccc(CC[NH2+][C@@H](C)c2ccccc2O)c1 ZINC000051668879 1119641403 /nfs/dbraw/zinc/64/14/03/1119641403.db2.gz RIJPMSNRKFWBNK-AWEZNQCLSA-N 1 0 255.361 3.594 20 10 CHCDRO C[C@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1ccccc1O ZINC000179900383 1119791888 /nfs/dbraw/zinc/79/18/88/1119791888.db2.gz KYDOMZSYAMRVLS-ZDUSSCGKSA-N 1 0 285.391 3.555 20 10 CHCDRO CCc1cccc(C[N@@H+]2CC[C@H](C3CCCC3)C2)c1O ZINC000708869431 1120039271 /nfs/dbraw/zinc/03/92/71/1120039271.db2.gz LLWJUJBMTAHCSJ-INIZCTEOSA-N 1 0 273.420 3.967 20 10 CHCDRO COCC[N@@H+](Cc1c(O)ccc2ccccc21)CC(C)C ZINC000073585862 1120041751 /nfs/dbraw/zinc/04/17/51/1120041751.db2.gz KPSLYGKRPULABY-UHFFFAOYSA-N 1 0 287.403 3.650 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2cc(F)ccc2F)c1 ZINC000107929075 1120062364 /nfs/dbraw/zinc/06/23/64/1120062364.db2.gz LZPKBXHJVOVVEJ-LLVKDONJSA-N 1 0 277.314 3.830 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCCC(F)(F)C2)c1 ZINC000695123551 1120109866 /nfs/dbraw/zinc/10/98/66/1120109866.db2.gz AQDYMSVPNLJKLS-NWDGAFQWSA-N 1 0 269.335 3.929 20 10 CHCDRO COc1cc(O)c(C[NH+]2CCC3(CCC3)CC2)c(Cl)c1 ZINC001236799177 1128893460 /nfs/dbraw/zinc/89/34/60/1128893460.db2.gz RWBNFLATVXQUSQ-UHFFFAOYSA-N 1 0 295.810 3.820 20 10 CHCDRO CO[C@H](C[NH2+][C@H](C)c1ccccc1O)C1CCCCC1 ZINC000695159886 1120125534 /nfs/dbraw/zinc/12/55/34/1120125534.db2.gz HHEXYGLCFPWORI-CXAGYDPISA-N 1 0 277.408 3.638 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2CCC[C@H](CO)C2)c1O ZINC000840893391 1120140146 /nfs/dbraw/zinc/14/01/46/1120140146.db2.gz GNAIOVYMHIKOEV-SGMGOOAPSA-N 1 0 297.826 3.556 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc2c(c1)CCCO2)c1ccncc1 ZINC000921774702 1120207593 /nfs/dbraw/zinc/20/75/93/1120207593.db2.gz AJWDCISMFQADSW-KRWDZBQOSA-N 1 0 282.387 3.648 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)c1ccc(N2CCCCC2)cc1)c1cn[nH]c1 ZINC000271461001 1120253814 /nfs/dbraw/zinc/25/38/14/1120253814.db2.gz HJKONTUCBAHXAP-HUUCEWRRSA-N 1 0 298.434 3.812 20 10 CHCDRO C[C@@H]([NH2+]CCN1CCCCCC1)c1cc(Cl)ccc1O ZINC000756379108 1120278344 /nfs/dbraw/zinc/27/83/44/1120278344.db2.gz LJVPSJIWFGZWKU-CYBMUJFWSA-N 1 0 296.842 3.572 20 10 CHCDRO Cc1nc(C(C)(C)[NH2+]Cc2cc(C)ccc2O)sc1C ZINC000076904613 1120300748 /nfs/dbraw/zinc/30/07/48/1120300748.db2.gz HVWVDWQXHYFSKJ-UHFFFAOYSA-N 1 0 290.432 3.799 20 10 CHCDRO CC[C@H]([NH2+]Cc1cncc(C)c1)c1ccc(N(C)C)cc1 ZINC000181837470 1128906686 /nfs/dbraw/zinc/90/66/86/1128906686.db2.gz KZFZGVOOBSLXHQ-SFHVURJKSA-N 1 0 283.419 3.697 20 10 CHCDRO CC[C@H](C[NH2+][C@@H](C)c1ccc(C)c(C)c1O)N1CCCC1 ZINC000756400923 1120311145 /nfs/dbraw/zinc/31/11/45/1120311145.db2.gz LFCVONACOJMYIO-JKSUJKDBSA-N 1 0 290.451 3.534 20 10 CHCDRO CC[C@H](C[NH2+][C@H](C)c1ccc(C)c(C)c1O)N1CCCC1 ZINC000756400920 1120311283 /nfs/dbraw/zinc/31/12/83/1120311283.db2.gz LFCVONACOJMYIO-HZPDHXFCSA-N 1 0 290.451 3.534 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccc([C@H](C)O)cc2)c1 ZINC000185119627 1120371070 /nfs/dbraw/zinc/37/10/70/1120371070.db2.gz VQCZIFUVEBYVPF-KBPBESRZSA-N 1 0 285.387 3.605 20 10 CHCDRO CCO[C@@H](CC[NH2+][C@H](C)c1cc(C)ccc1O)C(C)C ZINC000185625388 1120380039 /nfs/dbraw/zinc/38/00/39/1120380039.db2.gz HUDZKSGRNGRCIO-PBHICJAKSA-N 1 0 279.424 3.802 20 10 CHCDRO Cc1cnc([C@@H](C)C[NH2+][C@H](C)c2ccccc2O)s1 ZINC000186774503 1120405357 /nfs/dbraw/zinc/40/53/57/1120405357.db2.gz KFVPHEQKXAUTGC-CMPLNLGQSA-N 1 0 276.405 3.611 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCCO[C@@H]2CC(C)C)c(O)c1 ZINC000186824187 1120406110 /nfs/dbraw/zinc/40/61/10/1120406110.db2.gz YZMQTROSMSTNHR-YXJHDRRASA-N 1 0 291.435 3.945 20 10 CHCDRO CCOc1cccc(C[NH2+]C2CCC3(CC3)CC2)c1O ZINC000695761294 1120444709 /nfs/dbraw/zinc/44/47/09/1120444709.db2.gz QKRVHVKJFWIULM-UHFFFAOYSA-N 1 0 275.392 3.603 20 10 CHCDRO COc1cccc(C[NH2+][C@H]2CCC[C@@H](C(C)C)C2)c1O ZINC000728777069 1120456952 /nfs/dbraw/zinc/45/69/52/1120456952.db2.gz YAQOUPLUVLNKJD-HIFRSBDPSA-N 1 0 277.408 3.705 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccccc1F)c1ccccc1O ZINC000019950291 1120550014 /nfs/dbraw/zinc/55/00/14/1120550014.db2.gz TWJLIAFOQSLKIE-OAHLLOKOSA-N 1 0 259.324 3.772 20 10 CHCDRO COc1cccc(C[NH2+][C@@H](C)c2ccc(F)cc2C)c1O ZINC000922671718 1120576871 /nfs/dbraw/zinc/57/68/71/1120576871.db2.gz SYEBTFQOXJJCMT-LBPRGKRZSA-N 1 0 289.350 3.699 20 10 CHCDRO CCC[N@@H+](Cc1cccc(OCC)c1O)CC(C)C ZINC000311411170 1120619061 /nfs/dbraw/zinc/61/90/61/1120619061.db2.gz IPYXEEIQAFBHMT-UHFFFAOYSA-N 1 0 265.397 3.659 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]CCCNc1ccccc1 ZINC000124222273 1120652716 /nfs/dbraw/zinc/65/27/16/1120652716.db2.gz MFKQTDZMNZMDNB-UHFFFAOYSA-N 1 0 290.794 3.637 20 10 CHCDRO CC(C)C[C@@H]1OCCC[C@@H]1[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000186828067 1120674805 /nfs/dbraw/zinc/67/48/05/1120674805.db2.gz KKMPOWITWFIEHI-NUTKFTJISA-N 1 0 295.398 3.776 20 10 CHCDRO CS[C@@H]1CC[C@@H]([N@H+](C)Cc2ccc(N(C)C)c(C)c2)C1 ZINC001117704618 1120676696 /nfs/dbraw/zinc/67/66/96/1120676696.db2.gz ICNAVIMRTDDWOK-HZPDHXFCSA-N 1 0 292.492 3.777 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(C)c(C)n2)c1 ZINC000314352808 1120933335 /nfs/dbraw/zinc/93/33/35/1120933335.db2.gz WIASFLMRXAYCAW-AWEZNQCLSA-N 1 0 270.376 3.563 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCSC1)c1ccc2ccccc2c1O ZINC000228557400 1120970361 /nfs/dbraw/zinc/97/03/61/1120970361.db2.gz CNILKSJFFKQRKM-STQMWFEESA-N 1 0 287.428 3.949 20 10 CHCDRO Oc1cccc2c1CC[C@H]2[NH2+]Cc1cc(Cl)ccc1O ZINC000105486529 1120978328 /nfs/dbraw/zinc/97/83/28/1120978328.db2.gz AQBKMTUEDXNZJN-CQSZACIVSA-N 1 0 289.762 3.528 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H]2C[C@H](c3ccccc3)[C@H]2C)c1 ZINC000763518640 1128960894 /nfs/dbraw/zinc/96/08/94/1128960894.db2.gz NJDLVYMZRLOXCN-FHLIZLRMSA-N 1 0 281.399 3.982 20 10 CHCDRO C[C@H]([NH2+]CCOC1CCCCC1)c1cc(F)ccc1O ZINC000094618227 1121086148 /nfs/dbraw/zinc/08/61/48/1121086148.db2.gz BQXCQDDDOUQMKN-LBPRGKRZSA-N 1 0 281.371 3.531 20 10 CHCDRO CC[C@H]([NH2+][C@H]1C=CCC1)c1cc(Br)ccc1O ZINC000700586043 1121107256 /nfs/dbraw/zinc/10/72/56/1121107256.db2.gz GJOPMPBYFYVUBR-AAEUAGOBSA-N 1 0 296.208 3.914 20 10 CHCDRO Cc1ccncc1CCC[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC000779510413 1128965394 /nfs/dbraw/zinc/96/53/94/1128965394.db2.gz KTJRTSYWNRCCAI-UHFFFAOYSA-N 1 0 297.446 3.521 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)C2CCCC2)c1 ZINC000070305439 1128966421 /nfs/dbraw/zinc/96/64/21/1128966421.db2.gz GNVKTZMWQSMXCT-NEPJUHHUSA-N 1 0 263.381 3.630 20 10 CHCDRO C[C@H]([NH2+]Cc1cc(Cl)ccc1O)C1CCCC1 ZINC000070305459 1128966702 /nfs/dbraw/zinc/96/67/02/1128966702.db2.gz COCNXIAQVLOQLF-JTQLQIEISA-N 1 0 253.773 3.714 20 10 CHCDRO CSCC[C@@H](C)[NH2+]Cc1cc2ccccc2cc1O ZINC001258207627 1128967488 /nfs/dbraw/zinc/96/74/88/1128967488.db2.gz FODRQVDRCKJEEN-GFCCVEGCSA-N 1 0 275.417 3.777 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CCC(F)(F)F)cc1 ZINC000063099243 1121197993 /nfs/dbraw/zinc/19/79/93/1121197993.db2.gz QMNKDZLTIUMDER-UHFFFAOYSA-N 1 0 274.330 3.575 20 10 CHCDRO CCc1cccc(C[NH2+][C@H]2CCCC(F)(F)C2)c1O ZINC000702566238 1121204699 /nfs/dbraw/zinc/20/46/99/1121204699.db2.gz UNLPLDKACDMFLC-ZDUSSCGKSA-N 1 0 269.335 3.622 20 10 CHCDRO Cc1cc(C[NH2+][C@H]2CCOC[C@@H]2C)c(C)n1-c1ccccc1 ZINC000319022502 1121224305 /nfs/dbraw/zinc/22/43/05/1121224305.db2.gz IDEDYTDXHDUVDE-LIRRHRJNSA-N 1 0 298.430 3.609 20 10 CHCDRO Oc1cccc(Nc2ccc(C[NH+]3CCCCC3)cc2)c1O ZINC001175366421 1121299790 /nfs/dbraw/zinc/29/97/90/1121299790.db2.gz JKJXSNQGROYHLI-UHFFFAOYSA-N 1 0 298.386 3.827 20 10 CHCDRO CCO[C@@H]1C[C@@H]([NH2+]Cc2cc(C)ccc2O)C12CCCC2 ZINC000236876904 1121368362 /nfs/dbraw/zinc/36/83/62/1121368362.db2.gz ZZWAYNSHEZNTNE-IAGOWNOFSA-N 1 0 289.419 3.528 20 10 CHCDRO CCC[C@@H](C[NH2+][C@@H](C)c1cc(C)ccc1O)OCC ZINC000705314313 1121395947 /nfs/dbraw/zinc/39/59/47/1121395947.db2.gz HVSKCTGAGPLFQJ-KBPBESRZSA-N 1 0 265.397 3.556 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]CC2CC(C)(C)C2)c1O ZINC000706493504 1121432419 /nfs/dbraw/zinc/43/24/19/1121432419.db2.gz HBAYMWVRDPDHSP-UHFFFAOYSA-N 1 0 283.799 3.580 20 10 CHCDRO COc1cccc(C[NH2+]CC[C@H]2CCC[C@@H](C)C2)c1O ZINC000070546717 1128984936 /nfs/dbraw/zinc/98/49/36/1128984936.db2.gz NPKBEOIUSFMCMZ-ZIAGYGMSSA-N 1 0 277.408 3.707 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)C1(C)CC1 ZINC000706906032 1121444619 /nfs/dbraw/zinc/44/46/19/1121444619.db2.gz ROXSHYLHBISTPU-OAHLLOKOSA-N 1 0 272.436 3.955 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCCC23CC3)c1 ZINC000707043751 1121449327 /nfs/dbraw/zinc/44/93/27/1121449327.db2.gz PUVYQDSSYBTGGJ-QWHCGFSZSA-N 1 0 275.392 3.632 20 10 CHCDRO CCC[C@H](C[NH2+][C@H](C)c1ccc(N(C)C)cc1)OCC ZINC000707801302 1121462873 /nfs/dbraw/zinc/46/28/73/1121462873.db2.gz OORPKQNYHCGJSL-RHSMWYFYSA-N 1 0 278.440 3.608 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CC(C)(C)OC1(C)C)c1ccccc1O ZINC000709662003 1121468835 /nfs/dbraw/zinc/46/88/35/1121468835.db2.gz HGBKLWSGVCRMPH-OLZOCXBDSA-N 1 0 277.408 3.637 20 10 CHCDRO COc1cccc(C[NH2+][C@@H](C)CC2CCCCC2)c1O ZINC000709875912 1121472186 /nfs/dbraw/zinc/47/21/86/1121472186.db2.gz IJPWHHQXHYTXCY-ZDUSSCGKSA-N 1 0 277.408 3.849 20 10 CHCDRO COc1ccc(C[NH2+][C@@]2(C)CCOc3ccccc32)cc1C ZINC000923025721 1121513941 /nfs/dbraw/zinc/51/39/41/1121513941.db2.gz OAOWWCBYMJYQLF-IBGZPJMESA-N 1 0 297.398 3.791 20 10 CHCDRO CCOc1cccc(C[NH2+][C@H](C)Cc2ccccc2C)c1O ZINC000236960620 1121530402 /nfs/dbraw/zinc/53/04/02/1121530402.db2.gz LLEXDGJSTKYJLR-OAHLLOKOSA-N 1 0 299.414 3.820 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCC2(CCC2)O1)c1ccccc1O ZINC000711458537 1121536547 /nfs/dbraw/zinc/53/65/47/1121536547.db2.gz XNCNFHDMQAIDLC-ZFWWWQNUSA-N 1 0 275.392 3.535 20 10 CHCDRO CSC[C@H](C)[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC000168786156 1121610516 /nfs/dbraw/zinc/61/05/16/1121610516.db2.gz SGLZTHPCGXCBMI-WOPDTQHZSA-N 1 0 265.422 3.590 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]C1CCC(F)(F)CC1 ZINC000688480984 1128998813 /nfs/dbraw/zinc/99/88/13/1128998813.db2.gz GMCJDKMCYOSHOC-UHFFFAOYSA-N 1 0 275.726 3.713 20 10 CHCDRO CC[C@@H](Cc1ccccc1)[NH2+]Cc1cc(C)ccc1O ZINC000237030870 1121645582 /nfs/dbraw/zinc/64/55/82/1121645582.db2.gz KKKXUHPUKQLSGE-KRWDZBQOSA-N 1 0 269.388 3.812 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]C2(C)CCC(C)CC2)c1 ZINC000237032846 1121647125 /nfs/dbraw/zinc/64/71/25/1121647125.db2.gz SKWLUJHUXYRJIV-UHFFFAOYSA-N 1 0 277.408 3.849 20 10 CHCDRO COc1cc(C)cc(C[NH2+][C@H]2CCCc3ccccc32)c1O ZINC000894144847 1121665706 /nfs/dbraw/zinc/66/57/06/1121665706.db2.gz CFMDVSBKUCGDIL-KRWDZBQOSA-N 1 0 297.398 3.876 20 10 CHCDRO CN(C)c1cc(F)c(C[NH2+]CC2CCCCC2)cc1F ZINC001177081249 1121710345 /nfs/dbraw/zinc/71/03/45/1121710345.db2.gz GQBDPQDCILPYHS-UHFFFAOYSA-N 1 0 282.378 3.701 20 10 CHCDRO [O-]c1c(F)cc(Cl)cc1C[NH2+]Cc1ccccc1F ZINC001177117155 1121710421 /nfs/dbraw/zinc/71/04/21/1121710421.db2.gz JYYLGDVCWGHRAJ-UHFFFAOYSA-N 1 0 283.705 3.614 20 10 CHCDRO CCC[N@H+](CCc1cccs1)Cc1ccccc1O ZINC000727830916 1121750894 /nfs/dbraw/zinc/75/08/94/1121750894.db2.gz VJAPRBCORLIFNU-UHFFFAOYSA-N 1 0 275.417 3.908 20 10 CHCDRO CC1(C)CC[C@@H]([NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC001178209557 1121772321 /nfs/dbraw/zinc/77/23/21/1121772321.db2.gz WSQSUMGZPDVUHU-OAHLLOKOSA-N 1 0 259.393 3.680 20 10 CHCDRO CC[C@@H](CC(F)(F)F)[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001178430268 1121783325 /nfs/dbraw/zinc/78/33/25/1121783325.db2.gz DHLFNNZSMDOJSS-ZDUSSCGKSA-N 1 0 287.325 3.832 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CCC[C@H]2c2ccc[nH]2)cc1 ZINC000773775652 1121823460 /nfs/dbraw/zinc/82/34/60/1121823460.db2.gz JAVIJLKIEOOHBO-SFHVURJKSA-N 1 0 283.419 3.808 20 10 CHCDRO CO[C@@H]1CCCC[C@H]1[NH2+]Cc1c(C)c2ccccc2n1C ZINC001179086788 1121846609 /nfs/dbraw/zinc/84/66/09/1121846609.db2.gz UIWXNKDQOQSTBC-CRAIPNDOSA-N 1 0 286.419 3.534 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)cc1 ZINC001179228837 1121861532 /nfs/dbraw/zinc/86/15/32/1121861532.db2.gz UAIHZSPZWCUIJS-LXEGMVBOSA-N 1 0 284.447 3.792 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CC[C@@H](C(F)(F)F)C2)cc1 ZINC000773809111 1121863675 /nfs/dbraw/zinc/86/36/75/1121863675.db2.gz NLIGAPVBWKUNTI-CYBMUJFWSA-N 1 0 286.341 3.527 20 10 CHCDRO CCCOc1ccc(C[NH2+][C@@H]2[C@@H]3CCC[C@@H]32)cc1C ZINC001179266695 1121866464 /nfs/dbraw/zinc/86/64/64/1121866464.db2.gz VYEJZYBBNWPOOI-SCAQPMJSSA-N 1 0 259.393 3.672 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[NH2+]CC1(CC2CC2)CC1 ZINC001179464660 1121881155 /nfs/dbraw/zinc/88/11/55/1121881155.db2.gz WSRVQVNRNBGJBM-UHFFFAOYSA-N 1 0 284.447 3.957 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCCc2ccccc2C1)c1ccccc1O ZINC001179494339 1121885122 /nfs/dbraw/zinc/88/51/22/1121885122.db2.gz PSTCSPHYDVFSSR-YOEHRIQHSA-N 1 0 281.399 3.990 20 10 CHCDRO CCC[C@@](C)(O)C[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000732819902 1121940775 /nfs/dbraw/zinc/94/07/75/1121940775.db2.gz BXFPVPSAFLLEHJ-LJQANCHMSA-N 1 0 299.414 3.700 20 10 CHCDRO COc1ccccc1CC(C)(C)[NH2+]Cc1cc(C)ccc1O ZINC000733328193 1121978421 /nfs/dbraw/zinc/97/84/21/1121978421.db2.gz KFXLNNCVORNJQL-UHFFFAOYSA-N 1 0 299.414 3.820 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C/C=C/c2ccccc2)c1 ZINC000733326525 1121978618 /nfs/dbraw/zinc/97/86/18/1121978618.db2.gz IHVVKKVXHUPXFV-VMPITWQZSA-N 1 0 253.345 3.504 20 10 CHCDRO Oc1ccc(C[N@@H+]2CC[C@H](C3CCCCC3)C2)c(O)c1 ZINC001204278285 1122009077 /nfs/dbraw/zinc/00/90/77/1122009077.db2.gz CXHIYAIFXZVJAJ-AWEZNQCLSA-N 1 0 275.392 3.500 20 10 CHCDRO CCN(C)c1ccc(C[N@H+](C)Cc2ccn(CC)c2)cc1 ZINC000773888820 1122026956 /nfs/dbraw/zinc/02/69/56/1122026956.db2.gz PBRIACZWTATVEH-UHFFFAOYSA-N 1 0 285.435 3.596 20 10 CHCDRO CC[C@H]1[C@H](C)CC[N@@H+]1Cc1ccc(N(C)C)cc1C ZINC001181102712 1122033293 /nfs/dbraw/zinc/03/32/93/1122033293.db2.gz RYWXQRCVCSWNNA-DYVFJYSZSA-N 1 0 260.425 3.681 20 10 CHCDRO CC(C)[C@@H]1C[C@H]1C[NH2+]Cc1ccc(Br)cc1O ZINC001181809345 1122081846 /nfs/dbraw/zinc/08/18/46/1122081846.db2.gz YSHKFHKKHUTRSV-AAEUAGOBSA-N 1 0 298.224 3.536 20 10 CHCDRO COc1cc(C)c(C[NH2+]CCC(C)(C)C2CC2)c(O)c1 ZINC001182087480 1122108086 /nfs/dbraw/zinc/10/80/86/1122108086.db2.gz QGISERMSCPUJKI-UHFFFAOYSA-N 1 0 277.408 3.625 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H](c2ccccc2)N(C)C)c1 ZINC000192743799 1129032975 /nfs/dbraw/zinc/03/29/75/1129032975.db2.gz PMYXJPXITCBTPV-MAUKXSAKSA-N 1 0 298.430 3.654 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccc3c(c2)OCO3)c(O)c1 ZINC000192749851 1129033923 /nfs/dbraw/zinc/03/39/23/1129033923.db2.gz AVIIXEVAVDUYQA-OLZOCXBDSA-N 1 0 299.370 3.841 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccccc1N(C)C)c1ccccc1O ZINC000271758384 1122173881 /nfs/dbraw/zinc/17/38/81/1122173881.db2.gz ZAXMZFYYTJPUJB-INIZCTEOSA-N 1 0 284.403 3.699 20 10 CHCDRO CC(C)O[C@H]1CCC[N@H+](Cc2cc(C(C)C)ccc2O)C1 ZINC001206544655 1122195918 /nfs/dbraw/zinc/19/59/18/1122195918.db2.gz MZFOYWIYTCKXKW-KRWDZBQOSA-N 1 0 291.435 3.905 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCC[C@H]1c1ccsc1 ZINC000272249110 1122196390 /nfs/dbraw/zinc/19/63/90/1122196390.db2.gz HWMKTRGLSYPKHE-AWEZNQCLSA-N 1 0 259.374 3.791 20 10 CHCDRO CC[C@@H]1[C@H](C)CC[N@@H+]1Cc1c(O)ccc2ccncc21 ZINC000774623156 1122220656 /nfs/dbraw/zinc/22/06/56/1122220656.db2.gz ZFRNCQVXRZNZAU-MLGOLLRUSA-N 1 0 270.376 3.561 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2cn3ccccc3n2)c(O)c1C ZINC000273303095 1122227988 /nfs/dbraw/zinc/22/79/88/1122227988.db2.gz CBMYRGCMXWRNGO-CQSZACIVSA-N 1 0 295.386 3.508 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2cccnc2)c(O)c1C ZINC000273412842 1122232115 /nfs/dbraw/zinc/23/21/15/1122232115.db2.gz QEENPNDNHXCAHI-KBPBESRZSA-N 1 0 270.376 3.816 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCCc2ccccn2)c(O)c1C ZINC000273452873 1122234385 /nfs/dbraw/zinc/23/43/85/1122234385.db2.gz GLROVEKABIDWNG-HNNXBMFYSA-N 1 0 284.403 3.687 20 10 CHCDRO CC(C)c1ccc(O)c(C[NH2+]Cc2noc3ccccc23)c1 ZINC001183769602 1122238123 /nfs/dbraw/zinc/23/81/23/1122238123.db2.gz UMWCWTWURTUUSC-UHFFFAOYSA-N 1 0 296.370 3.947 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCCSC1)c1cc(Cl)ccc1O ZINC000273586194 1122239925 /nfs/dbraw/zinc/23/99/25/1122239925.db2.gz NWPCCDFMIOXBIT-GXSJLCMTSA-N 1 0 271.813 3.592 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](CCO)CC(C)C)c(O)c1C ZINC000273608503 1122240275 /nfs/dbraw/zinc/24/02/75/1122240275.db2.gz UYEMGKAXAOAXBF-HOTGVXAUSA-N 1 0 293.451 3.704 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2cn3cc(C)ccc3n2)c1 ZINC000273618329 1122240778 /nfs/dbraw/zinc/24/07/78/1122240778.db2.gz YETOZGQKLCDYHF-AWEZNQCLSA-N 1 0 295.386 3.508 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CCC[C@H](CF)C1 ZINC000711498573 1122297162 /nfs/dbraw/zinc/29/71/62/1122297162.db2.gz QHMUFHXGXCBOAF-CYBMUJFWSA-N 1 0 273.351 3.727 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCC[C@H](C)[C@@H](C)C2)c1O ZINC001203602258 1122302627 /nfs/dbraw/zinc/30/26/27/1122302627.db2.gz LSTGZLFKRPTXRI-KBPBESRZSA-N 1 0 277.408 3.659 20 10 CHCDRO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)C[C@H]1CCC=CO1 ZINC000774832726 1122319368 /nfs/dbraw/zinc/31/93/68/1122319368.db2.gz KUGANBKUNOCEPN-GOSISDBHSA-N 1 0 288.435 3.656 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccc(F)c(F)c1)c1ccccc1O ZINC000183345797 1129047046 /nfs/dbraw/zinc/04/70/46/1129047046.db2.gz AODRSZYNFYMBQN-INIZCTEOSA-N 1 0 291.341 3.954 20 10 CHCDRO COc1ccc(C[N@@H+]2CCCC3(CCCC3)C2)c(O)c1 ZINC001203621248 1122350095 /nfs/dbraw/zinc/35/00/95/1122350095.db2.gz QGZNDNGRAILZLZ-UHFFFAOYSA-N 1 0 275.392 3.557 20 10 CHCDRO C[C@@H]([NH2+]CC1(c2ccccc2)CC1)c1ccccc1O ZINC000183402515 1129051004 /nfs/dbraw/zinc/05/10/04/1129051004.db2.gz SVLZGOLUGASRJC-CQSZACIVSA-N 1 0 267.372 3.775 20 10 CHCDRO CC(C)[C@H]1CC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC000135648857 1122433898 /nfs/dbraw/zinc/43/38/98/1122433898.db2.gz RHKUZHMWJMIOCK-NSHDSACASA-N 1 0 253.773 3.524 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@H]1CCO[C@@H](C(C)C)C1 ZINC000775140242 1122439618 /nfs/dbraw/zinc/43/96/18/1122439618.db2.gz LGPXMZXNXAPMCH-ZWKOTPCHSA-N 1 0 290.451 3.565 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCCN(c2ccccc2)C1)c1ccccc1O ZINC000183514189 1129059423 /nfs/dbraw/zinc/05/94/23/1129059423.db2.gz XJGCZCLLONZOOY-HOTGVXAUSA-N 1 0 296.414 3.712 20 10 CHCDRO Cc1ccc(O[C@@H](C)C[NH2+][C@H](C)c2ccccc2O)cc1 ZINC000183534517 1129060991 /nfs/dbraw/zinc/06/09/91/1129060991.db2.gz PQYHTDDFJCKIMF-LSDHHAIUSA-N 1 0 285.387 3.819 20 10 CHCDRO CC[C@H](CSC)[NH2+][C@@H](C)c1ccc(N(C)CC)cc1 ZINC000775420204 1122559848 /nfs/dbraw/zinc/55/98/48/1122559848.db2.gz IBVUUAIXPUDSOL-DZGCQCFKSA-N 1 0 280.481 3.935 20 10 CHCDRO CN(Cc1nsc2ccccc21)Cc1ccccc1O ZINC001191683490 1122610675 /nfs/dbraw/zinc/61/06/75/1122610675.db2.gz WXRFUAFUAGHZDF-UHFFFAOYSA-N 1 0 284.384 3.634 20 10 CHCDRO CCOCCC[NH2+][C@H](CC)c1cc(Cl)ccc1O ZINC000775482846 1122615131 /nfs/dbraw/zinc/61/51/31/1122615131.db2.gz DFLZJAHVPOFXNN-CYBMUJFWSA-N 1 0 271.788 3.513 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](C)N1CCCC[C@H]1C)c1ccccc1O ZINC000775492755 1122622236 /nfs/dbraw/zinc/62/22/36/1122622236.db2.gz QLVIMIPPUIHBDE-INMHGKMJSA-N 1 0 290.451 3.696 20 10 CHCDRO CC[C@H]([NH2+]CCOc1ccccc1C)c1ccccc1O ZINC000775498318 1122629015 /nfs/dbraw/zinc/62/90/15/1122629015.db2.gz YJJBZAIHPGHNBP-INIZCTEOSA-N 1 0 285.387 3.820 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)CSC)c1cc(Cl)ccc1O ZINC000775508611 1122629843 /nfs/dbraw/zinc/62/98/43/1122629843.db2.gz DNOAAHOFQUQIDA-BXKDBHETSA-N 1 0 273.829 3.838 20 10 CHCDRO CC[C@@H](C)[C@](C)(O)C[NH2+][C@@H](CC)c1cc(Cl)ccc1O ZINC000775503606 1122630810 /nfs/dbraw/zinc/63/08/10/1122630810.db2.gz KSEDVZKPZXCNHT-DIOULYMOSA-N 1 0 299.842 3.883 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@]1(C)CCOC1)c1cc(Cl)ccc1O ZINC000775503168 1122630985 /nfs/dbraw/zinc/63/09/85/1122630985.db2.gz CTMBRQHLBZTILS-UKRRQHHQSA-N 1 0 283.799 3.513 20 10 CHCDRO CC[C@@H]([NH2+]CC[C@H](C)OC)c1cc(Cl)ccc1O ZINC000775502530 1122631316 /nfs/dbraw/zinc/63/13/16/1122631316.db2.gz XGOQMAQCLLBVEV-GXFFZTMASA-N 1 0 271.788 3.511 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](O)CC(C)(C)C)c1cc(Cl)ccc1O ZINC000775507883 1122632133 /nfs/dbraw/zinc/63/21/33/1122632133.db2.gz OVXBOKSZZZUDPO-OCCSQVGLSA-N 1 0 299.842 3.883 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(F)cn1)c1cc(Cl)ccc1O ZINC000775513404 1122632309 /nfs/dbraw/zinc/63/23/09/1122632309.db2.gz IDPVAQQODGDXKY-CQSZACIVSA-N 1 0 294.757 3.821 20 10 CHCDRO CCc1cc(C[NH2+][C@H](CC)c2cc(Cl)ccc2O)on1 ZINC000775509203 1122632568 /nfs/dbraw/zinc/63/25/68/1122632568.db2.gz JBUVQHAWIHCCTQ-CQSZACIVSA-N 1 0 294.782 3.837 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccn(C)c1)c1cc(Cl)ccc1O ZINC000775513380 1122632857 /nfs/dbraw/zinc/63/28/57/1122632857.db2.gz YXRRLHRIKMLKGE-CQSZACIVSA-N 1 0 278.783 3.625 20 10 CHCDRO CC[C@H]([NH2+]CCN1CCC[C@H]1C)c1cc(Cl)ccc1O ZINC000775509464 1122633094 /nfs/dbraw/zinc/63/30/94/1122633094.db2.gz STDVXJOOFSFBTI-DOMZBBRYSA-N 1 0 296.842 3.571 20 10 CHCDRO CCC[C@H](CCO)C[NH2+][C@H](CC)c1cc(Cl)ccc1O ZINC000775512472 1122634320 /nfs/dbraw/zinc/63/43/20/1122634320.db2.gz LCWMVIJJNSLKJJ-IUODEOHRSA-N 1 0 299.842 3.885 20 10 CHCDRO Cc1cc(C[N@H+]2CC[C@@H](C)[C@@H](C)C2)ccc1N(C)C ZINC001192261694 1122636667 /nfs/dbraw/zinc/63/66/67/1122636667.db2.gz FYJMTLGRARWPNT-HIFRSBDPSA-N 1 0 260.425 3.539 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(OC)cc1C)c1ccccc1O ZINC000775522452 1122639698 /nfs/dbraw/zinc/63/96/98/1122639698.db2.gz PSBNUMCNEJEHTR-QGZVFWFLSA-N 1 0 285.387 3.950 20 10 CHCDRO CC[C@H]([NH2+][C@@H](CO)c1sccc1C)c1ccccc1O ZINC000775524496 1122642617 /nfs/dbraw/zinc/64/26/17/1122642617.db2.gz APNUEOUFYRDOHK-KBPBESRZSA-N 1 0 291.416 3.536 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CC[C@H](C(C)(C)C)C2)cc1 ZINC001192481862 1122649479 /nfs/dbraw/zinc/64/94/79/1122649479.db2.gz QXPOPQQWZZCIBO-HNNXBMFYSA-N 1 0 260.425 3.621 20 10 CHCDRO COC1(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)CCCCC1 ZINC000775562039 1122670645 /nfs/dbraw/zinc/67/06/45/1122670645.db2.gz ATAYHOYVRGCMJU-OAHLLOKOSA-N 1 0 290.451 3.753 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCc2cc(F)ccc2C1)c1ccccc1O ZINC001168407187 1122733436 /nfs/dbraw/zinc/73/34/36/1122733436.db2.gz NAFJPCSGNKHPBN-BLLLJJGKSA-N 1 0 285.362 3.739 20 10 CHCDRO Cc1cc2cc(C[NH2+][C@H]3CCc4cccc(O)c43)ccc2[nH]1 ZINC000297309295 1122793629 /nfs/dbraw/zinc/79/36/29/1122793629.db2.gz MTEJWVYXPNJTHJ-KRWDZBQOSA-N 1 0 292.382 3.959 20 10 CHCDRO Cc1cccc(C[N@H+](C)CCOc2ccccc2C)c1O ZINC000775647391 1122854186 /nfs/dbraw/zinc/85/41/86/1122854186.db2.gz UEPSIGDGYURUMG-UHFFFAOYSA-N 1 0 285.387 3.520 20 10 CHCDRO Cc1ccc(C[N@H+](Cc2cccc(C)c2O)C2CC2)o1 ZINC000775648285 1122856412 /nfs/dbraw/zinc/85/64/12/1122856412.db2.gz CVTXXHFYHJFASF-UHFFFAOYSA-N 1 0 271.360 3.767 20 10 CHCDRO Cc1cccc(C[N@@H+]2CC[C@H](Cc3ccccc3)C2)c1O ZINC000775651858 1122867641 /nfs/dbraw/zinc/86/76/41/1122867641.db2.gz RCLNXTIVMKMFSV-QGZVFWFLSA-N 1 0 281.399 3.765 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+](C)[C@@H](C)C(C)C)c1O ZINC000775652513 1122868943 /nfs/dbraw/zinc/86/89/43/1122868943.db2.gz MGSFZNURFKTNIZ-NSHDSACASA-N 1 0 255.789 3.830 20 10 CHCDRO CC[N@H+](Cc1ccoc1)Cc1cc(Cl)cc(C)c1O ZINC000775674497 1122893246 /nfs/dbraw/zinc/89/32/46/1122893246.db2.gz FGKOJAMQDLPMAO-UHFFFAOYSA-N 1 0 279.767 3.969 20 10 CHCDRO CCOc1ccc(N(CC)CCC[C@H]2CCOC2)cc1 ZINC001167982980 1122902472 /nfs/dbraw/zinc/90/24/72/1122902472.db2.gz IERQRFATLAQJFY-HNNXBMFYSA-N 1 0 277.408 3.728 20 10 CHCDRO COc1cc(C)cc(C[N@H+](C)C2CCC(F)(F)CC2)c1O ZINC000894784189 1122905811 /nfs/dbraw/zinc/90/58/11/1122905811.db2.gz HLOYUFLQVGMQFE-UHFFFAOYSA-N 1 0 299.361 3.719 20 10 CHCDRO CCN(C)c1ccc(C[NH+](CC2CC2)CC2CC2)cc1 ZINC001196263335 1122914247 /nfs/dbraw/zinc/91/42/47/1122914247.db2.gz ONJIHQUYFZBQAI-UHFFFAOYSA-N 1 0 272.436 3.765 20 10 CHCDRO Cc1cc(Br)cc(C[N@H+](C)CCC2CC2)c1O ZINC000775738738 1122930367 /nfs/dbraw/zinc/93/03/67/1122930367.db2.gz ITSSELKIFSIQIA-UHFFFAOYSA-N 1 0 298.224 3.695 20 10 CHCDRO C[C@@H](C[NH2+]Cc1ccc2c(c1)CCO2)Cc1ccccc1 ZINC000775954940 1123028676 /nfs/dbraw/zinc/02/86/76/1123028676.db2.gz XWIGNZVQEYRSMG-OAHLLOKOSA-N 1 0 281.399 3.590 20 10 CHCDRO C[C@H](CO)C[N@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000776002602 1123035639 /nfs/dbraw/zinc/03/56/39/1123035639.db2.gz GGWQZZKIGGHXHD-HOTGVXAUSA-N 1 0 299.414 3.584 20 10 CHCDRO Cc1cccc(C[NH2+]Cc2ccc([C@@H]3C[C@@H]3C)o2)c1O ZINC000776024911 1123041104 /nfs/dbraw/zinc/04/11/04/1123041104.db2.gz ZVDBXACNYQXJJY-SWLSCSKDSA-N 1 0 271.360 3.707 20 10 CHCDRO COc1ccc(O)c(C[NH2+]C(C)(C)Cc2ccccc2C)c1 ZINC000776173630 1123101670 /nfs/dbraw/zinc/10/16/70/1123101670.db2.gz ASAIVYFQSPYMNF-UHFFFAOYSA-N 1 0 299.414 3.820 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+][C@@H]1C[C@@H]1Cc1ccccc1 ZINC000776177307 1123102504 /nfs/dbraw/zinc/10/25/04/1123102504.db2.gz MJXVLHXGUCSQCG-XJKSGUPXSA-N 1 0 287.790 3.766 20 10 CHCDRO COc1ccc(O)c(C[NH2+]C[C@@H](C)c2ccc(C)cc2)c1 ZINC000776208661 1123148383 /nfs/dbraw/zinc/14/83/83/1123148383.db2.gz JBGJNJXZMISSIC-CQSZACIVSA-N 1 0 285.387 3.603 20 10 CHCDRO Oc1ccccc1C[NH2+][C@@H](c1cccs1)C1CC1 ZINC000134225850 1123157258 /nfs/dbraw/zinc/15/72/58/1123157258.db2.gz WQBCPDNHGMVDTL-OAHLLOKOSA-N 1 0 259.374 3.695 20 10 CHCDRO CCOCc1cc(C[NH2+]CCC2CCC2)ccc1OC ZINC000776251572 1123179679 /nfs/dbraw/zinc/17/96/79/1123179679.db2.gz MNJZIUJJSLHOML-UHFFFAOYSA-N 1 0 277.408 3.512 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CC23CCCC3)c(O)c1C ZINC000760040839 1123181218 /nfs/dbraw/zinc/18/12/18/1123181218.db2.gz LUMGYWUOOIJEES-ZFWWWQNUSA-N 1 0 259.393 3.992 20 10 CHCDRO C[C@@H]1CC[C@@H](C[NH2+]C/C=C\c2ccc(N(C)C)cc2)C1 ZINC001202249940 1123190236 /nfs/dbraw/zinc/19/02/36/1123190236.db2.gz BWLKLEJOTYDSHP-XQJUWPJRSA-N 1 0 272.436 3.792 20 10 CHCDRO CC[N@H+](CCCC(F)(F)F)Cc1ccc(N(C)C)cc1 ZINC001202443246 1123209390 /nfs/dbraw/zinc/20/93/90/1123209390.db2.gz PQFUSLRKGPERFA-UHFFFAOYSA-N 1 0 288.357 3.917 20 10 CHCDRO COc1cccc(C[NH2+][C@@H]2CCC(C)(C)C[C@H]2C)c1O ZINC000237232014 1123220540 /nfs/dbraw/zinc/22/05/40/1123220540.db2.gz KGUVDIXXZDKDQG-TZMCWYRMSA-N 1 0 277.408 3.705 20 10 CHCDRO COc1cc(C[NH2+][C@H](C)CSC)c(O)c(C(C)(C)C)c1 ZINC000850145990 1123244129 /nfs/dbraw/zinc/24/41/29/1123244129.db2.gz QUOMKEJYKHBCCM-LLVKDONJSA-N 1 0 297.464 3.539 20 10 CHCDRO C[C@H](C[NH2+]C/C=C/c1ccc(N(C)C)cc1)c1ccccn1 ZINC000850342298 1123254628 /nfs/dbraw/zinc/25/46/28/1123254628.db2.gz KPLTVXCSSJGUKU-FYCOFBDGSA-N 1 0 295.430 3.554 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H]2CCc3ccccc32)cc1C ZINC000850373343 1123259101 /nfs/dbraw/zinc/25/91/01/1123259101.db2.gz JZEGNOAOMIUARN-QGZVFWFLSA-N 1 0 267.372 3.786 20 10 CHCDRO Oc1ccc(-c2ccccc2)cc1C[NH2+][C@H]1[C@@H]2CCC[C@@H]21 ZINC000850393604 1123261614 /nfs/dbraw/zinc/26/16/14/1123261614.db2.gz VEISYUCXNUUKRZ-DZFIZOCASA-N 1 0 279.383 3.947 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccccc1O)c1ccc2c(c1)CCCO2 ZINC000850429475 1123266421 /nfs/dbraw/zinc/26/64/21/1123266421.db2.gz FCKZSNPWJRBTOP-CYBMUJFWSA-N 1 0 283.371 3.568 20 10 CHCDRO COC1CC(CC[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)C1 ZINC000850483478 1123274621 /nfs/dbraw/zinc/27/46/21/1123274621.db2.gz XXYSFEZUTVESFI-DCBWTQNWSA-N 1 0 297.826 3.820 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCN(C(C)(C)C)C1)c1cc(Cl)ccc1O ZINC000850494849 1123275278 /nfs/dbraw/zinc/27/52/78/1123275278.db2.gz SXTPXMFCOHXCHT-WCQYABFASA-N 1 0 296.842 3.569 20 10 CHCDRO CCC(C)(C)[C@H](C)[NH2+][C@@H](C)c1cccc(OC)c1O ZINC000850502145 1123276435 /nfs/dbraw/zinc/27/64/35/1123276435.db2.gz MJCXWRHAKJBFPE-RYUDHWBXSA-N 1 0 265.397 3.876 20 10 CHCDRO Cc1cc(Br)cc([C@H](C)[NH2+][C@@H]2C=CCC2)c1O ZINC000850510675 1123278337 /nfs/dbraw/zinc/27/83/37/1123278337.db2.gz WEXZPLARJXEVSE-CMPLNLGQSA-N 1 0 296.208 3.832 20 10 CHCDRO CC[C@@H]([NH2+]CCC(C)(C)F)c1ccc(C)cc1O ZINC000850531609 1123285282 /nfs/dbraw/zinc/28/52/82/1123285282.db2.gz LCGIUZZKINNIFR-CYBMUJFWSA-N 1 0 253.361 3.880 20 10 CHCDRO CC[C@H]([NH2+][C@H]1C[C@H](O)c2ccccc21)c1ccc(C)cc1O ZINC000850530585 1123285313 /nfs/dbraw/zinc/28/53/13/1123285313.db2.gz ZZQQAKACHAVTQC-LNLFQRSKSA-N 1 0 297.398 3.920 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+][C@H](C)C(C)(C)C)c1O ZINC000169087091 1123286835 /nfs/dbraw/zinc/28/68/35/1123286835.db2.gz GNXUUFDIJFXBBE-SECBINFHSA-N 1 0 271.788 3.578 20 10 CHCDRO C[C@@H]([NH2+]CC[C@]1(C)CC1(F)F)c1ccc(N(C)C)cc1 ZINC000850536199 1123287333 /nfs/dbraw/zinc/28/73/33/1123287333.db2.gz IHERMYBWGKMFNN-IUODEOHRSA-N 1 0 282.378 3.839 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCC[C@@H](C)O1)c1cc(Cl)ccc1O ZINC000850535312 1123287414 /nfs/dbraw/zinc/28/74/14/1123287414.db2.gz UWDPDLVNEVRBLC-NTZNESFSSA-N 1 0 283.799 3.654 20 10 CHCDRO C[C@H]([NH2+]C[C@@H](CO)CC1CC1)c1ccc2ccccc2c1O ZINC000850544943 1123289076 /nfs/dbraw/zinc/28/90/76/1123289076.db2.gz KRSZEYYESRKFOK-ZFWWWQNUSA-N 1 0 299.414 3.605 20 10 CHCDRO C[C@@H]1C[C@@H]([NH2+]C[C@@H]2C(C)(C)C2(F)F)c2c1c(F)ccc2O ZINC000850552671 1123289785 /nfs/dbraw/zinc/28/97/85/1123289785.db2.gz PJDRAUJCGFZEMJ-HLUHBDAQSA-N 1 0 299.336 3.961 20 10 CHCDRO CCSC1(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)CC1 ZINC000850551792 1123289806 /nfs/dbraw/zinc/28/98/06/1123289806.db2.gz JVIXSFMTDPHUPN-CYBMUJFWSA-N 1 0 279.449 3.945 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2C(C)(C)C2(F)F)c(O)c1C ZINC000850553650 1123290078 /nfs/dbraw/zinc/29/00/78/1123290078.db2.gz ZXVTWRPJMSVAST-WCQYABFASA-N 1 0 283.362 3.951 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CCC2SCCS2)c(O)c1 ZINC000850569275 1123293659 /nfs/dbraw/zinc/29/36/59/1123293659.db2.gz YZRNIFSFFLXITF-GFCCVEGCSA-N 1 0 297.489 3.856 20 10 CHCDRO CC[C@@H]([NH2+]CCCc1ccco1)c1ccc(C)cc1O ZINC000850570284 1123294331 /nfs/dbraw/zinc/29/43/31/1123294331.db2.gz TYHFSFAJRLKMIA-MRXNPFEDSA-N 1 0 273.376 3.967 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCOC1(C)C)c1ccc(N(C)C)cc1 ZINC000850570331 1123294561 /nfs/dbraw/zinc/29/45/61/1123294561.db2.gz GADXEFLGULFTAY-WBVHZDCISA-N 1 0 290.451 3.608 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H](O)[C@@H](C)c2ccccc2)c1 ZINC000850572767 1123295036 /nfs/dbraw/zinc/29/50/36/1123295036.db2.gz GEIZFIHDVANASM-DOXZYTNZSA-N 1 0 299.414 3.516 20 10 CHCDRO COc1cccc(C[NH2+][C@@H](C)c2ccc(C)cc2O)c1C ZINC000850578320 1123296300 /nfs/dbraw/zinc/29/63/00/1123296300.db2.gz KOVDRMXISSKIBW-AWEZNQCLSA-N 1 0 285.387 3.868 20 10 CHCDRO CC(C)Oc1cccc(C[N@H+](C)Cc2ccccc2O)c1 ZINC000109771982 1123326313 /nfs/dbraw/zinc/32/63/13/1123326313.db2.gz SZWPTPGEUONHBO-UHFFFAOYSA-N 1 0 285.387 3.811 20 10 CHCDRO CC(C)Oc1ccccc1C[N@H+](C)Cc1ccccc1O ZINC000109772042 1123326488 /nfs/dbraw/zinc/32/64/88/1123326488.db2.gz AKSIFAJNSJYBNY-UHFFFAOYSA-N 1 0 285.387 3.811 20 10 CHCDRO CC[C@@H]1C[N@H+](C/C=C\c2ccc(N(C)C)cc2)CCS1 ZINC001204769371 1123424960 /nfs/dbraw/zinc/42/49/60/1123424960.db2.gz SZRHVJWAALEWMG-KEGWNNHHSA-N 1 0 290.476 3.593 20 10 CHCDRO C[N@H+](Cc1ccccc1O)[C@H]1CCCc2ccccc21 ZINC000111235619 1123432388 /nfs/dbraw/zinc/43/23/88/1123432388.db2.gz PAPFUWNUIVRQLZ-KRWDZBQOSA-N 1 0 267.372 3.902 20 10 CHCDRO CC[C@@H]([NH2+]CCOC1CCCCC1)c1ccccc1O ZINC000111636073 1123457694 /nfs/dbraw/zinc/45/76/94/1123457694.db2.gz DCRDBMHKFMPCDL-MRXNPFEDSA-N 1 0 277.408 3.782 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCc3cc(N)ccc32)c1 ZINC000854225723 1123478023 /nfs/dbraw/zinc/47/80/23/1123478023.db2.gz JTVKXMWAAJGYNC-SJKOYZFVSA-N 1 0 282.387 3.621 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCc3cc(N)ccc32)c(O)c1C ZINC000854226133 1123478259 /nfs/dbraw/zinc/47/82/59/1123478259.db2.gz OMRMZVDFRFTSEU-FZKQIMNGSA-N 1 0 296.414 3.929 20 10 CHCDRO CCc1cnccc1[C@H](C)[NH2+][C@H](C)c1ccccc1O ZINC000783526223 1123493365 /nfs/dbraw/zinc/49/33/65/1123493365.db2.gz UQKDSLNOPYZTCO-QWHCGFSZSA-N 1 0 270.376 3.761 20 10 CHCDRO COC[C@@H]1CCC[N@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000112961946 1123506012 /nfs/dbraw/zinc/50/60/12/1123506012.db2.gz FTIAOWRGOVHDOP-OAHLLOKOSA-N 1 0 291.435 3.682 20 10 CHCDRO Cc1ccc(C[NH2+]C[C@]2(C)CCOC3(CCC3)C2)c(O)c1 ZINC000895824428 1123518932 /nfs/dbraw/zinc/51/89/32/1123518932.db2.gz YVGRBCWSEPQAFE-QGZVFWFLSA-N 1 0 289.419 3.530 20 10 CHCDRO CCCOc1cccc(C[NH2+]Cc2cc(C)ccc2O)c1 ZINC000113324009 1123521596 /nfs/dbraw/zinc/52/15/96/1123521596.db2.gz WPKOPLXRLRHLLN-UHFFFAOYSA-N 1 0 285.387 3.779 20 10 CHCDRO CCC[N@@H+](Cc1ccccc1O)C[C@@H]1CCO[C@@H](CC)C1 ZINC000780758818 1123544433 /nfs/dbraw/zinc/54/44/33/1123544433.db2.gz WTEZANFHGIOTLU-WBVHZDCISA-N 1 0 291.435 3.809 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)Cc2ccnc(C)c2)cc1 ZINC000856720108 1123566274 /nfs/dbraw/zinc/56/62/74/1123566274.db2.gz XLNWEZCKLCFPFN-UHFFFAOYSA-N 1 0 297.446 3.868 20 10 CHCDRO Cc1cc(F)ccc1[C@H](C)[NH2+]Cc1cc(F)ccc1O ZINC000896804358 1123626684 /nfs/dbraw/zinc/62/66/84/1123626684.db2.gz UULPFMQEHIELFJ-NSHDSACASA-N 1 0 277.314 3.830 20 10 CHCDRO C[N@H+](Cc1cc(C(C)(C)C)cc(O)c1O)C1CCCC1 ZINC000194570473 1129135480 /nfs/dbraw/zinc/13/54/80/1129135480.db2.gz BBWUGFRMDCDJQB-UHFFFAOYSA-N 1 0 277.408 3.770 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1Cc2ccccc2CO1)c1ccccc1O ZINC000858452527 1123655377 /nfs/dbraw/zinc/65/53/77/1123655377.db2.gz FHJPMVOPZNTLSV-FUHWJXTLSA-N 1 0 297.398 3.574 20 10 CHCDRO C/C=C/C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000858538412 1123660740 /nfs/dbraw/zinc/66/07/40/1123660740.db2.gz WADSLIYJIOBIBC-NHZBNJEXSA-N 1 0 258.409 3.904 20 10 CHCDRO C/C=C\C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000858538406 1123660871 /nfs/dbraw/zinc/66/08/71/1123660871.db2.gz WADSLIYJIOBIBC-ABCZVMIZSA-N 1 0 258.409 3.904 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CCCC(F)(F)CC2)cc1 ZINC000859537924 1123701160 /nfs/dbraw/zinc/70/11/60/1123701160.db2.gz SGQZESLCUHRJMX-UHFFFAOYSA-N 1 0 282.378 3.764 20 10 CHCDRO Cc1cc(Cl)nc(C[NH2+][C@H](C)c2ccccc2O)c1 ZINC000281930957 1123750784 /nfs/dbraw/zinc/75/07/84/1123750784.db2.gz AYFWZUMPNMOUJJ-LLVKDONJSA-N 1 0 276.767 3.600 20 10 CHCDRO Cc1cccc(O)c1C[NH2+][C@@H]1CCSC2(CCC2)C1 ZINC000896952170 1123792790 /nfs/dbraw/zinc/79/27/90/1123792790.db2.gz VCBCXNJZKVCBTE-CYBMUJFWSA-N 1 0 277.433 3.609 20 10 CHCDRO CCCN(C[C@]1(C)CCCS1)c1ccc(C[NH3+])cc1 ZINC000862347654 1123800935 /nfs/dbraw/zinc/80/09/35/1123800935.db2.gz KAMCHQFLONWSCV-INIZCTEOSA-N 1 0 278.465 3.647 20 10 CHCDRO CCc1cccc(C[NH+]2C[C@@H](C)C(F)(F)[C@H](C)C2)c1O ZINC000862442060 1123810119 /nfs/dbraw/zinc/81/01/19/1123810119.db2.gz GHLGZYRQWFVKFG-VXGBXAGGSA-N 1 0 283.362 3.678 20 10 CHCDRO CCc1cccc(C[NH2+]CC(C)(C)c2ccc(C)cn2)c1O ZINC000862481636 1123812589 /nfs/dbraw/zinc/81/25/89/1123812589.db2.gz ZJCQGUBTUCAFRN-UHFFFAOYSA-N 1 0 298.430 3.725 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H](C)CSC(C)(C)C)c1 ZINC000862476398 1123812913 /nfs/dbraw/zinc/81/29/13/1123812913.db2.gz SEDNEXWGKLUNFZ-GFCCVEGCSA-N 1 0 267.438 3.710 20 10 CHCDRO Oc1cccc(Cl)c1C[NH+]1CC(Cc2cccs2)C1 ZINC000862537337 1123816798 /nfs/dbraw/zinc/81/67/98/1123816798.db2.gz AUKUNPOAJGVWEF-UHFFFAOYSA-N 1 0 293.819 3.782 20 10 CHCDRO C[C@@H]1CC2(CCC2)C[N@@H+]1Cc1ccc(N(C)C)cc1 ZINC000763645023 1129148675 /nfs/dbraw/zinc/14/86/75/1129148675.db2.gz DDXOEBBDALWQIF-CQSZACIVSA-N 1 0 258.409 3.517 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CS[C@H](C)C2)c(O)c1C ZINC000840859781 1123860845 /nfs/dbraw/zinc/86/08/45/1123860845.db2.gz MGJMGOPQGDKAGG-WXHSDQCUSA-N 1 0 265.422 3.554 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@](C)(O)CC2)cc1C(C)C ZINC000794664286 1123923497 /nfs/dbraw/zinc/92/34/97/1123923497.db2.gz CJGPPGQYZRSFJR-GOSISDBHSA-N 1 0 291.435 3.561 20 10 CHCDRO COc1cc(C)cc(C[N@H+](C)[C@H]2CCC(C)(C)C2)c1O ZINC000794684945 1123927495 /nfs/dbraw/zinc/92/74/95/1123927495.db2.gz KKWHZTJELVSDSQ-AWEZNQCLSA-N 1 0 277.408 3.720 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1Cc2ccccc2O1)c1ccc(C)cc1O ZINC000794793528 1123950263 /nfs/dbraw/zinc/95/02/63/1123950263.db2.gz OWPGJYWEWYFRHD-WBVHZDCISA-N 1 0 297.398 3.745 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CC)c1ccc(C)cc1O)C1CCOCC1 ZINC000794805613 1123955658 /nfs/dbraw/zinc/95/56/58/1123955658.db2.gz XWHSDGDQYFVWKB-SJORKVTESA-N 1 0 291.435 3.947 20 10 CHCDRO CC[C@@H]([NH2+]CCOCC1CCC1)c1ccc(C)cc1O ZINC000794812708 1123957429 /nfs/dbraw/zinc/95/74/29/1123957429.db2.gz FCWKVIQAKDTFHP-MRXNPFEDSA-N 1 0 277.408 3.558 20 10 CHCDRO CC[C@@H]([NH2+]CC1([C@H](O)C(C)C)CC1)c1ccc(C)cc1O ZINC000794817107 1123959767 /nfs/dbraw/zinc/95/97/67/1123959767.db2.gz MYHXOYXZTZMCPZ-NVXWUHKLSA-N 1 0 291.435 3.538 20 10 CHCDRO COC1([C@@H](C)[NH2+][C@H](C)c2ccc(C)c(C)c2O)CCC1 ZINC000840884670 1123995216 /nfs/dbraw/zinc/99/52/16/1123995216.db2.gz ONEABDYFJSHKQR-ZIAGYGMSSA-N 1 0 277.408 3.617 20 10 CHCDRO CC(C)(C)OC1CCC([NH2+]Cc2ccccc2O)CC1 ZINC000865697839 1124005933 /nfs/dbraw/zinc/00/59/33/1124005933.db2.gz GAASVRPAOBRLAR-UHFFFAOYSA-N 1 0 277.408 3.608 20 10 CHCDRO C[C@@H]1C[C@@H]([NH2+]Cc2ccc3ccccc3c2O)CS1 ZINC000840958942 1124041497 /nfs/dbraw/zinc/04/14/97/1124041497.db2.gz POTYWRHVJNRHKI-BXUZGUMPSA-N 1 0 273.401 3.529 20 10 CHCDRO CC(C)C[NH2+][C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000121066944 1124066151 /nfs/dbraw/zinc/06/61/51/1124066151.db2.gz QSUUXWKXCCGONR-ZDUSSCGKSA-N 1 0 298.377 3.502 20 10 CHCDRO Cc1ncc([C@H](C)[NH2+][C@H](C)c2cc(C)ccc2O)s1 ZINC000866455696 1124067898 /nfs/dbraw/zinc/06/78/98/1124067898.db2.gz OSXLWHWPFACPCH-MNOVXSKESA-N 1 0 276.405 3.877 20 10 CHCDRO Cc1ncc([C@H](C)[NH2+][C@@H](C)c2cc(C)ccc2O)s1 ZINC000866455698 1124068336 /nfs/dbraw/zinc/06/83/36/1124068336.db2.gz OSXLWHWPFACPCH-QWRGUYRKSA-N 1 0 276.405 3.877 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)o1 ZINC000866477535 1124070212 /nfs/dbraw/zinc/07/02/12/1124070212.db2.gz BAXUBSYRJCUZJZ-CYBMUJFWSA-N 1 0 259.349 3.761 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2cccc3c2CCOC3)c1 ZINC000866478726 1124070290 /nfs/dbraw/zinc/07/02/90/1124070290.db2.gz KOVWWSQDDUPOHA-AWEZNQCLSA-N 1 0 297.398 3.624 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)o1 ZINC000866478939 1124071250 /nfs/dbraw/zinc/07/12/50/1124071250.db2.gz OGBNWAKFPZWBOJ-ZDUSSCGKSA-N 1 0 259.349 3.761 20 10 CHCDRO CS[C@H]1C[C@H]([NH2+][C@H](C)c2ccc(C)c(C)c2O)C1 ZINC000866488845 1124072811 /nfs/dbraw/zinc/07/28/11/1124072811.db2.gz VQZYTWLBOGKVRQ-JHJVBQTASA-N 1 0 265.422 3.554 20 10 CHCDRO C[C@H]([NH2+][C@H](C1CCC1)[C@H]1CCCO1)c1cc(F)ccc1O ZINC000866491475 1124072828 /nfs/dbraw/zinc/07/28/28/1124072828.db2.gz RWQGTOCNMZXTJZ-YMRXKLBXSA-N 1 0 293.382 3.530 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCC12CCOCC2)c1ccccc1O ZINC000866528950 1124078238 /nfs/dbraw/zinc/07/82/38/1124078238.db2.gz KVBGSSJPSRJZDH-ZBFHGGJFSA-N 1 0 289.419 3.640 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H](C)c2ccccc2O)c1 ZINC000037679356 1129165210 /nfs/dbraw/zinc/16/52/10/1129165210.db2.gz PPGIWFGXJCJIHO-ZDUSSCGKSA-N 1 0 271.360 3.642 20 10 CHCDRO C[C@@H]([NH2+][C@@H](CF)c1ccc(F)cc1)c1ccccc1O ZINC000866597210 1124086268 /nfs/dbraw/zinc/08/62/68/1124086268.db2.gz ZDVBBEOXCJWVFN-ABAIWWIYSA-N 1 0 277.314 3.893 20 10 CHCDRO COc1ccc2ccc(O)c(C[N@@H+]3CCC4(CCC4)C3)c2c1 ZINC000121863788 1124104044 /nfs/dbraw/zinc/10/40/44/1124104044.db2.gz GFGAHSLHVACPGF-UHFFFAOYSA-N 1 0 297.398 3.930 20 10 CHCDRO CC(C)[N@H+](CCOC1CCC1)Cc1ccc(N(C)C)cc1 ZINC000805732258 1131260012 /nfs/dbraw/zinc/26/00/12/1131260012.db2.gz FLHOBXQNZCROGF-UHFFFAOYSA-N 1 0 290.451 3.532 20 10 CHCDRO CN(C)c1ccc(C2=CCC[NH2+]CC2)c(C(F)(F)F)c1 ZINC001238941719 1131274767 /nfs/dbraw/zinc/27/47/67/1131274767.db2.gz SEAAASIYMPNKRL-UHFFFAOYSA-N 1 0 284.325 3.538 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H]2C[C@H](c3cccc(F)c3)C2)cc1 ZINC000797880049 1124616804 /nfs/dbraw/zinc/61/68/04/1124616804.db2.gz NVRWQZGVRINUCE-SAABIXHNSA-N 1 0 298.405 3.928 20 10 CHCDRO Cc1nc(C)c([C@@H](C)[N@H+](C)Cc2ccc(N)cc2)s1 ZINC001120263178 1131273612 /nfs/dbraw/zinc/27/36/12/1131273612.db2.gz LMCVIQYCFDRSCH-LLVKDONJSA-N 1 0 275.421 3.535 20 10 CHCDRO Nc1ccc(C[NH2+]C2(c3ccc(F)cc3F)CCC2)cc1 ZINC001120370609 1131275132 /nfs/dbraw/zinc/27/51/32/1131275132.db2.gz CABPGDACEXBRQO-UHFFFAOYSA-N 1 0 288.341 3.716 20 10 CHCDRO COCC(C)(C)CC[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000872104719 1124682749 /nfs/dbraw/zinc/68/27/49/1124682749.db2.gz NWSRJQYSERHVQO-AWEZNQCLSA-N 1 0 279.424 3.722 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1cc(C)ccc1O)[C@@H](O)c1ccccc1 ZINC000872132214 1124691400 /nfs/dbraw/zinc/69/14/00/1124691400.db2.gz FLSGKQANULUTBT-LJHODMEESA-N 1 0 299.414 3.863 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+]1CCC[C@H](OC2CCC2)CC1 ZINC000872259635 1124699555 /nfs/dbraw/zinc/69/95/55/1124699555.db2.gz ZLCPRBVJJWNQQC-INIZCTEOSA-N 1 0 289.419 3.624 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]CC[C@@H]1CNc3ccccc31)CC2 ZINC000873238273 1124754406 /nfs/dbraw/zinc/75/44/06/1124754406.db2.gz YWYXDRDEDIKEOW-RHSMWYFYSA-N 1 0 294.398 3.569 20 10 CHCDRO CNc1ccc(Nc2ccc([C@@H]3CCC[NH2+]3)cc2)cc1 ZINC001159827789 1131294877 /nfs/dbraw/zinc/29/48/77/1131294877.db2.gz WDHFSRJKAGQRNO-KRWDZBQOSA-N 1 0 267.376 3.896 20 10 CHCDRO CCCC[N@H+](CCOC1CCC1)Cc1ccccc1O ZINC000805756215 1131309457 /nfs/dbraw/zinc/30/94/57/1131309457.db2.gz VKXDPNCBMXDYEN-UHFFFAOYSA-N 1 0 277.408 3.563 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)CC2CCOCC2)cc1C(C)C ZINC000124649319 1124804085 /nfs/dbraw/zinc/80/40/85/1124804085.db2.gz RXENWNYPBQVVKY-UHFFFAOYSA-N 1 0 291.435 3.682 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)CCc2ccco2)c(O)c1 ZINC000020145202 1124808750 /nfs/dbraw/zinc/80/87/50/1124808750.db2.gz FKCDXODLXFUTFN-KBPBESRZSA-N 1 0 273.376 3.966 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]C[C@@H](C)C(C)(C)C)c1 ZINC000125100254 1124848436 /nfs/dbraw/zinc/84/84/36/1124848436.db2.gz ZRYILRLNAAKVPF-NEPJUHHUSA-N 1 0 265.397 3.734 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCc2cccc(F)c2C1)c1ccccc1O ZINC001170956514 1131314207 /nfs/dbraw/zinc/31/42/07/1131314207.db2.gz XEZQHNPLHODIAC-TZMCWYRMSA-N 1 0 285.362 3.739 20 10 CHCDRO Cc1cc(O)c(C[NH+]2CCC(F)(F)CC2)cc1Cl ZINC000825749582 1124855599 /nfs/dbraw/zinc/85/55/99/1124855599.db2.gz VGIALUMOAGSINL-UHFFFAOYSA-N 1 0 275.726 3.585 20 10 CHCDRO CCC(CC)[C@@H](C[NH2+][C@H](CC)c1ccccc1O)N(C)C ZINC000021036370 1124893092 /nfs/dbraw/zinc/89/30/92/1124893092.db2.gz WHNCVMAIPKREHR-IAGOWNOFSA-N 1 0 292.467 3.799 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+](Cc1ccccn1)C(C)C ZINC000876624414 1124967007 /nfs/dbraw/zinc/96/70/07/1124967007.db2.gz LWQKSANCHUIIDP-UHFFFAOYSA-N 1 0 270.376 3.506 20 10 CHCDRO Cc1ccc(C[NH+]2CCC(OC3CCCC3)CC2)c(O)c1 ZINC000876660617 1124968946 /nfs/dbraw/zinc/96/89/46/1124968946.db2.gz WDJQDWUEDRBANR-UHFFFAOYSA-N 1 0 289.419 3.624 20 10 CHCDRO Cc1cccc(O)c1C[NH2+][C@H]1CCCc2ccccc21 ZINC000876884543 1124986538 /nfs/dbraw/zinc/98/65/38/1124986538.db2.gz CNNNMOUKAFHTTQ-KRWDZBQOSA-N 1 0 267.372 3.868 20 10 CHCDRO COc1ccc([C@H](C)[NH2+]Cc2ccc(C)cc2O)cc1F ZINC000876901122 1124988435 /nfs/dbraw/zinc/98/84/35/1124988435.db2.gz ZSMMMYCLARGVAG-LBPRGKRZSA-N 1 0 289.350 3.699 20 10 CHCDRO Cc1ccc(C[NH2+][C@H]2c3ccccc3C[C@@H]2C)c(O)c1 ZINC000877008573 1124996694 /nfs/dbraw/zinc/99/66/94/1124996694.db2.gz NCKFWNWPURTFFI-SCLBCKFNSA-N 1 0 267.372 3.724 20 10 CHCDRO COc1cccc(F)c1[C@H](C)[NH2+]Cc1ccc(C)cc1O ZINC000877041325 1125002527 /nfs/dbraw/zinc/00/25/27/1125002527.db2.gz FJFCHNRDVORHAN-LBPRGKRZSA-N 1 0 289.350 3.699 20 10 CHCDRO CC[C@@](C)([NH2+]Cc1ccc(C)cc1O)c1nccs1 ZINC000877048959 1125004271 /nfs/dbraw/zinc/00/42/71/1125004271.db2.gz QOZQTWKPGMKGSO-OAHLLOKOSA-N 1 0 276.405 3.572 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)c2ccc(F)c(C)c2)c(O)c1 ZINC000877083288 1125006680 /nfs/dbraw/zinc/00/66/80/1125006680.db2.gz LANRXNQMXHIZJK-CYBMUJFWSA-N 1 0 273.351 3.999 20 10 CHCDRO CCC(CC)[C@@H]1C[C@H]([NH2+]Cc2ccc(C)cc2O)CCO1 ZINC000877166460 1125017389 /nfs/dbraw/zinc/01/73/89/1125017389.db2.gz AMKCOMKIADTRMF-AEFFLSMTSA-N 1 0 291.435 3.774 20 10 CHCDRO Cc1ccc(C[NH2+]C(C)(C)c2ccccc2F)c(O)c1 ZINC000877545523 1125043275 /nfs/dbraw/zinc/04/32/75/1125043275.db2.gz HUFUABVUFBHFEI-UHFFFAOYSA-N 1 0 273.351 3.865 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](c2ccccn2)C2CCC2)c(O)c1 ZINC000877652742 1125057929 /nfs/dbraw/zinc/05/79/29/1125057929.db2.gz NHOLPWBMLCELCM-SFHVURJKSA-N 1 0 282.387 3.727 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]CC1([C@H]2CCCCO2)CCC1 ZINC000877697859 1125064070 /nfs/dbraw/zinc/06/40/70/1125064070.db2.gz OKGGLPCTSGIWJB-QGZVFWFLSA-N 1 0 289.419 3.530 20 10 CHCDRO CO[C@@H](c1ccccc1)[C@@H](C)[NH2+][C@H](C)c1ccccc1O ZINC000877757632 1125074466 /nfs/dbraw/zinc/07/44/66/1125074466.db2.gz PBHIDNUGCHXHRW-HBUWYVDXSA-N 1 0 285.387 3.819 20 10 CHCDRO Cc1cc(F)ccc1C[NH2+][C@@H](C)c1ccccc1O ZINC000877757191 1125074532 /nfs/dbraw/zinc/07/45/32/1125074532.db2.gz MVMRNVQAWAWCIT-LBPRGKRZSA-N 1 0 259.324 3.691 20 10 CHCDRO C[C@@H](CSC(C)(C)C)[NH2+][C@@H](C)c1ccccc1O ZINC000877757422 1125075593 /nfs/dbraw/zinc/07/55/93/1125075593.db2.gz ZWHUSXBOVCQUOV-RYUDHWBXSA-N 1 0 267.438 3.963 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CCCC2CCOCC2)cc1Cl ZINC000826029308 1125131197 /nfs/dbraw/zinc/13/11/97/1125131197.db2.gz DDIYKGYGDYILSL-UHFFFAOYSA-N 1 0 297.826 3.650 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCC2(CCC2)O1)c1ccc(N(C)C)cc1 ZINC000878454716 1125155172 /nfs/dbraw/zinc/15/51/72/1125155172.db2.gz GXNYHDJGWSKWLX-WMLDXEAASA-N 1 0 288.435 3.505 20 10 CHCDRO C[C@H]([NH2+]Cc1cccnc1C(F)(F)F)c1ccccc1O ZINC000879649736 1125222686 /nfs/dbraw/zinc/22/26/86/1125222686.db2.gz FNICGEMOVWUYSQ-JTQLQIEISA-N 1 0 296.292 3.657 20 10 CHCDRO CCCc1nc(C[NH2+][C@@H](C)c2ccccc2O)cs1 ZINC000879651938 1125224443 /nfs/dbraw/zinc/22/44/43/1125224443.db2.gz PZTXJJWWKBNOSX-NSHDSACASA-N 1 0 276.405 3.652 20 10 CHCDRO CSc1ccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)o1 ZINC000883092709 1125371187 /nfs/dbraw/zinc/37/11/87/1125371187.db2.gz WUWJAIKOJWYYOI-GFCCVEGCSA-N 1 0 290.432 3.918 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]CC[C@H]2CCCC2(F)F)c1 ZINC000883265583 1125388662 /nfs/dbraw/zinc/38/86/62/1125388662.db2.gz FTNFFIDHDXSQDN-CYBMUJFWSA-N 1 0 299.361 3.706 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCC3(CCC3)O2)c(O)c1C ZINC000883357102 1125401132 /nfs/dbraw/zinc/40/11/32/1125401132.db2.gz CSPCYCLMSYGZGJ-HUUCEWRRSA-N 1 0 289.419 3.761 20 10 CHCDRO CCOc1cccc(C[N@H+](C)C2CCCCC2)c1O ZINC000131745937 1125409708 /nfs/dbraw/zinc/40/97/08/1125409708.db2.gz JYCREZMNDVZKEP-UHFFFAOYSA-N 1 0 263.381 3.555 20 10 CHCDRO Cc1cc(C[N@@H+]2CCC(F)(F)C(C)(C)C2)ccc1N(C)C ZINC001139669611 1131353336 /nfs/dbraw/zinc/35/33/36/1131353336.db2.gz DHTVSOZAHZZLEN-UHFFFAOYSA-N 1 0 296.405 3.928 20 10 CHCDRO C[C@@H](C[NH2+]Cc1ccc(N2CCCCC2)cc1)C1CC1 ZINC000133042310 1125430795 /nfs/dbraw/zinc/43/07/95/1125430795.db2.gz PUWOZMHUQZFWCG-HNNXBMFYSA-N 1 0 272.436 3.813 20 10 CHCDRO Cc1cc(C[N@H+]2CCCC[C@@H](C)C2)ccc1N(C)C ZINC001139670016 1131357897 /nfs/dbraw/zinc/35/78/97/1131357897.db2.gz VJMMVYGTRPCZQI-CQSZACIVSA-N 1 0 260.425 3.683 20 10 CHCDRO CCCCC[N@H+](Cc1cc(OC)ccc1O)C(C)C ZINC000133252951 1125440431 /nfs/dbraw/zinc/44/04/31/1125440431.db2.gz DOIDLIIUTKYTSF-UHFFFAOYSA-N 1 0 265.397 3.801 20 10 CHCDRO C[C@@H](F)CC[NH2+][C@H](C)c1ccc(Br)cc1O ZINC000378855576 1129284482 /nfs/dbraw/zinc/28/44/82/1129284482.db2.gz JZCXVPQEEZEZFO-RKDXNWHRSA-N 1 0 290.176 3.553 20 10 CHCDRO CN(C)c1ccc(C[NH2+]Cc2coc3ccccc23)cc1F ZINC000734003932 1129291211 /nfs/dbraw/zinc/29/12/11/1129291211.db2.gz AZSCAEMDPODJAE-UHFFFAOYSA-N 1 0 298.361 3.928 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ncc(Cl)s1)c1ccccc1O ZINC000719395051 1129332324 /nfs/dbraw/zinc/33/23/24/1129332324.db2.gz OHTKWENUQAZXQA-SNVBAGLBSA-N 1 0 282.796 3.743 20 10 CHCDRO c1ccc2c(c1)CC[C@H](C[NH2+]Cc1ccc3c(c1)CCO3)C2 ZINC000735324669 1129339278 /nfs/dbraw/zinc/33/92/78/1129339278.db2.gz ZXUREISPAOVZLM-HNNXBMFYSA-N 1 0 293.410 3.516 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CSc3ccccc32)cc1C ZINC000735509126 1129348579 /nfs/dbraw/zinc/34/85/79/1129348579.db2.gz VHMCWXYNHYVQCX-OAHLLOKOSA-N 1 0 285.412 3.940 20 10 CHCDRO Cc1occc1C[N@@H+](C)Cc1cc(Cl)ccc1O ZINC000092438600 1129394113 /nfs/dbraw/zinc/39/41/13/1129394113.db2.gz KVGICGLQBMPRNZ-UHFFFAOYSA-N 1 0 265.740 3.579 20 10 CHCDRO COc1cc(C[N@@H+]2CCC=C(c3ccco3)C2)c(O)cc1C ZINC000795652311 1129407332 /nfs/dbraw/zinc/40/73/32/1129407332.db2.gz XHNFWQQSOJZSJY-UHFFFAOYSA-N 1 0 299.370 3.592 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H](C)C2(C)CC2)cc1F ZINC000740004709 1129408814 /nfs/dbraw/zinc/40/88/14/1129408814.db2.gz TXROUFBAYROPLK-CYBMUJFWSA-N 1 0 278.415 3.950 20 10 CHCDRO C[C@@H]([NH2+]CC(C)(C)N1CCC[C@H](C)C1)c1ccccc1O ZINC000248386174 1129415682 /nfs/dbraw/zinc/41/56/82/1129415682.db2.gz LNVZEIOCELZUAP-LSDHHAIUSA-N 1 0 290.451 3.553 20 10 CHCDRO CCOc1cccc(C[N@H+](C)Cc2ccc(C)s2)c1O ZINC000093049329 1129415910 /nfs/dbraw/zinc/41/59/10/1129415910.db2.gz JWHICDQJFVRYGC-UHFFFAOYSA-N 1 0 291.416 3.793 20 10 CHCDRO C[C@H]1C[C@H](C)[N@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C1 ZINC000740860283 1129420721 /nfs/dbraw/zinc/42/07/21/1129420721.db2.gz CMXMZNZOJUXAMD-RYUDHWBXSA-N 1 0 277.408 3.626 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H]2CC[C@H](C)CC2)c1 ZINC000248530474 1129421353 /nfs/dbraw/zinc/42/13/53/1129421353.db2.gz XJJCAWAQCAYHIZ-JHJVBQTASA-N 1 0 263.381 3.630 20 10 CHCDRO Oc1ccc(Br)cc1C[N@@H+]1CCC2(CCC2)C1 ZINC000093455757 1129423527 /nfs/dbraw/zinc/42/35/27/1129423527.db2.gz IOCMZJWVHKFREG-UHFFFAOYSA-N 1 0 296.208 3.531 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(F)cc1F)c1cc(F)ccc1O ZINC000094618059 1129448275 /nfs/dbraw/zinc/44/82/75/1129448275.db2.gz FUDDDHUNXGLQGU-VIFPVBQESA-N 1 0 281.277 3.660 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H](C)c1ccccc1)c1cc(F)ccc1O ZINC000094616908 1129448324 /nfs/dbraw/zinc/44/83/24/1129448324.db2.gz WKEMXMMNQUXFMF-CHWSQXEVSA-N 1 0 273.351 3.986 20 10 CHCDRO CCN(C)c1ccc(C[N@H+](C)Cc2ccccc2)cc1 ZINC000741752891 1129451213 /nfs/dbraw/zinc/45/12/13/1129451213.db2.gz HJOBVLXTEVTKRO-UHFFFAOYSA-N 1 0 268.404 3.775 20 10 CHCDRO CCC[N@H+](CC[C@@H](O)c1ccccc1)Cc1ccccc1O ZINC000795927850 1129457109 /nfs/dbraw/zinc/45/71/09/1129457109.db2.gz ZSOOJUPQFJKNNK-LJQANCHMSA-N 1 0 299.414 3.728 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2cccc(Cl)c2F)c1 ZINC000742388564 1129473921 /nfs/dbraw/zinc/47/39/21/1129473921.db2.gz YDFUQTXUVVVWHB-UHFFFAOYSA-N 1 0 279.742 3.783 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H]2CC[C@H]3CCC[C@@H]3C2)c1 ZINC000742378340 1129475979 /nfs/dbraw/zinc/47/59/79/1129475979.db2.gz FJKFOLPTJVICCW-IIAWOOMASA-N 1 0 259.393 3.759 20 10 CHCDRO CCOc1ccc(C[NH2+][C@@H]2CC[C@@H]3CCC[C@@H]3C2)c(O)c1 ZINC000742378732 1129476166 /nfs/dbraw/zinc/47/61/66/1129476166.db2.gz LIXKBBCSGYQMNB-SQWLQELKSA-N 1 0 289.419 3.849 20 10 CHCDRO C[N@H+](CCc1cccs1)Cc1cc2c(cc1O)CCC2 ZINC000743382258 1129521928 /nfs/dbraw/zinc/52/19/28/1129521928.db2.gz NDASBPUSLFLTSK-UHFFFAOYSA-N 1 0 287.428 3.617 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCOC[C@H]2c2ccccc2)cc1C ZINC000743407386 1129523282 /nfs/dbraw/zinc/52/32/82/1129523282.db2.gz WWCASOZYBRCWQM-SFHVURJKSA-N 1 0 297.398 3.583 20 10 CHCDRO Cc1ccccc1C(C)(C)C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000303106984 1129528061 /nfs/dbraw/zinc/52/80/61/1129528061.db2.gz JLZHONAJPLHIRF-UHFFFAOYSA-N 1 0 295.426 3.997 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2C[C@H](OC(C)C)C2(C)C)c1 ZINC000766331851 1129604564 /nfs/dbraw/zinc/60/45/64/1129604564.db2.gz NMZUKAUDONQMGH-XKQJLSEDSA-N 1 0 291.435 3.943 20 10 CHCDRO CCOc1cccc(C[N@@H+]2C[C@H](C)C[C@H](C)[C@H]2C)c1O ZINC000253093277 1129610027 /nfs/dbraw/zinc/61/00/27/1129610027.db2.gz IFLUVVTVPFGWLX-HZSPNIEDSA-N 1 0 277.408 3.657 20 10 CHCDRO CC(C)C[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(O)c(O)c1 ZINC001169060963 1129694412 /nfs/dbraw/zinc/69/44/12/1129694412.db2.gz FSUMMGURNSMFIK-KRWDZBQOSA-N 1 0 299.414 3.845 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)C[C@H]1CCOC1)c1ccc(N(C)C)cc1 ZINC000766582276 1129697707 /nfs/dbraw/zinc/69/77/07/1129697707.db2.gz QDMJPPSLFUFFND-RKVPGOIHSA-N 1 0 290.451 3.608 20 10 CHCDRO CNc1ccccc1N[C@H]1CC(C)(C)C[C@](C)(C[NH3+])C1 ZINC001169152410 1129705437 /nfs/dbraw/zinc/70/54/37/1129705437.db2.gz PNTJLNLSYZUNAO-SUMWQHHRSA-N 1 0 275.440 3.684 20 10 CHCDRO COc1cc(Cl)cc(C[NH+]2C[C@H]3CCCC[C@@H]3C2)c1O ZINC000380325624 1129739325 /nfs/dbraw/zinc/73/93/25/1129739325.db2.gz PMUZFXYLQIISTB-VXGBXAGGSA-N 1 0 295.810 3.676 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CSC[C@@H]2C)cc1F ZINC000796482226 1129742005 /nfs/dbraw/zinc/74/20/05/1129742005.db2.gz LQBFSGYGLNCLCI-SWLSCSKDSA-N 1 0 296.455 3.513 20 10 CHCDRO CCCC[N@H+](Cc1ccccc1O)CC12CC(C)(C1)OC2 ZINC001169753666 1129752542 /nfs/dbraw/zinc/75/25/42/1129752542.db2.gz ASSSVBUXOSDRTF-UHFFFAOYSA-N 1 0 289.419 3.563 20 10 CHCDRO COc1cccc(O)c1C[NH2+][C@@H]1CCCc2sccc21 ZINC000767190843 1129780693 /nfs/dbraw/zinc/78/06/93/1129780693.db2.gz PXKUBFCNCXIKKX-CYBMUJFWSA-N 1 0 289.400 3.630 20 10 CHCDRO CC/C=C/CC[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1 ZINC000767339062 1129785356 /nfs/dbraw/zinc/78/53/56/1129785356.db2.gz SGVLVEAGZAFALP-APHBUQMISA-N 1 0 288.435 3.530 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]CCC(C)(C)C2CC2)c1 ZINC000380949797 1129833460 /nfs/dbraw/zinc/83/34/60/1129833460.db2.gz DWVJNRQVINSKSE-GFCCVEGCSA-N 1 0 277.408 3.878 20 10 CHCDRO CC[C@@H](C)[C@H](C[NH2+]Cc1ccc(N(CC)CC)cc1)OC ZINC000381128640 1129834013 /nfs/dbraw/zinc/83/40/13/1129834013.db2.gz GQUIOSMAFKVZGE-QAPCUYQASA-N 1 0 292.467 3.684 20 10 CHCDRO CC(C)[C@@H](C)[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000768137146 1129835012 /nfs/dbraw/zinc/83/50/12/1129835012.db2.gz GQUWFNUBPORBRV-CQSZACIVSA-N 1 0 260.425 3.762 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)C[C@H]2CC=CCC2)cc1 ZINC000768129994 1129835230 /nfs/dbraw/zinc/83/52/30/1129835230.db2.gz MEIUWCMWCHJPSO-HNNXBMFYSA-N 1 0 258.409 3.541 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]CCC(C)(C)C2CC2)c1O ZINC000381333375 1129837090 /nfs/dbraw/zinc/83/70/90/1129837090.db2.gz 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CN(C)c1ccc(C[NH2+][C@@H]2CCC[C@H]2CCCF)cc1F ZINC000800969515 1129900901 /nfs/dbraw/zinc/90/09/01/1129900901.db2.gz RKVVANKGRPJEJM-GOEBONIOSA-N 1 0 296.405 3.900 20 10 CHCDRO CC[C@@H](C)[C@@H](C)[N@H+](Cc1cc2c(cc1O)OCO2)C1CC1 ZINC000769339606 1129903711 /nfs/dbraw/zinc/90/37/11/1129903711.db2.gz TVOCMBYRTWNOOB-VXGBXAGGSA-N 1 0 291.391 3.520 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CCc3ccccc3[C@H]2C)c(O)c1 ZINC000769349707 1129903801 /nfs/dbraw/zinc/90/38/01/1129903801.db2.gz DIAISQYTJXGGGL-CQSZACIVSA-N 1 0 297.398 3.910 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCCOC(C)(C)C2)cc1 ZINC000769464465 1129911678 /nfs/dbraw/zinc/91/16/78/1129911678.db2.gz XZTUNENERJGWDB-UHFFFAOYSA-N 1 0 290.451 3.534 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CCS[C@@H]2CCCC[C@@H]21 ZINC000769497429 1129913970 /nfs/dbraw/zinc/91/39/70/1129913970.db2.gz DOGRWRZGNSYTNB-DZGCQCFKSA-N 1 0 297.851 3.906 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CCS[C@H]2CCCC[C@H]21 ZINC000769497891 1129914050 /nfs/dbraw/zinc/91/40/50/1129914050.db2.gz HBWDNDVRDNFYOZ-HIFRSBDPSA-N 1 0 297.851 3.906 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CC[C@H]2Cc2ccccc2)c1O ZINC000769507050 1129915067 /nfs/dbraw/zinc/91/50/67/1129915067.db2.gz ZMXVSQHLQPAPPX-KRWDZBQOSA-N 1 0 297.398 3.608 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCCC[C@H]2c2cccn2C)cc1 ZINC000769536728 1129916541 /nfs/dbraw/zinc/91/65/41/1129916541.db2.gz CQJLSYITNGRCQV-IBGZPJMESA-N 1 0 297.446 3.818 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2ccc(N(C)C)cc2)[C@H]1c1ccccc1 ZINC000769538892 1129916581 /nfs/dbraw/zinc/91/65/81/1129916581.db2.gz GCPRIDMFJDAVNK-DNVCBOLYSA-N 1 0 280.415 3.946 20 10 CHCDRO CCS[C@H]1CC[C@@H]([N@H+](C)Cc2ccc(N(C)C)cc2)C1 ZINC000769550339 1129916882 /nfs/dbraw/zinc/91/68/82/1129916882.db2.gz RBZKDZDHJWWRNA-SJORKVTESA-N 1 0 292.492 3.859 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCC2(CCCC2)O1)c1ccccc1O ZINC000801527377 1129924524 /nfs/dbraw/zinc/92/45/24/1129924524.db2.gz AFYHNNHDZZRAMS-ZBFHGGJFSA-N 1 0 289.419 3.925 20 10 CHCDRO Oc1cc2c(cc1C[N@@H+]1CCCC3(CC3)C1)CCCC2 ZINC000769794303 1129925624 /nfs/dbraw/zinc/92/56/24/1129925624.db2.gz SHVODPRQVUYFJK-UHFFFAOYSA-N 1 0 271.404 3.647 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](C)Cc2cccc(N(C)C)c2)cc1C ZINC000769851845 1129928910 /nfs/dbraw/zinc/92/89/10/1129928910.db2.gz GDMIODSVSLHNJK-UHFFFAOYSA-N 1 0 298.430 3.707 20 10 CHCDRO CCCC[N@@H+](Cc1ccccc1O)C[C@H]1CC[C@@H](C)O1 ZINC000801594583 1129931322 /nfs/dbraw/zinc/93/13/22/1129931322.db2.gz GUKJFJLTGAGNIT-GDBMZVCRSA-N 1 0 277.408 3.562 20 10 CHCDRO CCCC[N@@H+](Cc1ccccc1O)C[C@H]1CCCCO1 ZINC000801596014 1129932155 /nfs/dbraw/zinc/93/21/55/1129932155.db2.gz ZBGKZNVZIHMPDF-MRXNPFEDSA-N 1 0 277.408 3.563 20 10 CHCDRO COC(C)(C)C[N@H+](C)Cc1cc(-c2ccccc2)ccc1O ZINC000770316948 1129944449 /nfs/dbraw/zinc/94/44/49/1129944449.db2.gz GWZDHZPRJLHLSE-UHFFFAOYSA-N 1 0 299.414 3.916 20 10 CHCDRO CS[C@@H]1CCCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC000770345995 1129945290 /nfs/dbraw/zinc/94/52/90/1129945290.db2.gz BMUASZCNEOKRMJ-CYBMUJFWSA-N 1 0 285.840 3.763 20 10 CHCDRO CCC[N@H+](Cc1ccccc1O)[C@H](C)c1ncc(C)o1 ZINC000771445748 1129980825 /nfs/dbraw/zinc/98/08/25/1129980825.db2.gz HGTQGHRTRPTBQG-CYBMUJFWSA-N 1 0 274.364 3.662 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@H](C)[C@@H]2C[C@H]2c2ccccc2)c1 ZINC000802303592 1129990877 /nfs/dbraw/zinc/99/08/77/1129990877.db2.gz LCONBVQSRONMQH-BVGQSLNGSA-N 1 0 297.398 3.683 20 10 CHCDRO COc1c(Cl)cccc1C[NH2+][C@@H](C)c1ccccc1O ZINC000903245821 1130135970 /nfs/dbraw/zinc/13/59/70/1130135970.db2.gz JHQWAOYWLOSBGX-NSHDSACASA-N 1 0 291.778 3.905 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)CCOC(C)(C)C)cc1 ZINC000746651405 1130137318 /nfs/dbraw/zinc/13/73/18/1130137318.db2.gz TXYZPJMJAIJLIQ-UHFFFAOYSA-N 1 0 292.467 3.780 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](c2ncccn2)C2CC2)c(O)c1C ZINC000903327366 1130155980 /nfs/dbraw/zinc/15/59/80/1130155980.db2.gz SDNMTWQPWPRFOV-XJKSGUPXSA-N 1 0 297.402 3.601 20 10 CHCDRO C[C@@H]([NH2+][C@H](c1ccccn1)C1CC1)c1ccccc1O ZINC000903337539 1130161796 /nfs/dbraw/zinc/16/17/96/1130161796.db2.gz DUOHKGNOIDCJOT-PXAZEXFGSA-N 1 0 268.360 3.589 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]CC[C@@H]1CCC(F)(F)C1)CC2 ZINC000903339761 1130162649 /nfs/dbraw/zinc/16/26/49/1130162649.db2.gz CWZILQKZPLDUNX-AAEUAGOBSA-N 1 0 281.346 3.795 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H](c2ccncc2)C2CC2)c1O ZINC000903428861 1130175695 /nfs/dbraw/zinc/17/56/95/1130175695.db2.gz LVIJKPCKWCOLNY-YVEFUNNKSA-N 1 0 298.386 3.598 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H](c2ccncc2)C2CC2)c(O)c1 ZINC000903430340 1130176853 /nfs/dbraw/zinc/17/68/53/1130176853.db2.gz YVRZPRCEBZMVLC-FZKQIMNGSA-N 1 0 282.387 3.898 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCC(O)(CC)CC)cc1 ZINC000788264040 1130179298 /nfs/dbraw/zinc/17/92/98/1130179298.db2.gz WRJMWACWZYXRPM-OAHLLOKOSA-N 1 0 292.467 3.735 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CCN(C(C)C)C(C)C)c(O)c1 ZINC000788506598 1130191675 /nfs/dbraw/zinc/19/16/75/1130191675.db2.gz WSVVJEAXMCPCNM-MRXNPFEDSA-N 1 0 292.467 3.778 20 10 CHCDRO CCN1CCCC[C@H]1C[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000788595033 1130196205 /nfs/dbraw/zinc/19/62/05/1130196205.db2.gz ZBZCPNUBPRVJHI-HOTGVXAUSA-N 1 0 290.451 3.534 20 10 CHCDRO CSC1(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)CCC1 ZINC000788604473 1130197497 /nfs/dbraw/zinc/19/74/97/1130197497.db2.gz AUQDBBVFBAGDDV-ZYHUDNBSSA-N 1 0 295.423 3.955 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@](C)(O)CCC(C)C)c(O)c1 ZINC000788600879 1130197558 /nfs/dbraw/zinc/19/75/58/1130197558.db2.gz DVIRXJJRAITCPU-MAUKXSAKSA-N 1 0 293.451 3.847 20 10 CHCDRO C[C@H]([NH2+]CCC1CC1)c1cccc(C(F)(F)F)c1[O-] ZINC000788667283 1130201348 /nfs/dbraw/zinc/20/13/48/1130201348.db2.gz UKWXKGPJEMUGOS-VIFPVBQESA-N 1 0 273.298 3.862 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H]2CCC(C)(C)O2)c(O)c1 ZINC000788765383 1130207188 /nfs/dbraw/zinc/20/71/88/1130207188.db2.gz NSZMQIBFOCLKIB-KBPBESRZSA-N 1 0 277.408 3.617 20 10 CHCDRO CCOC[C@H]([NH2+][C@@H](C)c1ccc(C)c(C)c1O)C(C)C ZINC000788983678 1130221808 /nfs/dbraw/zinc/22/18/08/1130221808.db2.gz FIRFOXABCMIHIH-HOCLYGCPSA-N 1 0 279.424 3.721 20 10 CHCDRO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)C[C@@H]1CC[C@H](C)O1 ZINC000789310644 1130242684 /nfs/dbraw/zinc/24/26/84/1130242684.db2.gz SYYVFQPQBJRBEG-YJBOKZPZSA-N 1 0 290.451 3.531 20 10 CHCDRO COc1c2ccccc2oc1C[NH2+]Cc1cccc(C)c1O ZINC000789583906 1130261007 /nfs/dbraw/zinc/26/10/07/1130261007.db2.gz KSCMKSBVVLDEHE-UHFFFAOYSA-N 1 0 297.354 3.745 20 10 CHCDRO CC[C@H](COCC1CC1)[NH2+]Cc1ccc2ccccc2c1O ZINC000826868358 1130299138 /nfs/dbraw/zinc/29/91/38/1130299138.db2.gz ROMBYSSEGGQIOR-QGZVFWFLSA-N 1 0 299.414 3.840 20 10 CHCDRO COCC[N@H+](Cc1cc(C)c(C)cc1O)[C@H]1CC[C@H](C)C1 ZINC000790475515 1130314971 /nfs/dbraw/zinc/31/49/71/1130314971.db2.gz AQSRXNKESWAGQX-GUYCJALGSA-N 1 0 291.435 3.646 20 10 CHCDRO C[C@@H]1CC[C@@H]([N@H+](C)Cc2ccc(N3CCCC3)cc2)C1 ZINC001170144659 1130330314 /nfs/dbraw/zinc/33/03/14/1130330314.db2.gz MWJTUUJURMAABC-CRAIPNDOSA-N 1 0 272.436 3.907 20 10 CHCDRO Cc1cccc(CNc2[nH+]ccc(C)c2C2CC2)c1O ZINC000827010887 1130337860 /nfs/dbraw/zinc/33/78/60/1130337860.db2.gz 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/nfs/dbraw/zinc/54/87/92/1130548792.db2.gz WJDNNTBDQHMGAH-UHFFFAOYSA-N 1 0 273.351 3.562 20 10 CHCDRO CC[N@@H+](Cc1cc(Cl)ccc1O)CC1CCC1 ZINC000793351786 1130549179 /nfs/dbraw/zinc/54/91/79/1130549179.db2.gz GUUMLWWQJGASNE-UHFFFAOYSA-N 1 0 253.773 3.668 20 10 CHCDRO CC1(C)CC[C@H]1[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000793526134 1130563456 /nfs/dbraw/zinc/56/34/56/1130563456.db2.gz XGCSZWSQZJLZEK-MRXNPFEDSA-N 1 0 290.476 3.518 20 10 CHCDRO COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+]Cc2ccccc2O)cc1 ZINC000793527196 1130563662 /nfs/dbraw/zinc/56/36/62/1130563662.db2.gz ONKSATVOXKOEGZ-MORSLUCNSA-N 1 0 297.398 3.683 20 10 CHCDRO COc1ccc(C[NH2+]CC(C)(C)[C@H]2CCCCO2)cc1C ZINC000758499627 1130614733 /nfs/dbraw/zinc/61/47/33/1130614733.db2.gz RWYHMZTVONFAGF-QGZVFWFLSA-N 1 0 291.435 3.689 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+][C@@H](c1cccnc1)C1CC1 ZINC000758622128 1130619624 /nfs/dbraw/zinc/61/96/24/1130619624.db2.gz HGYMRKRYGMQHSX-MRXNPFEDSA-N 1 0 288.778 3.682 20 10 CHCDRO 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Cc1cc(C)c([C@@H](C)[NH2+]CC(C)(C)[C@H](O)C(C)C)c(O)c1 ZINC000815598011 1131005732 /nfs/dbraw/zinc/00/57/32/1131005732.db2.gz KQPKOKNADFUWCT-RHSMWYFYSA-N 1 0 293.451 3.703 20 10 CHCDRO CCc1ccc(C[N@H+](C)Cc2ccccc2OC)c(O)c1 ZINC001236788682 1131006949 /nfs/dbraw/zinc/00/69/49/1131006949.db2.gz MZSZPCMVZCXEDT-UHFFFAOYSA-N 1 0 285.387 3.595 20 10 CHCDRO C[C@@H]1C[C@H](F)CN1Cc1cc(Cl)c(Cl)cc1O ZINC001236794835 1131009296 /nfs/dbraw/zinc/00/92/96/1131009296.db2.gz VGXBGHBGXYPJEY-APPZFPTMSA-N 1 0 278.154 3.631 20 10 CHCDRO CCc1ccc(C[NH+]2CCC(c3cccnc3)CC2)c(O)c1 ZINC001236791188 1131009524 /nfs/dbraw/zinc/00/95/24/1131009524.db2.gz FHMFXZNZJIBCNY-UHFFFAOYSA-N 1 0 296.414 3.729 20 10 CHCDRO CCc1ccc(C[N@@H+]2CC[C@H]2c2ccccc2)c(O)c1 ZINC001236791782 1131009556 /nfs/dbraw/zinc/00/95/56/1131009556.db2.gz KUOUTMFFNZLQNX-KRWDZBQOSA-N 1 0 267.372 3.902 20 10 CHCDRO C[N@H+](Cc1cc(Cl)c(Cl)cc1[O-])C1CC(F)(F)C1 ZINC001236794712 1131009773 /nfs/dbraw/zinc/00/97/73/1131009773.db2.gz UGZAJCICBWUDPJ-UHFFFAOYSA-N 1 0 296.144 3.929 20 10 CHCDRO CCCN1CCC[C@H]1C[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000815626089 1131010259 /nfs/dbraw/zinc/01/02/59/1131010259.db2.gz VIVCLPHFAQGDRR-HOTGVXAUSA-N 1 0 290.451 3.534 20 10 CHCDRO COc1cc(O)c(C[N@H+]2C[C@H](C)C[C@H](C)C2)c(Cl)c1 ZINC001236804802 1131012253 /nfs/dbraw/zinc/01/22/53/1131012253.db2.gz ZXSNNIKFLKEUKA-PHIMTYICSA-N 1 0 283.799 3.532 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+][C@@H]2CCC(F)(F)C2)c(O)c1 ZINC000815607514 1131012554 /nfs/dbraw/zinc/01/25/54/1131012554.db2.gz AGSNJYBONMLDEQ-VXGBXAGGSA-N 1 0 269.335 3.847 20 10 CHCDRO COc1cc(O)c(C[NH+](C(C)C)C(C)C)c(Cl)c1 ZINC001236804325 1131012987 /nfs/dbraw/zinc/01/29/87/1131012987.db2.gz QWTJLXWBMDZYKV-UHFFFAOYSA-N 1 0 271.788 3.673 20 10 CHCDRO COc1cc(C)c(C[N@@H+]2CCC3(C2)CCCCC3)c(O)c1 ZINC001236815412 1131015064 /nfs/dbraw/zinc/01/50/64/1131015064.db2.gz LHJIAHJPDINYGT-UHFFFAOYSA-N 1 0 289.419 3.865 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1cc[nH]c(=O)c1)c1ccc(C)cc1O 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CC1(C)C[NH+](Cc2cc3ccccc3cc2O)CC(C)(C)O1 ZINC001236834718 1131020104 /nfs/dbraw/zinc/02/01/04/1131020104.db2.gz BKVHUENOUJZUJG-UHFFFAOYSA-N 1 0 299.414 3.935 20 10 CHCDRO CSc1ccc(CC[NH2+]Cc2cc(F)ccc2O)cc1 ZINC000798086650 1131024487 /nfs/dbraw/zinc/02/44/87/1131024487.db2.gz SJUPJNGZBIEJPQ-UHFFFAOYSA-N 1 0 291.391 3.586 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CCC[C@@H]3CCCC[C@@H]32)c(O)c1 ZINC001237042044 1131038819 /nfs/dbraw/zinc/03/88/19/1131038819.db2.gz DPWWKKQNAOAYEG-YOEHRIQHSA-N 1 0 289.419 3.946 20 10 CHCDRO CC(C)c1ccc(C[N@@H+]2CC[C@]3(CC3(F)F)C2)c(O)c1 ZINC001237050224 1131040740 /nfs/dbraw/zinc/04/07/40/1131040740.db2.gz ZMTKYIVFCUBAQJ-HNNXBMFYSA-N 1 0 281.346 3.747 20 10 CHCDRO CC[N@H+](Cc1ccc(OCC(F)(F)F)cc1O)C(C)C ZINC001237050318 1131040985 /nfs/dbraw/zinc/04/09/85/1131040985.db2.gz AHZNFUUCTHPYCY-UHFFFAOYSA-N 1 0 291.313 3.564 20 10 CHCDRO CC(C)c1ccc(C[N@@H+]2CCC3(C2)CCOCC3)c(O)c1 ZINC001237053410 1131043070 /nfs/dbraw/zinc/04/30/70/1131043070.db2.gz LLMZRLKSFDVPIK-UHFFFAOYSA-N 1 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XJNXCTQCGUAJLO-LBPRGKRZSA-N 1 0 273.298 3.785 20 10 CHCDRO C[C@H]1C[C@H](C)C[NH+](Cc2cc(C(F)(F)F)ccc2O)C1 ZINC001237140742 1131058685 /nfs/dbraw/zinc/05/86/85/1131058685.db2.gz OKNWRPIQNUBMAX-QWRGUYRKSA-N 1 0 287.325 3.889 20 10 CHCDRO Cc1ncc(C[N@@H+](C)Cc2ccc3ccccc3c2O)s1 ZINC000816493657 1131100141 /nfs/dbraw/zinc/10/01/41/1131100141.db2.gz JIQFRVAMWFFWRW-UHFFFAOYSA-N 1 0 298.411 3.942 20 10 CHCDRO CCC[N@H+](Cc1ccc2ccccc2c1O)CC(C)(C)O ZINC000816504316 1131102328 /nfs/dbraw/zinc/10/23/28/1131102328.db2.gz IESXTUZJWBQUIT-UHFFFAOYSA-N 1 0 287.403 3.528 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2c(C)cccc2O)cc1 ZINC001237489491 1131103393 /nfs/dbraw/zinc/10/33/93/1131103393.db2.gz IASXUXCPLYUXGW-UHFFFAOYSA-N 1 0 255.361 3.641 20 10 CHCDRO COc1cccc(CCC[N@H+](C)Cc2c(C)cccc2O)c1 ZINC001237491093 1131103421 /nfs/dbraw/zinc/10/34/21/1131103421.db2.gz GRAICCNOKFJYSJ-UHFFFAOYSA-N 1 0 299.414 3.774 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)c1cccc(O)c1 ZINC000799718457 1131103638 /nfs/dbraw/zinc/10/36/38/1131103638.db2.gz BKPSSEYULRRCAF-CQSZACIVSA-N 1 0 284.403 3.617 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+]1CCc2c(C)cccc2C1 ZINC001237480855 1131103842 /nfs/dbraw/zinc/10/38/42/1131103842.db2.gz AOCVPWAUPYHNJO-UHFFFAOYSA-N 1 0 267.372 3.567 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+]1CC[C@@H](c2ccccc2F)C1 ZINC001237489827 1131104209 /nfs/dbraw/zinc/10/42/09/1131104209.db2.gz LFEQVZRZVGTBCH-CQSZACIVSA-N 1 0 285.362 3.829 20 10 CHCDRO Cc1cccc(O)c1C[N@H+](C)Cc1cccc2cccnc21 ZINC001237490619 1131104351 /nfs/dbraw/zinc/10/43/51/1131104351.db2.gz XSHZQOGUTXLVNV-UHFFFAOYSA-N 1 0 292.382 3.881 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCCC[C@@H]1OC)c1ccc(N(C)C)cc1 ZINC000799729757 1131105502 /nfs/dbraw/zinc/10/55/02/1131105502.db2.gz RAOOPUUHZZGRLN-BZSNNMDCSA-N 1 0 290.451 3.751 20 10 CHCDRO Cc1cccc(O)c1C[N@H+](C)CCc1cccc(F)c1 ZINC001237494784 1131106152 /nfs/dbraw/zinc/10/61/52/1131106152.db2.gz LKMWSCRSJGHXLG-UHFFFAOYSA-N 1 0 273.351 3.514 20 10 CHCDRO CC(C)[C@@H]1CC[N@@H+]1Cc1ccc2ccccc2c1O ZINC000816527858 1131108761 /nfs/dbraw/zinc/10/87/61/1131108761.db2.gz BTSAFXDPLFWKFE-INIZCTEOSA-N 1 0 255.361 3.776 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H](C)Cc1ccc(O)cc1 ZINC000816592179 1131109457 /nfs/dbraw/zinc/10/94/57/1131109457.db2.gz BGINNFBBDYQURH-HNNXBMFYSA-N 1 0 298.430 3.699 20 10 CHCDRO Oc1c(C[NH2+]C[C@H]2CCCS2)ccc2ccccc21 ZINC000816556425 1131109870 /nfs/dbraw/zinc/10/98/70/1131109870.db2.gz IRQXKLRAURVRBA-CQSZACIVSA-N 1 0 273.401 3.531 20 10 CHCDRO COC[C@@H]1CCCC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816570750 1131112445 /nfs/dbraw/zinc/11/24/45/1131112445.db2.gz GMBHJGQHAXQOJJ-OAHLLOKOSA-N 1 0 299.414 3.794 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CC(C)(C)[C@H]2C(C)C)c1O ZINC000816624853 1131112485 /nfs/dbraw/zinc/11/24/85/1131112485.db2.gz JNOFRLRNXUVLSM-MRXNPFEDSA-N 1 0 277.408 3.657 20 10 CHCDRO COc1ccc(C[NH2+][C@H]2CCCC23CCCC3)c(O)c1 ZINC000816597256 1131114416 /nfs/dbraw/zinc/11/44/16/1131114416.db2.gz KZRUTJWPKVSFSW-INIZCTEOSA-N 1 0 275.392 3.603 20 10 CHCDRO CO[C@@]1(C)CCC[N@H+](Cc2ccc3ccccc3c2O)CC1 ZINC000816596085 1131114563 /nfs/dbraw/zinc/11/45/63/1131114563.db2.gz NVBSTNPZXKXXJR-IBGZPJMESA-N 1 0 299.414 3.936 20 10 CHCDRO COc1cccc(C[N@@H+]2CCC[C@@H](c3ccccc3)C2)c1O ZINC000816619850 1131117050 /nfs/dbraw/zinc/11/70/50/1131117050.db2.gz XXCBBHGZSLBPGM-MRXNPFEDSA-N 1 0 297.398 3.780 20 10 CHCDRO Cc1cccc(C[NH2+]C[C@@H]2C[C@H]2c2ccccc2)c1O ZINC000816649928 1131120595 /nfs/dbraw/zinc/12/05/95/1131120595.db2.gz OREOIURENSCYKQ-IRXDYDNUSA-N 1 0 267.372 3.594 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+]2C[C@H](C)C[C@H](C)C2)c1O ZINC001237685194 1131126222 /nfs/dbraw/zinc/12/62/22/1131126222.db2.gz FILWSDHKHHQZEK-PHIMTYICSA-N 1 0 267.800 3.832 20 10 CHCDRO CCCC[NH+](CCCC)Cc1cc(OC)cc(OC)c1O ZINC001237679234 1131126519 /nfs/dbraw/zinc/12/65/19/1131126519.db2.gz UIFLLFCBNVUULK-UHFFFAOYSA-N 1 0 295.423 3.812 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+]2CCC[C@H](C)CC2)c1O ZINC001237681801 1131127245 /nfs/dbraw/zinc/12/72/45/1131127245.db2.gz SHTUNMIUTPVTPO-NSHDSACASA-N 1 0 267.800 3.976 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+](CC2CC2)C(C)C)c1O ZINC001237685524 1131127448 /nfs/dbraw/zinc/12/74/48/1131127448.db2.gz FGNPHLCPZJICET-UHFFFAOYSA-N 1 0 267.800 3.974 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+]2CC[C@H](C)C[C@@H]2C)c1O ZINC001237687227 1131127906 /nfs/dbraw/zinc/12/79/06/1131127906.db2.gz VVZXADQTPOMNQY-JQWIXIFHSA-N 1 0 267.800 3.974 20 10 CHCDRO CCN(CC[NH+](CC)CC)Cc1cc(Cl)cc(C)c1O ZINC001237687582 1131128697 /nfs/dbraw/zinc/12/86/97/1131128697.db2.gz NGIIBIFVQOJSIA-UHFFFAOYSA-N 1 0 298.858 3.518 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+](CCCCCO)C(C)C)c1O ZINC001237689068 1131128887 /nfs/dbraw/zinc/12/88/87/1131128887.db2.gz MMGLCGITPOFUKQ-UHFFFAOYSA-N 1 0 299.842 3.727 20 10 CHCDRO [O-]c1c(Cl)cc(F)cc1C[N@@H+]1CCCCC12CC2 ZINC001237807263 1131142151 /nfs/dbraw/zinc/14/21/51/1131142151.db2.gz ZWHHDPWMUGBMOS-UHFFFAOYSA-N 1 0 269.747 3.703 20 10 CHCDRO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1cc(F)cc(Cl)c1[O-] ZINC001237810071 1131142573 /nfs/dbraw/zinc/14/25/73/1131142573.db2.gz MZYJTVQESRVMDH-AOOOYVTPSA-N 1 0 271.763 3.948 20 10 CHCDRO C[C@]1(F)CCC[N@H+](Cc2cc(F)c(Cl)cc2[O-])CC1 ZINC001237935062 1131152742 /nfs/dbraw/zinc/15/27/42/1131152742.db2.gz PPMQWQPFTKOORI-AWEZNQCLSA-N 1 0 289.753 3.899 20 10 CHCDRO CC[C@@H]1C[C@@H]([NH2+][C@@H](C)c2ccc(N(C)CC)cc2)CCO1 ZINC000817586084 1131173653 /nfs/dbraw/zinc/17/36/53/1131173653.db2.gz LPFVIJKKALCZLQ-QILLFSRXSA-N 1 0 290.451 3.751 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CCO[C@H](CC)C1)c1ccc(F)cc1[O-] ZINC000817587429 1131173663 /nfs/dbraw/zinc/17/36/63/1131173663.db2.gz WYIRKVURXMFWSX-GZBFAFLISA-N 1 0 281.371 3.530 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCO[C@H](CC)C1)c1ccc(N(C)C)cc1 ZINC000817585737 1131173689 /nfs/dbraw/zinc/17/36/89/1131173689.db2.gz HKLDCWFRRUNCGM-NXHRZFHOSA-N 1 0 290.451 3.751 20 10 CHCDRO Cc1cc(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)cc(C)n1 ZINC000817590111 1131175167 /nfs/dbraw/zinc/17/51/67/1131175167.db2.gz SZZFSMKRNOGJIP-OAHLLOKOSA-N 1 0 284.403 3.872 20 10 CHCDRO C[C@@H](CCC(C)(C)C)[NH2+]C[C@H](N)c1ccc(N(C)C)cc1 ZINC000817943902 1131188520 /nfs/dbraw/zinc/18/85/20/1131188520.db2.gz WMASLHBETVJXLO-YOEHRIQHSA-N 1 0 291.483 3.557 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCc2ccc(N)cc2)c(C)c1 ZINC000817955499 1131190111 /nfs/dbraw/zinc/19/01/11/1131190111.db2.gz CKPINISSSIUVFI-HNNXBMFYSA-N 1 0 268.404 3.779 20 10 CHCDRO Nc1ccc(CC[NH2+][C@H]2CCC[C@@H](c3cccnc3)C2)cc1 ZINC000817958761 1131191010 /nfs/dbraw/zinc/19/10/10/1131191010.db2.gz YAFPHZATFPHZES-APWZRJJASA-N 1 0 295.430 3.522 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccc(N)cc1)c1cccc(F)c1 ZINC000817957833 1131191048 /nfs/dbraw/zinc/19/10/48/1131191048.db2.gz PORHNTHIENRIEW-QGZVFWFLSA-N 1 0 272.367 3.691 20 10 CHCDRO CC[C@@H]1CC[C@H](C)C[C@H]1[NH2+]CCc1ccc(N)cc1 ZINC000817957383 1131191259 /nfs/dbraw/zinc/19/12/59/1131191259.db2.gz LSGZJMBWLRVCIM-YSVLISHTSA-N 1 0 260.425 3.616 20 10 CHCDRO C[C@H]([NH2+]CCc1ccc(N)cc1)[C@H]1CCCC[C@H]1C ZINC000817957823 1131191324 /nfs/dbraw/zinc/19/13/24/1131191324.db2.gz PIEYGWXOWVJBPK-KEYYUXOJSA-N 1 0 260.425 3.616 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)NCC[NH2+]C2CCCCCC2)c1 ZINC000817959623 1131191584 /nfs/dbraw/zinc/19/15/84/1131191584.db2.gz DRUSQCDGIFWEIS-OAHLLOKOSA-N 1 0 290.451 3.664 20 10 CHCDRO Nc1ccc2c(c1)CCC[C@@H]2[NH2+][C@H]1CCc2cccc(O)c21 ZINC000817967377 1131193643 /nfs/dbraw/zinc/19/36/43/1131193643.db2.gz GVHNMQCJERUMPH-IRXDYDNUSA-N 1 0 294.398 3.629 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc3c(c2)CCCN3)c(O)c1 ZINC000817977970 1131194862 /nfs/dbraw/zinc/19/48/62/1131194862.db2.gz SFWZQHUNSFSESS-AWEZNQCLSA-N 1 0 296.414 3.910 20 10 CHCDRO Cc1cc(N)cc(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)c1 ZINC000817980025 1131195109 /nfs/dbraw/zinc/19/51/09/1131195109.db2.gz HRTXTNFXDBPBMN-CQSZACIVSA-N 1 0 284.403 3.750 20 10 CHCDRO C[C@@H]([NH2+][C@@H](CN)C1CCCC1)c1ccc2ccccc2c1O ZINC000817981184 1131195118 /nfs/dbraw/zinc/19/51/18/1131195118.db2.gz HAIMYTFRIHNNFY-ACJLOTCBSA-N 1 0 298.430 3.714 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc(C)cc(N)c1)c1ccccc1O ZINC000817979765 1131195571 /nfs/dbraw/zinc/19/55/71/1131195571.db2.gz FACKFJHPSBQEGS-MRXNPFEDSA-N 1 0 270.376 3.524 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C)[C@@H](O)C(C)C ZINC001117945849 1131205551 /nfs/dbraw/zinc/20/55/51/1131205551.db2.gz VRQDSGARLKINCJ-NPSOMJIGSA-N 1 0 291.435 3.634 20 10 CHCDRO Oc1cc(C(F)(F)F)ccc1C[NH+]1CCCCCC1 ZINC000258026141 1131206635 /nfs/dbraw/zinc/20/66/35/1131206635.db2.gz CKHLYOZULXNKKP-UHFFFAOYSA-N 1 0 273.298 3.787 20 10 CHCDRO CC[C@H](C)[C@@H](C)[NH2+]C[C@H]1CCN(c2ccc(OC)cc2)C1 ZINC000818344615 1131209938 /nfs/dbraw/zinc/20/99/38/1131209938.db2.gz OYNAXAZSLUXKRO-ARFHVFGLSA-N 1 0 290.451 3.546 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H]2CC23CC3)c1O ZINC000818355321 1131210693 /nfs/dbraw/zinc/21/06/93/1131210693.db2.gz COJSSVHJVBBQEB-BXKDBHETSA-N 1 0 251.757 3.557 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2CC23CC3)c1O ZINC000818355323 1131210736 /nfs/dbraw/zinc/21/07/36/1131210736.db2.gz COJSSVHJVBBQEB-JOYOIKCWSA-N 1 0 251.757 3.557 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2CC23CC3)c1O ZINC000818355322 1131210898 /nfs/dbraw/zinc/21/08/98/1131210898.db2.gz COJSSVHJVBBQEB-CABZTGNLSA-N 1 0 251.757 3.557 20 10 CHCDRO COC1CC(CC[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)C1 ZINC001118428213 1131225853 /nfs/dbraw/zinc/22/58/53/1131225853.db2.gz RICSUYQLPXXSMM-URGYJCLVSA-N 1 0 289.419 3.654 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)Cc1ccc(F)c(F)c1F ZINC001137940135 1131439191 /nfs/dbraw/zinc/43/91/91/1131439191.db2.gz ISCPZUZYZPHHES-UHFFFAOYSA-N 1 0 295.304 3.832 20 10 CHCDRO COc1cccc(O)c1C[NH2+]CC[C@H]1CCc2ccccc21 ZINC000824548273 1131475627 /nfs/dbraw/zinc/47/56/27/1131475627.db2.gz DFFGEIBARMMZQQ-OAHLLOKOSA-N 1 0 297.398 3.611 20 10 CHCDRO Cc1noc(C)c1C[N@@H+](C)Cc1cc(Cl)c(C)cc1O ZINC000824593899 1131476083 /nfs/dbraw/zinc/47/60/83/1131476083.db2.gz UUQAVTOTXXQYFR-UHFFFAOYSA-N 1 0 294.782 3.591 20 10 CHCDRO CC[C@H](C)[C@H](C[NH2+]Cc1ccc2ccccc2c1O)OC ZINC000824597665 1131476723 /nfs/dbraw/zinc/47/67/23/1131476723.db2.gz WEWVXVCKGXWSAG-GUYCJALGSA-N 1 0 287.403 3.696 20 10 CHCDRO c1cc(N2CCCCC2)ccc1C[N@@H+]1CC[C@@H]1C1CC1 ZINC000824650446 1131477158 /nfs/dbraw/zinc/47/71/58/1131477158.db2.gz NTXUJEWCZJBNEY-GOSISDBHSA-N 1 0 270.420 3.661 20 10 CHCDRO Cc1c(C[N@H+]2CCCC[C@@H]2C)c2ccccc2n1C ZINC001138252492 1131482138 /nfs/dbraw/zinc/48/21/38/1131482138.db2.gz IWXPTIKCOYZNKE-ZDUSSCGKSA-N 1 0 256.393 3.861 20 10 CHCDRO Cc1c(C[N@@H+]2CC3CCC2CC3)c2ccccc2n1C ZINC001138258035 1131483171 /nfs/dbraw/zinc/48/31/71/1131483171.db2.gz IYZRKRHOLPXGSV-UHFFFAOYSA-N 1 0 268.404 3.861 20 10 CHCDRO Cc1c(C[NH+]2CCC3(CCCO3)CC2)c2ccccc2n1C ZINC001138257146 1131483618 /nfs/dbraw/zinc/48/36/18/1131483618.db2.gz XZTHIOJVVMEKPB-UHFFFAOYSA-N 1 0 298.430 3.632 20 10 CHCDRO CC[C@@H]([NH2+]C[C@](C)(OC)c1ccccc1)c1ccccc1O ZINC000824780328 1131484050 /nfs/dbraw/zinc/48/40/50/1131484050.db2.gz KMYRLARPSHJOKL-MJGOQNOKSA-N 1 0 299.414 3.995 20 10 CHCDRO CC(C)[C@@H]1C[C@H](C[NH2+]Cc2cc(Cl)ccc2O)CCO1 ZINC000824798548 1131484699 /nfs/dbraw/zinc/48/46/99/1131484699.db2.gz DRWMZJHQDZJLMG-WBMJQRKESA-N 1 0 297.826 3.586 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@H]2CCO[C@H](C(C)C)C2)cc1C ZINC000824798575 1131484973 /nfs/dbraw/zinc/48/49/73/1131484973.db2.gz FAFANMKPFAQOBU-YJBOKZPZSA-N 1 0 291.435 3.550 20 10 CHCDRO CN1CCCc2cc(C[NH+]3CC4(C3)CCCCC4)ccc21 ZINC001138357011 1131493561 /nfs/dbraw/zinc/49/35/61/1131493561.db2.gz YEQJFGMMMWPVKI-UHFFFAOYSA-N 1 0 284.447 3.835 20 10 CHCDRO CN1CCCc2cc(C[N@H+](C)CC3CC(F)(F)C3)ccc21 ZINC001138356636 1131493712 /nfs/dbraw/zinc/49/37/12/1131493712.db2.gz UBDGPTFOHRHLKM-UHFFFAOYSA-N 1 0 294.389 3.546 20 10 CHCDRO CN1CCCc2cc(C[NH+]3C[C@H]4CCCC[C@@H]4C3)ccc21 ZINC001138354686 1131494179 /nfs/dbraw/zinc/49/41/79/1131494179.db2.gz PTVKESFNLJYYMK-QZTJIDSGSA-N 1 0 284.447 3.691 20 10 CHCDRO C[C@@H]1C[C@@H]([NH2+]Cc2ccc3ccccc3c2O)c2nccn21 ZINC000825016892 1131494348 /nfs/dbraw/zinc/49/43/48/1131494348.db2.gz ITYNWAIGYWEBLK-MLGOLLRUSA-N 1 0 293.370 3.538 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)Cc1cc(F)ccc1OC ZINC001138374898 1131495576 /nfs/dbraw/zinc/49/55/76/1131495576.db2.gz IAWBBOZZMLMQMZ-UHFFFAOYSA-N 1 0 289.350 3.562 20 10 CHCDRO Oc1c(C[NH2+]C[C@@H]2C[C@H]2C2CC2)ccc2ccccc21 ZINC000825250119 1131504664 /nfs/dbraw/zinc/50/46/64/1131504664.db2.gz VOGISXDBILWNJZ-RDJZCZTQSA-N 1 0 267.372 3.681 20 10 CHCDRO COC(C)(C)C[C@H](C)[NH2+]Cc1cc(Cl)c(C)cc1O ZINC000825316518 1131506887 /nfs/dbraw/zinc/50/68/87/1131506887.db2.gz VUQOQYHJBYHOEK-NSHDSACASA-N 1 0 285.815 3.647 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H](C)c2ccc[nH]2)cc1Cl ZINC000825390929 1131509121 /nfs/dbraw/zinc/50/91/21/1131509121.db2.gz NEWWHWPMNMXZCZ-JTQLQIEISA-N 1 0 264.756 3.533 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](C)[C@H](C)c2ccncc2)cc1Cl ZINC000825501300 1131513499 /nfs/dbraw/zinc/51/34/99/1131513499.db2.gz ODNGLMJKRRLTDD-GFCCVEGCSA-N 1 0 290.794 3.942 20 10 CHCDRO CCN(C)c1ccc(C[NH+]2CCC3(CC3(F)F)CC2)cc1 ZINC000844410402 1131559447 /nfs/dbraw/zinc/55/94/47/1131559447.db2.gz RCZUADUEYVUVCX-UHFFFAOYSA-N 1 0 294.389 3.764 20 10 CHCDRO CCCOc1ccc(C[NH2+][C@H](CO)C[C@@H](C)CC)cc1C ZINC001202922908 1131603161 /nfs/dbraw/zinc/60/31/61/1131603161.db2.gz VFHURSQBJGDPTP-YOEHRIQHSA-N 1 0 293.451 3.671 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+][C@H]2CNc3ccccc3C2)c(O)c1 ZINC000844919340 1131607402 /nfs/dbraw/zinc/60/74/02/1131607402.db2.gz FLFVBLVZUWGMNQ-GDBMZVCRSA-N 1 0 296.414 3.696 20 10 CHCDRO Cc1cc(C[N@@H+]2CC[C@@H]3CCC[C@@H]3C2)ccc1N(C)C ZINC001139671505 1131626698 /nfs/dbraw/zinc/62/66/98/1131626698.db2.gz XDKOWSAJNPVEBH-DLBZAZTESA-N 1 0 272.436 3.683 20 10 CHCDRO Cc1cc(C[N@H+]2C[C@H]3CC[C@@H](C2)C3(F)F)ccc1N(C)C ZINC001139669931 1131627048 /nfs/dbraw/zinc/62/70/48/1131627048.db2.gz DYDHMMWWVBUBDD-GASCZTMLSA-N 1 0 294.389 3.538 20 10 CHCDRO Oc1ccc(F)cc1C[NH+]1CCC2(CC[C@@H](F)C2)CC1 ZINC001140059215 1131660389 /nfs/dbraw/zinc/66/03/89/1131660389.db2.gz ZOXFBZNUCSKTHW-CQSZACIVSA-N 1 0 281.346 3.636 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CC[C@H](Oc3ccccc3)C2)c1O ZINC001140179082 1131673013 /nfs/dbraw/zinc/67/30/13/1131673013.db2.gz GPNDNQOCDSCIRY-KRWDZBQOSA-N 1 0 297.398 3.662 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCOC[C@@H]2c2ccccc2)c1O ZINC001140178140 1131673162 /nfs/dbraw/zinc/67/31/62/1131673162.db2.gz AIGWKNKAHQVDPF-GOSISDBHSA-N 1 0 297.398 3.583 20 10 CHCDRO COC[C@H](CC(C)(C)C)[NH2+][C@H](C)c1cc(OC)ccc1O ZINC000845970841 1131673843 /nfs/dbraw/zinc/67/38/43/1131673843.db2.gz DBEZWYLXMNTUDI-OLZOCXBDSA-N 1 0 295.423 3.503 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]C2(C3CCC3)CC2)cc1 ZINC000846056713 1131678796 /nfs/dbraw/zinc/67/87/96/1131678796.db2.gz YERQXLFTLADLLY-SNAWJCMRSA-N 1 0 270.420 3.688 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CC[C@@]2(C)C[C@@]2(F)Cl)cc1C ZINC000846032539 1131680869 /nfs/dbraw/zinc/68/08/69/1131680869.db2.gz AQENRVKWZAVGMS-GJZGRUSLSA-N 1 0 285.790 3.803 20 10 CHCDRO C[C@@H](CCCc1cccnc1)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000834496393 1131681051 /nfs/dbraw/zinc/68/10/51/1131681051.db2.gz GKFCMGQXXZXWIK-INIZCTEOSA-N 1 0 297.446 3.649 20 10 CHCDRO COc1ccc(CCC[NH2+][C@H]2CCc3cccc(O)c32)cc1 ZINC000834526793 1131682161 /nfs/dbraw/zinc/68/21/61/1131682161.db2.gz PEWSVRVWTWLPTJ-KRWDZBQOSA-N 1 0 297.398 3.611 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)CCCc2cccnc2)cc1C ZINC000834555206 1131683509 /nfs/dbraw/zinc/68/35/09/1131683509.db2.gz MTSOCFMQVNZUJR-INIZCTEOSA-N 1 0 298.430 3.900 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)[C@](C)(O)c1ccccc1)c1ccccc1O ZINC000846044040 1131683950 /nfs/dbraw/zinc/68/39/50/1131683950.db2.gz NKUKJLGRTLLUSH-LJHODMEESA-N 1 0 299.414 3.729 20 10 CHCDRO CC(C)n1cc([C@H](C)[NH2+][C@H]2CCc3cccc(O)c32)cn1 ZINC000834581916 1131684647 /nfs/dbraw/zinc/68/46/47/1131684647.db2.gz QYKSPHGAFFMKNU-WFASDCNBSA-N 1 0 285.391 3.508 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]C[C@H]1CCc3ccccc31)CC2 ZINC000834578537 1131684735 /nfs/dbraw/zinc/68/47/35/1131684735.db2.gz UCXVYKPBYHLKJV-WBVHZDCISA-N 1 0 279.383 3.699 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@]3(CC3(F)F)C2)cc1F ZINC000846107853 1131686612 /nfs/dbraw/zinc/68/66/12/1131686612.db2.gz LCPGCYMOBHORKH-OAHLLOKOSA-N 1 0 298.352 3.513 20 10 CHCDRO Cc1ccc(CC[C@@H](C)[NH2+][C@@H]2CCc3cccc(O)c32)o1 ZINC000834602546 1131686766 /nfs/dbraw/zinc/68/67/66/1131686766.db2.gz RYACVLIHSJGXFS-MLGOLLRUSA-N 1 0 285.387 3.892 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000846108786 1131687035 /nfs/dbraw/zinc/68/70/35/1131687035.db2.gz QFDLWPDAFZWOMA-ZDUSSCGKSA-N 1 0 287.737 3.667 20 10 CHCDRO Oc1c(C[NH2+]C2CC3(CCC3)C2)ccc2ccccc21 ZINC000846112453 1131687424 /nfs/dbraw/zinc/68/74/24/1131687424.db2.gz CSBKGRGZXWUZIB-UHFFFAOYSA-N 1 0 267.372 3.968 20 10 CHCDRO C[C@@H](C[NH2+][C@H]1CCc2cccc(O)c21)Cc1cccs1 ZINC000834603225 1131687732 /nfs/dbraw/zinc/68/77/32/1131687732.db2.gz XEGWGRMGZGWWON-DOMZBBRYSA-N 1 0 287.428 3.909 20 10 CHCDRO CCc1cccc(C[NH2+]Cc2cccc(C)c2O)c1 ZINC000846100097 1131689123 /nfs/dbraw/zinc/68/91/23/1131689123.db2.gz HAAAJCRXLQDUEV-UHFFFAOYSA-N 1 0 255.361 3.553 20 10 CHCDRO [O-]c1ccc(Cl)c(F)c1C[NH2+]C1CC2(CCC2)C1 ZINC000846106219 1131691465 /nfs/dbraw/zinc/69/14/65/1131691465.db2.gz CQFFYFYALFWQCQ-UHFFFAOYSA-N 1 0 269.747 3.607 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H](c2cccnc2)C2CC2)c1O ZINC000846157648 1131692138 /nfs/dbraw/zinc/69/21/38/1131692138.db2.gz NPXGVWZTQZSLSL-SJCJKPOMSA-N 1 0 298.386 3.598 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CCc2ccc(C)cc2)c1O ZINC000846153342 1131692152 /nfs/dbraw/zinc/69/21/52/1131692152.db2.gz XCXBSODYBZICRI-AWEZNQCLSA-N 1 0 285.387 3.603 20 10 CHCDRO CN(Cc1ccccc1O)Cc1cc(F)c(F)cc1Cl ZINC001144729362 1131692789 /nfs/dbraw/zinc/69/27/89/1131692789.db2.gz LWIPYHHBAHSXIX-UHFFFAOYSA-N 1 0 297.732 3.956 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]C2(c3ccccc3)CC2)c1O ZINC000846164611 1131692990 /nfs/dbraw/zinc/69/29/90/1131692990.db2.gz VLXOBUISJQEGDB-ZDUSSCGKSA-N 1 0 283.371 3.741 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CC(C)(C)C(C)C)c1O ZINC000846163444 1131693086 /nfs/dbraw/zinc/69/30/86/1131693086.db2.gz HRPYDYLKIFWLEW-GFCCVEGCSA-N 1 0 265.397 3.734 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]C2CCC(C(F)F)CC2)c1O ZINC000846170731 1131693596 /nfs/dbraw/zinc/69/35/96/1131693596.db2.gz ZAYVSIMSCIXPJH-VOMCLLRMSA-N 1 0 299.361 3.875 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H](C)c2ccccc2)c1O ZINC000846136541 1131693759 /nfs/dbraw/zinc/69/37/59/1131693759.db2.gz JVZXGRGCWSRFKB-STQMWFEESA-N 1 0 271.360 3.813 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H](C)CCC(C)C)c1O ZINC000846136191 1131693999 /nfs/dbraw/zinc/69/39/99/1131693999.db2.gz HGGOUBIUXKUPJC-STQMWFEESA-N 1 0 265.397 3.876 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CCCc2ccccc2)c1O ZINC000846137327 1131694204 /nfs/dbraw/zinc/69/42/04/1131694204.db2.gz NSOGBLAKWBFUDI-AWEZNQCLSA-N 1 0 285.387 3.684 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]Cc2sccc2C)c1O ZINC000846143704 1131694629 /nfs/dbraw/zinc/69/46/29/1131694629.db2.gz KIOWKOVHDRBDJH-LLVKDONJSA-N 1 0 277.389 3.622 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]Cc2ccc(F)cc2F)c1O ZINC000846141673 1131694698 /nfs/dbraw/zinc/69/46/98/1131694698.db2.gz MIOKFVPZIMEAAA-SNVBAGLBSA-N 1 0 293.313 3.530 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C2CC3(CCC3)C2)c(O)c1 ZINC000846210680 1131699022 /nfs/dbraw/zinc/69/90/22/1131699022.db2.gz BJHSHYOTHVSVCL-CYBMUJFWSA-N 1 0 259.393 3.992 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](C)COCC2CC2)cc1 ZINC000846203055 1131699724 /nfs/dbraw/zinc/69/97/24/1131699724.db2.gz DQCHRHRCYIMNGU-GJZGRUSLSA-N 1 0 290.451 3.608 20 10 CHCDRO CC[N@H+](Cc1[nH]nc2ccc(C)cc21)Cc1ccccc1O ZINC001140333696 1131701329 /nfs/dbraw/zinc/70/13/29/1131701329.db2.gz MZSFCXGADYKZNW-UHFFFAOYSA-N 1 0 295.386 3.599 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@@H]1CCOc3c(F)cccc31)CC2 ZINC000834779475 1131704443 /nfs/dbraw/zinc/70/44/43/1131704443.db2.gz MHLKCVFAVCJZAX-CABCVRRESA-N 1 0 299.345 3.632 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2cc(F)cnc2Cl)c(O)c1 ZINC000834836834 1131709915 /nfs/dbraw/zinc/70/99/15/1131709915.db2.gz PJMXBYWNAOOLAX-JTQLQIEISA-N 1 0 294.757 3.739 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2ccnc(C)c2)cc1 ZINC000834859923 1131713335 /nfs/dbraw/zinc/71/33/35/1131713335.db2.gz LYZZYDILGURISP-HNNXBMFYSA-N 1 0 283.419 3.697 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCOC3(CCC3)C2)c1 ZINC000834882650 1131716713 /nfs/dbraw/zinc/71/67/13/1131716713.db2.gz NJEFFEIJSDWJFF-GJZGRUSLSA-N 1 0 289.419 3.701 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2C[C@@H](C)n3ccnc32)c(O)c1 ZINC000834892114 1131720660 /nfs/dbraw/zinc/72/06/60/1131720660.db2.gz BCFAZLBYYYYQMT-HZSPNIEDSA-N 1 0 285.391 3.562 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@H]2C[C@H](C)n3ccnc32)c(O)c1 ZINC000834892115 1131721034 /nfs/dbraw/zinc/72/10/34/1131721034.db2.gz BCFAZLBYYYYQMT-IHRRRGAJSA-N 1 0 285.391 3.562 20 10 CHCDRO Cc1ccc(F)c(CC[NH2+][C@H]2CCc3cccc(O)c32)c1 ZINC000834895104 1131721619 /nfs/dbraw/zinc/72/16/19/1131721619.db2.gz YTLZAAMYDYKEBU-INIZCTEOSA-N 1 0 285.362 3.659 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1CCCC[C@H]1O)c1cc(Cl)ccc1O ZINC000834898669 1131723216 /nfs/dbraw/zinc/72/32/16/1131723216.db2.gz BANLWBSYWOJBDX-NILFDRSVSA-N 1 0 297.826 3.637 20 10 CHCDRO CCCc1ncc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)o1 ZINC000834898484 1131723302 /nfs/dbraw/zinc/72/33/02/1131723302.db2.gz DSCLVSDLDVDWGU-ZDUSSCGKSA-N 1 0 287.407 3.544 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H](C)[C@@H](OC)C2CC2)cc1 ZINC000834904443 1131728623 /nfs/dbraw/zinc/72/86/23/1131728623.db2.gz OEBQLHBVZGMQPP-PMUMKWKESA-N 1 0 290.451 3.607 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C2CCC(OC(F)F)CC2)c(O)c1 ZINC000834906759 1131728629 /nfs/dbraw/zinc/72/86/29/1131728629.db2.gz ZCVORCRPZIRTAA-HIFPTAJRSA-N 1 0 299.361 3.902 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H]2C[C@H]2C2CC2)c(O)c1 ZINC000834906146 1131729012 /nfs/dbraw/zinc/72/90/12/1131729012.db2.gz NCGSFXHZFHNVJF-SNPRPXQTSA-N 1 0 259.393 3.706 20 10 CHCDRO COCC1(C[NH2+][C@@H](C)c2cc(C)ccc2O)CCCC1 ZINC000834906270 1131729167 /nfs/dbraw/zinc/72/91/67/1131729167.db2.gz NUHKAAKNNBIGDY-AWEZNQCLSA-N 1 0 277.408 3.558 20 10 CHCDRO CC[C@H]([NH2+][C@H]1COCC1(C)C)c1cc(Cl)ccc1O ZINC000834905780 1131729190 /nfs/dbraw/zinc/72/91/90/1131729190.db2.gz WLOLUZLVYDYMRJ-JSGCOSHPSA-N 1 0 283.799 3.511 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CCc2ccc(C)cn2)cc1 ZINC000834908656 1131729891 /nfs/dbraw/zinc/72/98/91/1131729891.db2.gz GKIKZFOKZVLWQL-INIZCTEOSA-N 1 0 297.446 3.739 20 10 CHCDRO CCO[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000834910622 1131730615 /nfs/dbraw/zinc/73/06/15/1131730615.db2.gz FIVYMZSMPWHUEC-SGIREYDYSA-N 1 0 281.371 3.530 20 10 CHCDRO Cc1ccc(CC[NH2+][C@H](C)c2cc(Cl)ccc2O)nc1 ZINC000834908400 1131730999 /nfs/dbraw/zinc/73/09/99/1131730999.db2.gz DPLNFPPPFUEBDC-GFCCVEGCSA-N 1 0 290.794 3.642 20 10 CHCDRO CN(C)c1ccc(/C=C/C[N@H+](C)Cc2cccc(O)c2)cc1 ZINC000835025410 1131759563 /nfs/dbraw/zinc/75/95/63/1131759563.db2.gz STVNISYSFTUFPA-FNORWQNLSA-N 1 0 296.414 3.603 20 10 CHCDRO CN(C)c1ccc(/C=C\C[N@H+](C)CCOC(C)(C)C)cc1 ZINC000835027327 1131759946 /nfs/dbraw/zinc/75/99/46/1131759946.db2.gz CQJZKHYFRVXWSH-FPLPWBNLSA-N 1 0 290.451 3.513 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+][C@H]2CCCC(F)(F)C2)cc1 ZINC000835043853 1131762631 /nfs/dbraw/zinc/76/26/31/1131762631.db2.gz UIDREHKXJJULQD-RGDDUWESSA-N 1 0 294.389 3.933 20 10 CHCDRO CC[C@@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)c1ccncc1 ZINC000835039077 1131762808 /nfs/dbraw/zinc/76/28/08/1131762808.db2.gz ASPSFSAUWPNOJJ-ZMBJWTFHSA-N 1 0 295.430 3.902 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]CCC2CC(F)(F)C2)cc1 ZINC000835060677 1131767579 /nfs/dbraw/zinc/76/75/79/1131767579.db2.gz UNHLTVQUIGLGKM-ONEGZZNKSA-N 1 0 294.389 3.791 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CC[C@H]1C(C)C ZINC000796769993 1131789426 /nfs/dbraw/zinc/78/94/26/1131789426.db2.gz AOGOGFYNGZQGLM-DLBZAZTESA-N 1 0 260.425 3.585 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(OC)c(C)c1)[C@@H]1CC1(C)C ZINC001171285461 1131798620 /nfs/dbraw/zinc/79/86/20/1131798620.db2.gz AHICEYKJNGFTLC-LSDHHAIUSA-N 1 0 261.409 3.918 20 10 CHCDRO Cc1ccc(CC[N@@H+](C)Cc2cc(C)ccc2O)cc1 ZINC001140623079 1131831261 /nfs/dbraw/zinc/83/12/61/1131831261.db2.gz LCVTVOVEVZBACW-UHFFFAOYSA-N 1 0 269.388 3.684 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC[C@@H](Oc3ccccc3C)C2)c1 ZINC001140620905 1131831545 /nfs/dbraw/zinc/83/15/45/1131831545.db2.gz GAIXLOVFLYMJNH-QGZVFWFLSA-N 1 0 297.398 3.662 20 10 CHCDRO COc1cccc(CCC[N@H+](C)Cc2cc(C)ccc2O)c1 ZINC001140623385 1131833299 /nfs/dbraw/zinc/83/32/99/1131833299.db2.gz PEGLFAINKQAYJH-UHFFFAOYSA-N 1 0 299.414 3.774 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+](C)Cc2cccc(F)c2F)c1 ZINC001140623321 1131833410 /nfs/dbraw/zinc/83/34/10/1131833410.db2.gz LRAQFHZLJYUMNO-UHFFFAOYSA-N 1 0 277.314 3.611 20 10 CHCDRO CC[N@H+](Cc1ccc(C)cc1)Cc1ccc(O)c(C)c1O ZINC001140748163 1131906715 /nfs/dbraw/zinc/90/67/15/1131906715.db2.gz STTWYDSAMRNLRZ-UHFFFAOYSA-N 1 0 285.387 3.737 20 10 CHCDRO CC[C@@H]([NH2+]CC1(C)CCOCC1)c1ccc(N(C)C)cc1 ZINC000773044790 1131929463 /nfs/dbraw/zinc/92/94/63/1131929463.db2.gz RWBWCBBOPUESNW-QGZVFWFLSA-N 1 0 290.451 3.610 20 10 CHCDRO CC[C@H]([NH2+][C@@H](CO)CC(C)(C)C)c1ccc(N(C)C)cc1 ZINC000773076945 1131937298 /nfs/dbraw/zinc/93/72/98/1131937298.db2.gz PJEJCDHRNYVWOK-WBVHZDCISA-N 1 0 292.467 3.590 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H](C)C2CCC2)cc1 ZINC000773105790 1131946329 /nfs/dbraw/zinc/94/63/29/1131946329.db2.gz QWRJYDOHXWKIFQ-KGLIPLIRSA-N 1 0 260.425 3.982 20 10 CHCDRO CC[C@H]([NH2+]CC1(C2CC2)CC1)c1ccc(N(C)C)cc1 ZINC000773098573 1131946567 /nfs/dbraw/zinc/94/65/67/1131946567.db2.gz MRNAIDLIWNFSIT-KRWDZBQOSA-N 1 0 272.436 3.984 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCCC[C@@H]2C)c(O)c1 ZINC001140851360 1131947223 /nfs/dbraw/zinc/94/72/23/1131947223.db2.gz IOLRSZOQVYPCML-AWEZNQCLSA-N 1 0 276.424 3.613 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H](CF)C2)c(Cl)c1 ZINC001140926004 1131966231 /nfs/dbraw/zinc/96/62/31/1131966231.db2.gz XAWFYASJTIOTCT-LBPRGKRZSA-N 1 0 284.806 3.588 20 10 CHCDRO Cc1ccc(C[N@@H+]2CCSC[C@@H]2c2ccccc2)c(O)c1 ZINC001140950836 1131971941 /nfs/dbraw/zinc/97/19/41/1131971941.db2.gz KJFOFZQMWYTRBM-QGZVFWFLSA-N 1 0 299.439 3.991 20 10 CHCDRO Cc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(C)nc2)c(O)c1 ZINC001140958358 1131974138 /nfs/dbraw/zinc/97/41/38/1131974138.db2.gz YZKOLBAYWWTMRE-QGZVFWFLSA-N 1 0 282.387 3.741 20 10 CHCDRO Cc1ccc(CN2Cc3ccc(Cl)cc3C2)c(O)c1 ZINC001140957533 1131974245 /nfs/dbraw/zinc/97/42/45/1131974245.db2.gz CWJPHVKVBQFKBY-UHFFFAOYSA-N 1 0 273.763 3.870 20 10 CHCDRO C[C@H]([NH2+][C@H]1CC12CC2)c1ccc2ccccc2c1O ZINC000715220332 1131980814 /nfs/dbraw/zinc/98/08/14/1131980814.db2.gz AKTUDJAGSGGHIL-NHYWBVRUSA-N 1 0 253.345 3.749 20 10 CHCDRO CC[C@H]([NH2+]CC[C@@H]1CCCS1)c1ccccc1O ZINC000715697804 1131990857 /nfs/dbraw/zinc/99/08/57/1131990857.db2.gz QLFKQEPUCUHSHK-JSGCOSHPSA-N 1 0 265.422 3.719 20 10 CHCDRO c1c(C[N@@H+]2CC3CCC2CC3)cc2c3c1CCCN3CCC2 ZINC001141075878 1132005146 /nfs/dbraw/zinc/00/51/46/1132005146.db2.gz DYRJWVLMFMKQET-UHFFFAOYSA-N 1 0 296.458 3.760 20 10 CHCDRO CC[C@@H](CSC)[N@H+](C)Cc1c(O)ccc2ccncc21 ZINC000773257493 1132012817 /nfs/dbraw/zinc/01/28/17/1132012817.db2.gz YERDLTGCFSGWAF-ZDUSSCGKSA-N 1 0 290.432 3.514 20 10 CHCDRO CCC1(C[NH2+]Cc2ccc(N3CCCC3)cc2)CCC1 ZINC000227762539 1132016842 /nfs/dbraw/zinc/01/68/42/1132016842.db2.gz GEPKCMWDTVPSJJ-UHFFFAOYSA-N 1 0 272.436 3.957 20 10 CHCDRO CC(C)C[N@H+](Cc1ccccc1)Cc1cc(O)ccc1O ZINC001141156329 1132029137 /nfs/dbraw/zinc/02/91/37/1132029137.db2.gz JNJFAJHUJWGQHC-UHFFFAOYSA-N 1 0 285.387 3.756 20 10 CHCDRO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2cc(O)ccc2O)c1 ZINC001141156034 1132030014 /nfs/dbraw/zinc/03/00/14/1132030014.db2.gz OTXBYBVPBBKWJJ-KRWDZBQOSA-N 1 0 283.371 3.743 20 10 CHCDRO Oc1ccc(O)c(C[N@@H+]2CCC[C@H]2c2cccc(F)c2)c1 ZINC001141159467 1132031541 /nfs/dbraw/zinc/03/15/41/1132031541.db2.gz GVXIDZIHONNCJZ-INIZCTEOSA-N 1 0 287.334 3.574 20 10 CHCDRO Cc1cccc2c1CC[C@H]([N@@H+]1CCc3cccc(O)c3C1)C2 ZINC001171572193 1132058884 /nfs/dbraw/zinc/05/88/84/1132058884.db2.gz ABTMTTNVWGLVKX-KRWDZBQOSA-N 1 0 293.410 3.616 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2CSc3ccccc3C2)cc1 ZINC001172196801 1132147762 /nfs/dbraw/zinc/14/77/62/1132147762.db2.gz LPWUSTVBMNPISS-INIZCTEOSA-N 1 0 298.455 3.559 20 10 CHCDRO CC[C@@H](C)OCC[C@@H](C)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC001172343663 1132177822 /nfs/dbraw/zinc/17/78/22/1132177822.db2.gz RAEXGAUOFMLIRH-OAGGEKHMSA-N 1 0 292.467 3.997 20 10 CHCDRO CC[C@@H](C)OCC[C@H](C)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC001172343682 1132178439 /nfs/dbraw/zinc/17/84/39/1132178439.db2.gz RAEXGAUOFMLIRH-XHSDSOJGSA-N 1 0 292.467 3.997 20 10 CHCDRO Cc1cc(C)c(C[NH2+][C@@H]2CC[C@H](C)[C@@H](C)C2)c(O)c1 ZINC001172368501 1132192967 /nfs/dbraw/zinc/19/29/67/1132192967.db2.gz PFELYSXSEYBARQ-KCQAQPDRSA-N 1 0 261.409 3.923 20 10 CHCDRO CC(C)OCC[C@H](C)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC001172444865 1132235784 /nfs/dbraw/zinc/23/57/84/1132235784.db2.gz ZMCNJTKPMNDOJH-GJZGRUSLSA-N 1 0 278.440 3.607 20 10 CHCDRO Oc1ccc(C[NH2+][C@H]2CCC[C@@H](c3ccccc3)C2)cc1O ZINC001172541264 1132277168 /nfs/dbraw/zinc/27/71/68/1132277168.db2.gz VWZMTCJHFKFCMQ-SJORKVTESA-N 1 0 297.398 3.914 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)nc1C ZINC000840783288 1132286962 /nfs/dbraw/zinc/28/69/62/1132286962.db2.gz IMLLVVWRQZFRDI-HNNXBMFYSA-N 1 0 284.403 3.872 20 10 CHCDRO COCC[C@@H](C)C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000840834926 1132292202 /nfs/dbraw/zinc/29/22/02/1132292202.db2.gz BXORWWTVASCCNA-ZIAGYGMSSA-N 1 0 287.403 3.869 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H]2C[C@H](C)O[C@H]2C)cc1 ZINC000840874173 1132299518 /nfs/dbraw/zinc/29/95/18/1132299518.db2.gz XUAUEIJAXYWEJK-JKQORVJESA-N 1 0 290.451 3.607 20 10 CHCDRO COCC1CCC([NH2+][C@@H](C)c2cc(C)ccc2O)CC1 ZINC000840879329 1132300505 /nfs/dbraw/zinc/30/05/05/1132300505.db2.gz DWPNJGBBZXQLJG-NFOMZHRRSA-N 1 0 277.408 3.556 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC(C)(C)c2cccnc2)c(O)c1 ZINC000840892477 1132304794 /nfs/dbraw/zinc/30/47/94/1132304794.db2.gz UBFLVIQEATVXBD-CQSZACIVSA-N 1 0 284.403 3.724 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H]2CC=CCC2)c(Cl)c1 ZINC000840899218 1132306455 /nfs/dbraw/zinc/30/64/55/1132306455.db2.gz MBIGZSCGXUBCGR-NSHDSACASA-N 1 0 251.757 3.552 20 10 CHCDRO CSC(C)(C)C[NH2+]Cc1c(O)cc(C)cc1Cl ZINC000840903041 1132306977 /nfs/dbraw/zinc/30/69/77/1132306977.db2.gz YIXSUDHITCEBGX-UHFFFAOYSA-N 1 0 273.829 3.585 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)CCC2CCOCC2)c(Cl)c1 ZINC000840917439 1132307078 /nfs/dbraw/zinc/30/70/78/1132307078.db2.gz KRYXPWNPVBPZNN-UHFFFAOYSA-N 1 0 297.826 3.603 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@@H]2CCCC2(F)F)c(Cl)c1 ZINC000840951301 1132311567 /nfs/dbraw/zinc/31/15/67/1132311567.db2.gz VVMWFEJZMYSKQH-JTQLQIEISA-N 1 0 289.753 3.879 20 10 CHCDRO Cc1csc(C[NH2+]Cc2ccc(N(C)C)cc2C)c1 ZINC000840950270 1132311897 /nfs/dbraw/zinc/31/18/97/1132311897.db2.gz GODPSAGOBPIRCC-UHFFFAOYSA-N 1 0 274.433 3.721 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CC[C@@H]2CCO[C@H](C)C2)c(Cl)c1 ZINC000840939981 1132312355 /nfs/dbraw/zinc/31/23/55/1132312355.db2.gz STBZBFGGYBEARX-CHWSQXEVSA-N 1 0 297.826 3.649 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)[C@H]2CC2(F)F)cc1 ZINC000840965300 1132314206 /nfs/dbraw/zinc/31/42/06/1132314206.db2.gz BRXOLHJSLBIEMS-SWLSCSKDSA-N 1 0 282.378 3.666 20 10 CHCDRO Oc1ccc2ccccc2c1C[NH+]1CC2(CCC2)C1 ZINC001231586150 1132317075 /nfs/dbraw/zinc/31/70/75/1132317075.db2.gz BORVAGXJWIEVCB-UHFFFAOYSA-N 1 0 253.345 3.531 20 10 CHCDRO COc1cccc([C@@H]2C[C@H]2C[NH2+]Cc2cccc(C)c2O)c1 ZINC000840973629 1132317452 /nfs/dbraw/zinc/31/74/52/1132317452.db2.gz RXXRYBSJIDMNPP-WMZOPIPTSA-N 1 0 297.398 3.603 20 10 CHCDRO C[C@H]1C[N@H+](Cc2c(O)ccc3ccccc32)CCC[C@@]1(C)O ZINC001231586954 1132317832 /nfs/dbraw/zinc/31/78/32/1132317832.db2.gz NTLNOTIRAQHSDX-IFXJQAMLSA-N 1 0 299.414 3.528 20 10 CHCDRO Oc1ccc2ccccc2c1C[NH+]1CCC2(CC2)CC1 ZINC001231587605 1132319110 /nfs/dbraw/zinc/31/91/10/1132319110.db2.gz WKJBIDINHNJPFW-UHFFFAOYSA-N 1 0 267.372 3.921 20 10 CHCDRO Cc1cccc(C[NH2+]C[C@@H](N)c2ccc(C(C)C)cc2)c1O ZINC000841034258 1132321199 /nfs/dbraw/zinc/32/11/99/1132321199.db2.gz BXCCGOVJAVLVMK-GOSISDBHSA-N 1 0 298.430 3.614 20 10 CHCDRO C[C@@H]([NH3+])c1ccc(NC/C=C/c2ccc(N(C)C)cc2)cc1 ZINC000841031033 1132321442 /nfs/dbraw/zinc/32/14/42/1132321442.db2.gz OAJDXRJAYUJXLY-MBVDDHJVSA-N 1 0 295.430 3.898 20 10 CHCDRO CC[N@H+](Cc1ccccc1F)Cc1cccc(C)c1O ZINC001231593930 1132321885 /nfs/dbraw/zinc/32/18/85/1132321885.db2.gz PAJIUFIKHCZDFY-UHFFFAOYSA-N 1 0 273.351 3.862 20 10 CHCDRO COc1ccccc1[C@@H](C)[N@H+](C)Cc1cccc(C)c1O ZINC001231594194 1132321910 /nfs/dbraw/zinc/32/19/10/1132321910.db2.gz WBJZRCRTTUDFHE-CQSZACIVSA-N 1 0 285.387 3.902 20 10 CHCDRO CC[C@@H](C[NH2+]CCc1ccc(N)cc1)c1ccccc1 ZINC000841035322 1132322095 /nfs/dbraw/zinc/32/20/95/1132322095.db2.gz MMPOYNUDYIYEFM-INIZCTEOSA-N 1 0 268.404 3.595 20 10 CHCDRO Cc1ccc(C[NH2+]CCc2ccc(N)cc2)cc1Cl ZINC000841038658 1132323630 /nfs/dbraw/zinc/32/36/30/1132323630.db2.gz NBUYFAFQRSGGKW-UHFFFAOYSA-N 1 0 274.795 3.563 20 10 CHCDRO C[NH2+]Cc1ccc(NC/C=C\c2ccc(N(C)C)cc2)cc1 ZINC000841069763 1132324524 /nfs/dbraw/zinc/32/45/24/1132324524.db2.gz DLFBBWALESSSBS-PLNGDYQASA-N 1 0 295.430 3.597 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H]2CCCc3cc(N)ccc32)cc1C ZINC000841057326 1132324626 /nfs/dbraw/zinc/32/46/26/1132324626.db2.gz GCGDKCIIYAWVMV-GOSISDBHSA-N 1 0 296.414 3.758 20 10 CHCDRO Cc1cc(C)c(C[NH+]2CCC3(CCC3)CC2)c(O)c1 ZINC001231843322 1132375794 /nfs/dbraw/zinc/37/57/94/1132375794.db2.gz VUSJAEBNCBVYKN-UHFFFAOYSA-N 1 0 259.393 3.775 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CC[C@@H](c3ccccc3)C2)c(O)c1 ZINC001231842130 1132377348 /nfs/dbraw/zinc/37/73/48/1132377348.db2.gz KAKKLQQDGPULJJ-QGZVFWFLSA-N 1 0 281.399 3.999 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CC[C@@H](Oc3ccccc3)C2)c(O)c1 ZINC001231843851 1132377365 /nfs/dbraw/zinc/37/73/65/1132377365.db2.gz BZAMKOJKKKLSKY-QGZVFWFLSA-N 1 0 297.398 3.662 20 10 CHCDRO COc1cc(N(C)C)ccc1C[N@@H+]1CCCCC[C@@H]1C ZINC001231853029 1132377799 /nfs/dbraw/zinc/37/77/99/1132377799.db2.gz RAUTVVJVLJONHD-AWEZNQCLSA-N 1 0 276.424 3.526 20 10 CHCDRO Cc1cc(C)c(C[N@H+](C)Cc2ccccc2C)c(O)c1 ZINC001231843868 1132378353 /nfs/dbraw/zinc/37/83/53/1132378353.db2.gz CFGBVIBKIXRION-UHFFFAOYSA-N 1 0 269.388 3.949 20 10 CHCDRO COc1cc(N(C)C)ccc1C[N@H+](C)C1CCCCC1 ZINC001231847989 1132378370 /nfs/dbraw/zinc/37/83/70/1132378370.db2.gz CZSAQVPPBZGXTN-UHFFFAOYSA-N 1 0 276.424 3.526 20 10 CHCDRO COc1cc(N(C)C)ccc1C[N@@H+]1CCCC2(CCC2)C1 ZINC001231857929 1132380627 /nfs/dbraw/zinc/38/06/27/1132380627.db2.gz OTZVJTZCXOLRPF-UHFFFAOYSA-N 1 0 288.435 3.527 20 10 CHCDRO COc1cc(N(C)C)ccc1C[NH+]1C2CCCC1CCC2 ZINC001231858097 1132382430 /nfs/dbraw/zinc/38/24/30/1132382430.db2.gz SEZYOSJRVNHIOC-UHFFFAOYSA-N 1 0 288.435 3.668 20 10 CHCDRO COc1cccc(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)c1 ZINC000841743036 1132387367 /nfs/dbraw/zinc/38/73/67/1132387367.db2.gz BOQYKROFVCNABJ-NSHDSACASA-N 1 0 291.778 3.905 20 10 CHCDRO C[C@H]([NH2+]CCC(C)(F)F)c1ccc(Cl)cc1O ZINC000841758981 1132394456 /nfs/dbraw/zinc/39/44/56/1132394456.db2.gz WLQLESLBKIVNJL-QMMMGPOBSA-N 1 0 263.715 3.742 20 10 CHCDRO CC(C)SCC[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841752398 1132390239 /nfs/dbraw/zinc/39/02/39/1132390239.db2.gz AJFHQGNQWXBRRC-JTQLQIEISA-N 1 0 273.829 3.838 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCC(F)(F)C1)c1ccc(Cl)cc1O ZINC000841749900 1132390347 /nfs/dbraw/zinc/39/03/47/1132390347.db2.gz JMPCZQXMDCFORQ-WPRPVWTQSA-N 1 0 275.726 3.884 20 10 CHCDRO COC[C@@H]1CCCC[N@@H+]1Cc1ccc2ccccc2c1O ZINC001231879712 1132390947 /nfs/dbraw/zinc/39/09/47/1132390947.db2.gz PIHIDEYKOJAULQ-INIZCTEOSA-N 1 0 285.387 3.546 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCC(C)(C)O1)c1ccc(Cl)cc1O ZINC000841751762 1132391311 /nfs/dbraw/zinc/39/13/11/1132391311.db2.gz IZISXESKBINDPY-CMPLNLGQSA-N 1 0 283.799 3.654 20 10 CHCDRO CO[C@@](C)([C@H](C)[NH2+][C@@H](C)c1ccc(Cl)cc1O)C1CC1 ZINC000841756511 1132392909 /nfs/dbraw/zinc/39/29/09/1132392909.db2.gz WNNVADQODZLWHW-MMPTUQATSA-N 1 0 297.826 3.900 20 10 CHCDRO C[C@@H]([NH2+]CC(C)(C)OCC1CC1)c1ccc(Cl)cc1O ZINC000841755358 1132393066 /nfs/dbraw/zinc/39/30/66/1132393066.db2.gz JNCGDGMDWJJQIU-LLVKDONJSA-N 1 0 297.826 3.901 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccc[nH]1)c1ccc(Cl)cc1O ZINC000841753301 1132393078 /nfs/dbraw/zinc/39/30/78/1132393078.db2.gz YRCKOFKCFQTDQN-ZJUUUORDSA-N 1 0 264.756 3.786 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2COCc3ccccc32)c(O)c1 ZINC000841759840 1132393283 /nfs/dbraw/zinc/39/32/83/1132393283.db2.gz IUVMASVQXHQDOB-CXAGYDPISA-N 1 0 283.371 3.623 20 10 CHCDRO CC[C@@](C)(C[NH2+][C@H](C)c1ccc(Cl)cc1O)OC ZINC000841759016 1132393860 /nfs/dbraw/zinc/39/38/60/1132393860.db2.gz WXEKQMWKJXHUQM-YGRLFVJLSA-N 1 0 271.788 3.511 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@H]2COCc3ccccc32)c(O)c1 ZINC000841759382 1132394828 /nfs/dbraw/zinc/39/48/28/1132394828.db2.gz FLMRVNFUHTZGRJ-YOEHRIQHSA-N 1 0 297.398 3.931 20 10 CHCDRO Oc1cc(O)c(C[N@@H+]2CCC[C@H]3CCCC[C@@H]32)cc1Cl ZINC001232263263 1132445131 /nfs/dbraw/zinc/44/51/31/1132445131.db2.gz MEMHKEJRXYANLM-RISCZKNCSA-N 1 0 295.810 3.906 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C2(c3ccccc3C)CC2)c1 ZINC000842731911 1132455638 /nfs/dbraw/zinc/45/56/38/1132455638.db2.gz DDSLBGKYPTWGRT-UHFFFAOYSA-N 1 0 267.372 3.788 20 10 CHCDRO CC[C@H](C)C[C@H](CO)[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000842915908 1132475937 /nfs/dbraw/zinc/47/59/37/1132475937.db2.gz HWKSZKIMKSSULO-BJJXKVORSA-N 1 0 279.424 3.538 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2CCS[C@H]2C)c1O ZINC000842928825 1132477720 /nfs/dbraw/zinc/47/77/20/1132477720.db2.gz LTXWLLBKQZJTDO-KWBADKCTSA-N 1 0 285.840 3.899 20 10 CHCDRO CC(C)(C)c1cccc(C[N@@H+]2CC[C@@](C)(F)[C@H](F)C2)c1O ZINC001143104537 1132501630 /nfs/dbraw/zinc/50/16/30/1132501630.db2.gz UXSAGVYWKWBGDZ-RHSMWYFYSA-N 1 0 297.389 3.962 20 10 CHCDRO CC[N@H+](Cc1cccc(C(C)(C)C)c1O)C1CCOCC1 ZINC001143110978 1132503178 /nfs/dbraw/zinc/50/31/78/1132503178.db2.gz UIVXTLJFQUZGBW-UHFFFAOYSA-N 1 0 291.435 3.691 20 10 CHCDRO CO[C@H]1CCC[N@H+](Cc2cccc(C(C)(C)C)c2O)CC1 ZINC001143112620 1132504735 /nfs/dbraw/zinc/50/47/35/1132504735.db2.gz XQILYEQJZIETFN-HNNXBMFYSA-N 1 0 291.435 3.691 20 10 CHCDRO CCCC[NH+](CCCC)Cc1ccc(N(C)C)cc1O ZINC001232840234 1132528514 /nfs/dbraw/zinc/52/85/14/1132528514.db2.gz QGWCCVAJTCTXCT-UHFFFAOYSA-N 1 0 278.440 3.860 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H]2c2ccccc2)c(O)c1 ZINC001232838442 1132528724 /nfs/dbraw/zinc/52/87/24/1132528724.db2.gz FPZGUFVNFGHHED-GOSISDBHSA-N 1 0 296.414 3.795 20 10 CHCDRO Cc1cccc(C[NH2+]C[C@H]2C[C@@H]2c2ccccc2)c1O ZINC000843420164 1132530044 /nfs/dbraw/zinc/53/00/44/1132530044.db2.gz OREOIURENSCYKQ-IAGOWNOFSA-N 1 0 267.372 3.594 20 10 CHCDRO Cc1ccc(C[N@@H+](Cc2ccccc2O)CC2CC2)cn1 ZINC000843423390 1132533761 /nfs/dbraw/zinc/53/37/61/1132533761.db2.gz NDWVXABDSRJPJU-UHFFFAOYSA-N 1 0 282.387 3.508 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCC[C@H]3CCCC[C@@H]32)c1 ZINC000132383052 1132582200 /nfs/dbraw/zinc/58/22/00/1132582200.db2.gz GYJLSXKQXNQORD-ZBFHGGJFSA-N 1 0 259.393 3.855 20 10 CHCDRO CC[C@@H]1CC[N@H+](Cc2cc(C(C)(C)C)ccc2O)C1 ZINC001233287327 1132596813 /nfs/dbraw/zinc/59/68/13/1132596813.db2.gz JWNXQIKYOJFMIL-CYBMUJFWSA-N 1 0 261.409 3.922 20 10 CHCDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CCC[C@@H]2CF)c1 ZINC001233287314 1132597614 /nfs/dbraw/zinc/59/76/14/1132597614.db2.gz IMQRKLMTPSFJAT-CQSZACIVSA-N 1 0 265.372 3.624 20 10 CHCDRO C[C@H]1C[N@H+](Cc2ccc(C(F)(F)F)cc2O)C2(CC2)C1 ZINC001233455191 1132624497 /nfs/dbraw/zinc/62/44/97/1132624497.db2.gz ACUHRMLCZPTYKU-SNVBAGLBSA-N 1 0 285.309 3.785 20 10 CHCDRO Oc1cc(C(F)(F)F)ccc1C[NH+]1CCC2(CC2)CC1 ZINC001233452488 1132626198 /nfs/dbraw/zinc/62/61/98/1132626198.db2.gz YLUGGOMBDMDRIC-UHFFFAOYSA-N 1 0 285.309 3.787 20 10 CHCDRO CC1CC([N@H+](C)Cc2cccc(OC(F)(F)F)c2O)C1 ZINC001233728708 1132671702 /nfs/dbraw/zinc/67/17/02/1132671702.db2.gz YZSALMRSMRODGS-UHFFFAOYSA-N 1 0 289.297 3.521 20 10 CHCDRO CC(C)Oc1cc[nH+]c(N(C)Cc2ccc(N(C)C)cc2)c1 ZINC001156920430 1132714971 /nfs/dbraw/zinc/71/49/71/1132714971.db2.gz DYHDOSHYSUVZTP-UHFFFAOYSA-N 1 0 299.418 3.571 20 10 CHCDRO Nc1ccc(Nc2cccc(C[NH+]3CCCCC3)c2)cc1 ZINC001159485597 1132853657 /nfs/dbraw/zinc/85/36/57/1132853657.db2.gz NJMTXQLWHOXYPA-UHFFFAOYSA-N 1 0 281.403 3.998 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2CC[C@H](C(C)C)C2)c(Cl)c1 ZINC001204390149 1133217801 /nfs/dbraw/zinc/21/78/01/1133217801.db2.gz RDXCFJXRJUMRCA-LBPRGKRZSA-N 1 0 267.800 3.832 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2CC[C@@H](C(C)C)C2)c(Cl)c1 ZINC001204390147 1133218552 /nfs/dbraw/zinc/21/85/52/1133218552.db2.gz RDXCFJXRJUMRCA-GFCCVEGCSA-N 1 0 267.800 3.832 20 10 CHCDRO C[N@H+](Cc1ccccc1)Cc1ccc(N2CCCC2)cc1 ZINC001203312461 1133313723 /nfs/dbraw/zinc/31/37/23/1133313723.db2.gz FPIXCESLMOAYLN-UHFFFAOYSA-N 1 0 280.415 3.919 20 10 CHCDRO COc1ccc2c(c1)[nH+]ccc2N(C)c1ccc(N)cc1 ZINC001203528553 1133337296 /nfs/dbraw/zinc/33/72/96/1133337296.db2.gz ROKIKVHRBMZODH-UHFFFAOYSA-N 1 0 279.343 3.594 20 10 CHCDRO CC[N@H+](Cc1ccc(F)cc1)Cc1cccc(OC)c1O ZINC001203596632 1133343727 /nfs/dbraw/zinc/34/37/27/1133343727.db2.gz MOSHUPXMTMPWSU-UHFFFAOYSA-N 1 0 289.350 3.562 20 10 CHCDRO CCOc1cccc(C[N@H+](C)CCc2ccc(C)cc2)c1O ZINC001203609413 1133344271 /nfs/dbraw/zinc/34/42/71/1133344271.db2.gz RTCLFJZYVILRJX-UHFFFAOYSA-N 1 0 299.414 3.774 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@@H](C(F)F)C1 ZINC001203657423 1133349048 /nfs/dbraw/zinc/34/90/48/1133349048.db2.gz KWPGIFOOWDZPCE-SECBINFHSA-N 1 0 275.726 3.523 20 10 CHCDRO COc1ccc(O)c(C[N@H+](C)C/C=C/c2ccccc2)c1 ZINC001203680306 1133353070 /nfs/dbraw/zinc/35/30/70/1133353070.db2.gz NXUXPVCBOFQGBW-RMKNXTFCSA-N 1 0 283.371 3.546 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]C2CCC=CCC2)cc1 ZINC001203721611 1133358725 /nfs/dbraw/zinc/35/87/25/1133358725.db2.gz PYNALPPFWZUVNA-BQYQJAHWSA-N 1 0 270.420 3.854 20 10 CHCDRO Oc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)cc1O ZINC001203875557 1133378013 /nfs/dbraw/zinc/37/80/13/1133378013.db2.gz PVTUVOSCZUGPRM-HNNXBMFYSA-N 1 0 287.334 3.574 20 10 CHCDRO CCC[C@H]1CCCC[N@@H+]1Cc1ccc(N(C)C)cc1 ZINC001203933697 1133386022 /nfs/dbraw/zinc/38/60/22/1133386022.db2.gz GIYGQLGFHGMLOQ-KRWDZBQOSA-N 1 0 260.425 3.907 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CC[C@@H](Cc3ccccc3)C2)cc1 ZINC001203934099 1133386203 /nfs/dbraw/zinc/38/62/03/1133386203.db2.gz MFDOHRLWFZSINE-IBGZPJMESA-N 1 0 294.442 3.817 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H](CF)C2)cc1 ZINC001203939842 1133386263 /nfs/dbraw/zinc/38/62/63/1133386263.db2.gz WSJUEKWYRJGLLP-INIZCTEOSA-N 1 0 278.415 3.714 20 10 CHCDRO CCCO[C@@H]1CC[N@H+](Cc2ccc(N(CC)CC)cc2)C1 ZINC001203939011 1133386394 /nfs/dbraw/zinc/38/63/94/1133386394.db2.gz IRTIUJMRSLYUTP-GOSISDBHSA-N 1 0 290.451 3.534 20 10 CHCDRO CCc1ccc(C[N@@H+](CC)Cc2ccccc2O)cc1 ZINC001204178423 1133416129 /nfs/dbraw/zinc/41/61/29/1133416129.db2.gz QDPYUZNAQJNDKD-UHFFFAOYSA-N 1 0 269.388 3.977 20 10 CHCDRO Oc1ccc(C[N@@H+]2CCC[C@@H]2C2CCCCC2)c(O)c1 ZINC001204281501 1133428757 /nfs/dbraw/zinc/42/87/57/1133428757.db2.gz SEGTYJJOWQWMLB-MRXNPFEDSA-N 1 0 275.392 3.643 20 10 CHCDRO C[C@H]1CCCC[N@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001204324951 1133438421 /nfs/dbraw/zinc/43/84/21/1133438421.db2.gz PQNVKNAJYDXEAZ-INIZCTEOSA-N 1 0 272.436 3.909 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC001204887940 1133496403 /nfs/dbraw/zinc/49/64/03/1133496403.db2.gz CRDDQXWSOWFBGJ-YJBOKZPZSA-N 1 0 272.436 3.826 20 10 CHCDRO Cc1ccc(C[N@H+]2C[C@H](C)[C@H]3CCCC[C@@H]32)c(O)c1 ZINC001204961964 1133508446 /nfs/dbraw/zinc/50/84/46/1133508446.db2.gz YFSOGHVOCKUOSA-IMJJTQAJSA-N 1 0 259.393 3.711 20 10 CHCDRO COc1cc(C)c(C[N@H+](C)[C@H]2CCc3ccccc32)c(O)c1 ZINC001205185051 1133543256 /nfs/dbraw/zinc/54/32/56/1133543256.db2.gz JFNHCXQBSPKPQD-SFHVURJKSA-N 1 0 297.398 3.829 20 10 CHCDRO COc1cc(C)cc(C[NH2+]C[C@H](C)c2ccccc2)c1O ZINC001205277663 1133554013 /nfs/dbraw/zinc/55/40/13/1133554013.db2.gz SDDFCHSHIAEZEJ-AWEZNQCLSA-N 1 0 285.387 3.603 20 10 CHCDRO C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(N(C)C)cc2)C[C@@H]1C ZINC000084982618 1133582888 /nfs/dbraw/zinc/58/28/88/1133582888.db2.gz CZWPGJGUZXFQSP-IJEWVQPXSA-N 1 0 260.425 3.667 20 10 CHCDRO CC[C@@H]1[C@@H](C)CC[N@@H+]1C/C=C\c1ccc(N(C)C)cc1 ZINC001205489427 1133583067 /nfs/dbraw/zinc/58/30/67/1133583067.db2.gz QGWQXIDOALEZCZ-ZNUVNQELSA-N 1 0 272.436 3.886 20 10 CHCDRO Cc1ccoc1C[N@@H+](C)Cc1ccc(Cl)cc1O ZINC001205997650 1133640209 /nfs/dbraw/zinc/64/02/09/1133640209.db2.gz CDVPQMAREPTQNP-UHFFFAOYSA-N 1 0 265.740 3.579 20 10 CHCDRO Cc1ccc(C[NH2+]C[C@@H](c2ccccc2)C2CC2)c(O)c1 ZINC001205999081 1133640351 /nfs/dbraw/zinc/64/03/51/1133640351.db2.gz VBJFKIDSXPTWSB-SFHVURJKSA-N 1 0 281.399 3.984 20 10 CHCDRO Oc1c(C[NH2+]CCOCC2CCCC2)ccc2ccccc21 ZINC001206151162 1133664733 /nfs/dbraw/zinc/66/47/33/1133664733.db2.gz LAQOCRZSRHGDMO-UHFFFAOYSA-N 1 0 299.414 3.842 20 10 CHCDRO CCCCCOC1C[NH+](Cc2ccc3ccccc3c2O)C1 ZINC001206173823 1133667568 /nfs/dbraw/zinc/66/75/68/1133667568.db2.gz BSPYTZHQRHLUOA-UHFFFAOYSA-N 1 0 299.414 3.936 20 10 CHCDRO CCC[N@H+](C/C=C/c1ccc(N(C)C)cc1)C(C)C ZINC001206464713 1133705446 /nfs/dbraw/zinc/70/54/46/1133705446.db2.gz VGNBGRYHCVEBOV-BQYQJAHWSA-N 1 0 260.425 3.886 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)Cc1ccc(C)cc1OC ZINC001206783197 1133747891 /nfs/dbraw/zinc/74/78/91/1133747891.db2.gz VVZJMSZVOTVAFY-UHFFFAOYSA-N 1 0 285.387 3.731 20 10 CHCDRO CC(C)c1ccc(O)c(C[NH2+][C@H](CCO)C2CCCC2)c1 ZINC001207675076 1133837369 /nfs/dbraw/zinc/83/73/69/1133837369.db2.gz JPPMMLRGIDPRGT-QGZVFWFLSA-N 1 0 291.435 3.546 20 10 CHCDRO CC[N@H+](CCc1c(F)cccc1F)Cc1ccccc1O ZINC001208116948 1133878805 /nfs/dbraw/zinc/87/88/05/1133878805.db2.gz MZCSAKJRPBWXFZ-UHFFFAOYSA-N 1 0 291.341 3.735 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(C[N@@H+](C)[C@@H]2CCCOC2)cc1 ZINC001209520284 1134033959 /nfs/dbraw/zinc/03/39/59/1134033959.db2.gz UIVREQOCACGFHY-LJQANCHMSA-N 1 0 298.430 3.705 20 10 CHCDRO COC[C@H]1CCC[N@@H+]1Cc1ccc(-n2c(C)ccc2C)cc1 ZINC001209517791 1134034248 /nfs/dbraw/zinc/03/42/48/1134034248.db2.gz GSWFOQRMFIGOAW-LJQANCHMSA-N 1 0 298.430 3.705 20 10 CHCDRO CC[C@@H](C[NH2+]Cc1cc(F)ccc1O)CC(F)(F)F ZINC000402557040 1134660124 /nfs/dbraw/zinc/66/01/24/1134660124.db2.gz HSIDYMMNJGWPMH-SECBINFHSA-N 1 0 279.277 3.600 20 10 CHCDRO CC[NH+](CC)Cc1ccc(F)c(Nc2ccc(N)cc2)c1 ZINC001215727087 1134667621 /nfs/dbraw/zinc/66/76/21/1134667621.db2.gz ZYESCSZISLGKOQ-UHFFFAOYSA-N 1 0 287.382 3.993 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[NH2+][C@@H]1CC[C@H]2C[C@H]2C1 ZINC000403485264 1134788496 /nfs/dbraw/zinc/78/84/96/1134788496.db2.gz UBKUSZCJLTWWFS-YESZJQIVSA-N 1 0 270.420 3.565 20 10 CHCDRO C[C@H](Oc1ccc(NN=C2C=CC(=O)C=C2)cc1)C1C[NH2+]C1 ZINC001218198315 1135068375 /nfs/dbraw/zinc/06/83/75/1135068375.db2.gz HGHOQBPSTQTLPZ-LBPRGKRZSA-N 1 0 297.358 3.794 20 10 CHCDRO Cc1ccc([C@@H](C)Oc2ccc(N3CC[NH2+]CC3)cc2)cc1 ZINC001218343904 1135090573 /nfs/dbraw/zinc/09/05/73/1135090573.db2.gz MGLXNAQCRGUFGS-MRXNPFEDSA-N 1 0 296.414 3.545 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]CCOc1ccccc1 ZINC000314533568 1135145700 /nfs/dbraw/zinc/14/57/00/1135145700.db2.gz ALLOOTFUTQZWGS-GDBMZVCRSA-N 1 0 297.398 3.918 20 10 CHCDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]Cc1ccc(C#N)cc1 ZINC000314693416 1135147106 /nfs/dbraw/zinc/14/71/06/1135147106.db2.gz LVYYUDXWELTYSZ-BBRMVZONSA-N 1 0 292.382 3.910 20 10 CHCDRO C[C@H]([NH2+]CCc1ccc(Cl)cc1)c1ccccc1O ZINC000020122554 171002629 /nfs/dbraw/zinc/00/26/29/171002629.db2.gz HHEZQRQMYNGXGE-LBPRGKRZSA-N 1 0 275.779 3.939 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1ccccn1)c1ccccc1O ZINC000020123557 171004855 /nfs/dbraw/zinc/00/48/55/171004855.db2.gz ZJASMSCGSHPGGK-JSGCOSHPSA-N 1 0 256.349 3.589 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2cccnc2)c(O)c1 ZINC000020127994 171013921 /nfs/dbraw/zinc/01/39/21/171013921.db2.gz YNWWYPKVRNJELE-QWHCGFSZSA-N 1 0 256.349 3.507 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccccc1O ZINC000020146099 171032097 /nfs/dbraw/zinc/03/20/97/171032097.db2.gz MCUIQRQVXSEZEA-QGZVFWFLSA-N 1 0 284.403 3.699 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2cccc(F)c2)c1 ZINC000020147926 171035611 /nfs/dbraw/zinc/03/56/11/171035611.db2.gz VAZVUEIAJBPOMY-NWDGAFQWSA-N 1 0 289.350 3.952 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](C(C)C)N1CCCC1)c1ccccc1O ZINC000020200857 171064834 /nfs/dbraw/zinc/06/48/34/171064834.db2.gz ICJJXKUDPNNBEQ-IRXDYDNUSA-N 1 0 290.451 3.553 20 10 CHCDRO CCOc1cccc(C[NH2+][C@H]2CCCc3occc32)c1O ZINC000020204323 171069600 /nfs/dbraw/zinc/06/96/00/171069600.db2.gz SHYPWPQRMUKKTG-AWEZNQCLSA-N 1 0 287.359 3.551 20 10 CHCDRO COc1ccc(C[NH2+][C@H]2CCCc3occc32)cc1C ZINC000035273645 172094519 /nfs/dbraw/zinc/09/45/19/172094519.db2.gz IPWYTIMOYAWVIB-HNNXBMFYSA-N 1 0 271.360 3.764 20 10 CHCDRO CCCCCC[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000037232574 173051308 /nfs/dbraw/zinc/05/13/08/173051308.db2.gz QGCHKEWJMJWWPP-UHFFFAOYSA-N 1 0 260.425 3.957 20 10 CHCDRO CC[C@H](C)[NH2+]Cc1cc(C)n(-c2ccccc2)c1C ZINC000037329009 173130589 /nfs/dbraw/zinc/13/05/89/173130589.db2.gz SHEDNWFJXBDJDM-ZDUSSCGKSA-N 1 0 256.393 3.982 20 10 CHCDRO C[C@H]([NH2+]Cc1ccccc1)c1ccc(N(C)C)cc1 ZINC000037187687 260073536 /nfs/dbraw/zinc/07/35/36/260073536.db2.gz FQNOSLGXYULJBK-AWEZNQCLSA-N 1 0 254.377 3.603 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)c2cccc(O)c2)cc1C ZINC000037319286 260087338 /nfs/dbraw/zinc/08/73/38/260087338.db2.gz GBOKKNRKXQFRGL-ZDUSSCGKSA-N 1 0 271.360 3.560 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(C)c(OC)c1)c1ccccc1O ZINC000155385654 261101090 /nfs/dbraw/zinc/10/10/90/261101090.db2.gz IKTHUFWCFUIDCB-INIZCTEOSA-N 1 0 285.387 3.950 20 10 CHCDRO CCC(CC)(CCO)C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000155342339 261101325 /nfs/dbraw/zinc/10/13/25/261101325.db2.gz ZFEQOOZPDVVTDI-OAHLLOKOSA-N 1 0 292.467 3.592 20 10 CHCDRO CCc1nc(CC[NH2+][C@@H](CC)c2ccccc2O)cs1 ZINC000155569468 261103880 /nfs/dbraw/zinc/10/38/80/261103880.db2.gz YOZMRBCKVGJRPO-AWEZNQCLSA-N 1 0 290.432 3.695 20 10 CHCDRO CCc1nc(CC[NH2+][C@H](CC)c2ccccc2O)cs1 ZINC000155569580 261104194 /nfs/dbraw/zinc/10/41/94/261104194.db2.gz YOZMRBCKVGJRPO-CQSZACIVSA-N 1 0 290.432 3.695 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)Cc1c(C)noc1C)c1ccccc1O ZINC000155925209 261109753 /nfs/dbraw/zinc/10/97/53/261109753.db2.gz JXTCIJJXXFZRPV-ZBEGNZNMSA-N 1 0 288.391 3.669 20 10 CHCDRO CCc1noc(CC)c1C[NH2+][C@@H](CC)c1ccccc1O ZINC000156306101 261120044 /nfs/dbraw/zinc/12/00/44/261120044.db2.gz LWUBGRFDRABNOP-AWEZNQCLSA-N 1 0 288.391 3.746 20 10 CHCDRO CC[C@H]([NH2+]CC1(CCOC)CCC1)c1ccccc1O ZINC000156357472 261120794 /nfs/dbraw/zinc/12/07/94/261120794.db2.gz ZYBUOTZKNBABSG-HNNXBMFYSA-N 1 0 277.408 3.640 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cccnc1Cl ZINC000160536997 261217562 /nfs/dbraw/zinc/21/75/62/261217562.db2.gz FIDJTQITOFFCIQ-GFCCVEGCSA-N 1 0 289.810 3.652 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1ccc(N(C)C)cc1)c1ccncc1 ZINC000163666987 261324909 /nfs/dbraw/zinc/32/49/09/261324909.db2.gz WUKVVCXBRNNFMT-KDOFPFPSSA-N 1 0 283.419 3.950 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(Cl)nc1)c1ccc(N(C)C)cc1 ZINC000165486476 261371237 /nfs/dbraw/zinc/37/12/37/261371237.db2.gz JGYBUOVBASXMBF-LBPRGKRZSA-N 1 0 289.810 3.652 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccoc2)cc1 ZINC000178474885 261744412 /nfs/dbraw/zinc/74/44/12/261744412.db2.gz GTTLRUWFADMZFF-CYBMUJFWSA-N 1 0 258.365 3.587 20 10 CHCDRO CCOc1ccccc1C[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000185103448 262041087 /nfs/dbraw/zinc/04/10/87/262041087.db2.gz QFHUCNOYWLNGTO-AWEZNQCLSA-N 1 0 285.387 3.950 20 10 CHCDRO Cc1noc(C)c1C[C@@H](C)[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000185501297 262056757 /nfs/dbraw/zinc/05/67/57/262056757.db2.gz YVHMUEKIMIWALI-NEPJUHHUSA-N 1 0 288.391 3.587 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H](CCCO)c2ccccc2)c1 ZINC000185532124 262058523 /nfs/dbraw/zinc/05/85/23/262058523.db2.gz KIUFWTGEGCQBMI-CRAIPNDOSA-N 1 0 299.414 3.865 20 10 CHCDRO C[C@H]([NH2+]C1CCSCC1)c1cc2c(cc1O)CCCC2 ZINC000185979039 262074063 /nfs/dbraw/zinc/07/40/63/262074063.db2.gz WRTPJBRJSGSNPR-LBPRGKRZSA-N 1 0 291.460 3.817 20 10 CHCDRO CCOCCC1(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)CC1 ZINC000186155213 262081778 /nfs/dbraw/zinc/08/17/78/262081778.db2.gz RRHXVHHLKBLQQS-LBPRGKRZSA-N 1 0 297.826 3.903 20 10 CHCDRO Cc1noc(C)c1[C@@H](C)C[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000186158062 262082681 /nfs/dbraw/zinc/08/26/81/262082681.db2.gz PESAFQVXBDRGKM-RYUDHWBXSA-N 1 0 288.391 3.760 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(Cl)cn2)c(O)c1 ZINC000186230059 262085513 /nfs/dbraw/zinc/08/55/13/262085513.db2.gz SLMXCLLJINQKJQ-LLVKDONJSA-N 1 0 276.767 3.600 20 10 CHCDRO Cc1csc([C@@H](C)C[NH2+][C@H](C)c2cc(C)ccc2O)n1 ZINC000186561776 262099220 /nfs/dbraw/zinc/09/92/20/262099220.db2.gz WVOIPWXVSNRTFL-WCQYABFASA-N 1 0 290.432 3.920 20 10 CHCDRO Cc1cnc([C@H](C)C[NH2+][C@@H](C)c2ccc(C)cc2O)s1 ZINC000186777928 262109276 /nfs/dbraw/zinc/10/92/76/262109276.db2.gz QCKUMRXRJGJUBK-YPMHNXCESA-N 1 0 290.432 3.920 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C2CCC(C(F)F)CC2)cc1 ZINC000281875140 263072774 /nfs/dbraw/zinc/07/27/74/263072774.db2.gz FQBMIBPCRJYBDE-UHFFFAOYSA-N 1 0 282.378 3.666 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CN(C)Cc3ccccc32)c1 ZINC000370372738 267313296 /nfs/dbraw/zinc/31/32/96/267313296.db2.gz CYTPNGANDHPGCV-KSSFIOAISA-N 1 0 296.414 3.538 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CN(C)Cc3ccccc32)c(O)c1 ZINC000370375083 267313336 /nfs/dbraw/zinc/31/33/36/267313336.db2.gz QWWMVJFOAANCDB-RDTXWAMCSA-N 1 0 296.414 3.538 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CC2(c3ccccn3)CCC2)cc1C ZINC000370742716 267344118 /nfs/dbraw/zinc/34/41/18/267344118.db2.gz WWIOSDGFEMIOFS-UHFFFAOYSA-N 1 0 296.414 3.616 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1ccc(C)cc1O)c1ccncc1 ZINC000185541544 327840426 /nfs/dbraw/zinc/84/04/26/327840426.db2.gz FRVODIXBXOMUFR-CJNGLKHVSA-N 1 0 270.376 3.898 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CC3(CCC3)[C@H]2C2CC2)c1O ZINC000291532409 328264662 /nfs/dbraw/zinc/26/46/62/328264662.db2.gz KJJKKWYCYXRZPQ-QGZVFWFLSA-N 1 0 287.403 3.555 20 10 CHCDRO CCOc1cccc(C[NH2+]CC[C@@H]2CC=CCC2)c1O ZINC000527789699 326868166 /nfs/dbraw/zinc/86/81/66/326868166.db2.gz NJPQNAWJSMXTIY-CQSZACIVSA-N 1 0 275.392 3.627 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCOC[C@H]1C)c1ccc2ccccc2c1O ZINC000278613839 327177766 /nfs/dbraw/zinc/17/77/66/327177766.db2.gz RGPKQDDKPNZFFY-IGCXYCKISA-N 1 0 285.387 3.621 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+]C1CC(C)(C)C1 ZINC000395162407 328621507 /nfs/dbraw/zinc/62/15/07/328621507.db2.gz AAQCXCIOVDQDLR-UHFFFAOYSA-N 1 0 256.393 3.765 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1COc2c1cccc2Cl)c1ccccc1O ZINC000374681218 328996121 /nfs/dbraw/zinc/99/61/21/328996121.db2.gz ULDPLWJWYYQUBZ-QMTHXVAHSA-N 1 0 289.762 3.830 20 10 CHCDRO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2cccc(C)c2O)n1 ZINC000180277739 329219451 /nfs/dbraw/zinc/21/94/51/329219451.db2.gz RFRPPWHLCCCKLE-KRWDZBQOSA-N 1 0 282.387 3.741 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+]CC2CC=CC2)c2c1c(F)ccc2O ZINC000527951663 330294542 /nfs/dbraw/zinc/29/45/42/330294542.db2.gz RJPQXFQEPAFKKM-MFKMUULPSA-N 1 0 261.340 3.635 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ncccc1F)c1ccc(Cl)cc1O ZINC000528038147 330303306 /nfs/dbraw/zinc/30/33/06/330303306.db2.gz QUOCTTLDFXAMFV-ZJUUUORDSA-N 1 0 294.757 3.992 20 10 CHCDRO CCc1cnc(C[NH2+][C@H](CC)c2ccccc2O)s1 ZINC000156090210 330718915 /nfs/dbraw/zinc/71/89/15/330718915.db2.gz NWGZLTKTQZCPDA-CYBMUJFWSA-N 1 0 276.405 3.652 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCOC(C)(C)C2)cc1 ZINC000160636236 330870568 /nfs/dbraw/zinc/87/05/68/330870568.db2.gz STIKCTTVYGFWFU-INIZCTEOSA-N 1 0 290.451 3.580 20 10 CHCDRO C[C@H](CO)CCC[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000230669759 333320244 /nfs/dbraw/zinc/32/02/44/333320244.db2.gz PIUWDLMAGWQSDW-KBPBESRZSA-N 1 0 287.403 3.605 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1cccc([N+](=O)[O-])c1 ZINC000295992125 334904971 /nfs/dbraw/zinc/90/49/71/334904971.db2.gz NUFDGPWWIFAWPO-XHDPSFHLSA-N 1 0 298.342 3.639 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)CC(C)(C)O)c1ccc2ccccc2c1O ZINC000296633513 334912768 /nfs/dbraw/zinc/91/27/68/334912768.db2.gz XNOSIUGAVQRCAD-QWHCGFSZSA-N 1 0 287.403 3.746 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1C[C@@H](C)[C@@H]1C ZINC000385713275 336154751 /nfs/dbraw/zinc/15/47/51/336154751.db2.gz VSDSWFYGIPVPCC-TYNCELHUSA-N 1 0 256.393 3.621 20 10 CHCDRO COC1(C[NH2+]Cc2c(C)c3ccccc3n2C)CCCC1 ZINC000386756327 336178000 /nfs/dbraw/zinc/17/80/00/336178000.db2.gz FMKZKJWFVFUHDX-UHFFFAOYSA-N 1 0 286.419 3.536 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCSC(C)(C)CC2)c1O ZINC000279513230 521341685 /nfs/dbraw/zinc/34/16/85/521341685.db2.gz XKTIQVOAJKDVEH-UHFFFAOYSA-N 1 0 295.448 3.508 20 10 CHCDRO CCOc1cccc(C[NH2+]Cc2ccccc2Cl)c1O ZINC000019908225 521368048 /nfs/dbraw/zinc/36/80/48/521368048.db2.gz LOWFMNQHAOPSAT-UHFFFAOYSA-N 1 0 291.778 3.734 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H](C)c2cc(C)ccc2O)c1 ZINC000037679524 521370126 /nfs/dbraw/zinc/37/01/26/521370126.db2.gz WCXWFCRLYYPWNG-AWEZNQCLSA-N 1 0 285.387 3.950 20 10 CHCDRO CCC(O)(CC)C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000087014080 521657226 /nfs/dbraw/zinc/65/72/26/521657226.db2.gz HZJNLJXBUTYDIS-ZDUSSCGKSA-N 1 0 287.403 3.747 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC[C@H](c3ccncc3)C2)cc1 ZINC000296047782 522176428 /nfs/dbraw/zinc/17/64/28/522176428.db2.gz TWGRUOZOUYLELO-SFHVURJKSA-N 1 0 295.430 3.527 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H](c2cccnc2)C2CCC2)cc1 ZINC000280427396 522213015 /nfs/dbraw/zinc/21/30/15/522213015.db2.gz ZXYVWTLUHURSKF-IBGZPJMESA-N 1 0 295.430 3.779 20 10 CHCDRO CC[C@H]([NH2+]Cc1nc(C)cs1)c1ccc(N(C)C)cc1 ZINC000126244258 522669283 /nfs/dbraw/zinc/66/92/83/522669283.db2.gz TXOZVIYSVBUHKC-HNNXBMFYSA-N 1 0 289.448 3.758 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCOC2(CCC2)C1)c1ccc(C)cc1O ZINC000280274252 522755863 /nfs/dbraw/zinc/75/58/63/522755863.db2.gz YATCFJANFWAJCD-HOCLYGCPSA-N 1 0 289.419 3.843 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1CSCCS1)c1ccc(C)cc1O ZINC000280082564 522867323 /nfs/dbraw/zinc/86/73/23/522867323.db2.gz LUIDMGJGQHUAHK-GXTWGEPZSA-N 1 0 297.489 3.590 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(Cl)cn1)c1ccc(C)cc1O ZINC000279947660 522874568 /nfs/dbraw/zinc/87/45/68/522874568.db2.gz BNVWSZSYGXVISV-OAHLLOKOSA-N 1 0 290.794 3.990 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1cnn(C)c1C)c1ccc(C)cc1O ZINC000280269126 522917552 /nfs/dbraw/zinc/91/75/52/522917552.db2.gz XTNQQKNLAILEGO-BLLLJJGKSA-N 1 0 287.407 3.544 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CCOC)c1ccco1)c1ccccc1O ZINC000274741727 522919970 /nfs/dbraw/zinc/91/99/70/522919970.db2.gz FLXBZCYUGZSUGU-CABCVRRESA-N 1 0 289.375 3.804 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CCOC2(CCC2)C1)c1ccccc1O ZINC000274961633 522950370 /nfs/dbraw/zinc/95/03/70/522950370.db2.gz WVUXKJBKONNYMS-DZGCQCFKSA-N 1 0 275.392 3.535 20 10 CHCDRO COc1ccc(C[NH2+]CCCC(C)(F)F)cc1C ZINC000296142551 524069934 /nfs/dbraw/zinc/06/99/34/524069934.db2.gz VITLZKPTTZGUEW-UHFFFAOYSA-N 1 0 257.324 3.529 20 10 CHCDRO COc1ccc(C[NH2+]Cc2sccc2C)cc1C ZINC000075675513 524073952 /nfs/dbraw/zinc/07/39/52/524073952.db2.gz QUYOGPWPHYXLOQ-UHFFFAOYSA-N 1 0 261.390 3.663 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)c2ccc(C)cc2O)s1 ZINC000050225188 524604354 /nfs/dbraw/zinc/60/43/54/524604354.db2.gz TUUJLSTVVJSOQX-GFCCVEGCSA-N 1 0 261.390 3.921 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)s1 ZINC000050225295 524605168 /nfs/dbraw/zinc/60/51/68/524605168.db2.gz HZPYWKQLYMVLFJ-CYBMUJFWSA-N 1 0 274.433 3.973 20 10 CHCDRO C[C@H](Cc1ccsc1)[NH2+][C@H](C)c1ccccc1O ZINC000049154520 524763988 /nfs/dbraw/zinc/76/39/88/524763988.db2.gz BKRMWDVAUHISKD-VXGBXAGGSA-N 1 0 261.390 3.736 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(F)c(F)c2)c1 ZINC000049577420 525363265 /nfs/dbraw/zinc/36/32/65/525363265.db2.gz VPMCEJGCIIXOJN-LLVKDONJSA-N 1 0 277.314 3.830 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(F)c(F)c2)c1 ZINC000049577421 525365841 /nfs/dbraw/zinc/36/58/41/525365841.db2.gz VPMCEJGCIIXOJN-NSHDSACASA-N 1 0 277.314 3.830 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(Cl)cn1 ZINC000274964460 525445355 /nfs/dbraw/zinc/44/53/55/525445355.db2.gz XCOFRMIROYRSPF-LBPRGKRZSA-N 1 0 289.810 3.652 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccsc1 ZINC000061361745 525451150 /nfs/dbraw/zinc/45/11/50/525451150.db2.gz LQPYZRWTTYECPL-ZDUSSCGKSA-N 1 0 286.444 3.981 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCSC1)c1cc2c(cc1O)CCCC2 ZINC000280120750 525502728 /nfs/dbraw/zinc/50/27/28/525502728.db2.gz PNLURBGVMFFKBF-CHWSQXEVSA-N 1 0 291.460 3.675 20 10 CHCDRO Cc1cccnc1CCC[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000296571424 525510028 /nfs/dbraw/zinc/51/00/28/525510028.db2.gz SYDFETUCFAZUJP-INIZCTEOSA-N 1 0 297.446 3.739 20 10 CHCDRO Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccccc1O)CCC2 ZINC000291669284 526210681 /nfs/dbraw/zinc/21/06/81/526210681.db2.gz GDMVMRPMTTXKHK-QGZVFWFLSA-N 1 0 267.372 3.868 20 10 CHCDRO CCOc1cccc(C[N@H+](CC(C)C)C(C)C)c1O ZINC000133522364 1125467699 /nfs/dbraw/zinc/46/76/99/1125467699.db2.gz PXWHOFFMVVWSFP-UHFFFAOYSA-N 1 0 265.397 3.657 20 10 CHCDRO C[C@@H](c1cccc(F)c1)[N@H+](C)Cc1ccccc1O ZINC000109772069 1125469262 /nfs/dbraw/zinc/46/92/62/1125469262.db2.gz VOUDGHJIVLBXBC-LBPRGKRZSA-N 1 0 259.324 3.724 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)c(C)c1)[C@@H](C)C(C)C ZINC001167241050 1118115483 /nfs/dbraw/zinc/11/54/83/1118115483.db2.gz OQZMSTRJLBEVPT-HNNXBMFYSA-N 1 0 262.441 3.927 20 10 CHCDRO COc1cccc(C[NH+]2CCC(C(C)(C)C)CC2)c1O ZINC000133755581 1125491495 /nfs/dbraw/zinc/49/14/95/1125491495.db2.gz RKZPKCPNTNZJAF-UHFFFAOYSA-N 1 0 277.408 3.659 20 10 CHCDRO CSCC[C@@H](C)[N@H+](C)Cc1cc(Cl)ccc1O ZINC000093558740 1120822157 /nfs/dbraw/zinc/82/21/57/1120822157.db2.gz WAVZUPRYAXUFQB-SNVBAGLBSA-N 1 0 273.829 3.619 20 10 CHCDRO CCC(CC)[NH2+]Cc1cc(OC)cc(C(C)(C)C)c1O ZINC001177108578 1121714089 /nfs/dbraw/zinc/71/40/89/1121714089.db2.gz GYERTIBTQIPJAH-UHFFFAOYSA-N 1 0 279.424 3.977 20 10 CHCDRO COc1ccc(C[NH2+]CC2(CC3CC3)CC2)cc1C ZINC001179464818 1121881902 /nfs/dbraw/zinc/88/19/02/1121881902.db2.gz YXVWWWATJKFQRN-UHFFFAOYSA-N 1 0 259.393 3.674 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CCC2(CSC)CC2)c1O ZINC000850507988 1123276873 /nfs/dbraw/zinc/27/68/73/1123276873.db2.gz QOHOKGQFGDNHQO-LBPRGKRZSA-N 1 0 295.448 3.585 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H]2C(C)(C)C2(F)F)c1 ZINC000850552874 1123290056 /nfs/dbraw/zinc/29/00/56/1123290056.db2.gz QHCKVEMVXPXCTM-GWCFXTLKSA-N 1 0 269.335 3.643 20 10 CHCDRO CC[C@H](C)[N@H+](C)Cc1ccc(N(CC)CC)cc1OC ZINC001138386514 1131497403 /nfs/dbraw/zinc/49/74/03/1131497403.db2.gz PGXPDUWBWSKLGH-AWEZNQCLSA-N 1 0 278.440 3.772 20 10 CHCDRO CCC[C@H](C[NH2+][C@@H](C)c1cc(Cl)ccc1O)OC ZINC000834841755 1131710554 /nfs/dbraw/zinc/71/05/54/1131710554.db2.gz ZVCAVGAIRICZDC-CMPLNLGQSA-N 1 0 271.788 3.511 20 10 CHCDRO CO[C@@H]([C@H](C)[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O)C1CC1 ZINC000834904972 1131728277 /nfs/dbraw/zinc/72/82/77/1131728277.db2.gz RKBAECRNCFAORY-MMPTUQATSA-N 1 0 297.826 3.818 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@H]2CCS[C@H]2C)c(O)c1 ZINC000842930944 1132477472 /nfs/dbraw/zinc/47/74/72/1132477472.db2.gz ZJZCTGSULKEBKM-AVGNSLFASA-N 1 0 265.422 3.554 20 10 CHCDRO CC[C@@H]1CC[N@H+](Cc2ccc(Br)cc2O)[C@H]1C ZINC001205470637 1133580596 /nfs/dbraw/zinc/58/05/96/1133580596.db2.gz BEHYKYJAGMWUDP-WDEREUQCSA-N 1 0 298.224 3.775 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCOC(C)(C)C1)c1cc(Cl)ccc1O ZINC000120214092 1125542584 /nfs/dbraw/zinc/54/25/84/1125542584.db2.gz HOGYPBKJNSSVOD-JQWIXIFHSA-N 1 0 283.799 3.654 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)Cc1ccco1)c1ccc(Cl)cc1O ZINC000841743617 1125568880 /nfs/dbraw/zinc/56/88/80/1125568880.db2.gz IRSLPNZIVHZYNZ-WDEREUQCSA-N 1 0 279.767 3.920 20 10 CHCDRO CC[C@@H](C)[NH2+][C@@H](C)c1ccc(Br)cc1O ZINC000134906963 1125569561 /nfs/dbraw/zinc/56/95/61/1125569561.db2.gz LNKNZSJWWUEJPU-BDAKNGLRSA-N 1 0 272.186 3.604 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H]2CC[C@@H](C)C2)cc1 ZINC000135152371 1125579627 /nfs/dbraw/zinc/57/96/27/1125579627.db2.gz WTGAYCIZQXMNFF-ZBFHGGJFSA-N 1 0 260.425 3.811 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccccc1OC ZINC000215914330 1125581919 /nfs/dbraw/zinc/58/19/19/1125581919.db2.gz WEDHLWQYSPEESN-UHFFFAOYSA-N 1 0 298.430 3.783 20 10 CHCDRO C[C@H]([NH2+][C@H](CO)C1CCCCC1)c1ccc(Cl)cc1O ZINC000841751193 1125582633 /nfs/dbraw/zinc/58/26/33/1125582633.db2.gz MILRQXZGGSHEHP-XHDPSFHLSA-N 1 0 297.826 3.637 20 10 CHCDRO CCOC[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)C(C)C ZINC000841753803 1125592410 /nfs/dbraw/zinc/59/24/10/1125592410.db2.gz WOAYGEAGYPUBBR-SMDDNHRTSA-N 1 0 285.815 3.757 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCC[C@@H]([NH+](C)C)C1)c1ccc(Cl)cc1[O-] ZINC000841756182 1125594184 /nfs/dbraw/zinc/59/41/84/1125594184.db2.gz UTTZCKQSJWDYEQ-IACUBPJLSA-N 1 0 296.842 3.569 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CC[C@@H]2OCCC[C@H]2C1 ZINC000246942446 1125651350 /nfs/dbraw/zinc/65/13/50/1125651350.db2.gz LORYEGKHNWUYEZ-KXBFYZLASA-N 1 0 297.398 3.546 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCc3cccnc32)cc1 ZINC000886506461 1125681358 /nfs/dbraw/zinc/68/13/58/1125681358.db2.gz UMSZBKRRANNBEH-SFHVURJKSA-N 1 0 295.430 3.705 20 10 CHCDRO C[C@H]([NH2+]CCC1(O)CCC1)c1ccc2ccccc2c1O ZINC000284287190 1125691884 /nfs/dbraw/zinc/69/18/84/1125691884.db2.gz HXQGEJGHMHSROS-ZDUSSCGKSA-N 1 0 285.387 3.501 20 10 CHCDRO COc1ccc(C[NH2+]Cc2cccc3[nH]ccc32)cc1C ZINC000237435732 1125710620 /nfs/dbraw/zinc/71/06/20/1125710620.db2.gz DRMOPEXNRSLGNV-UHFFFAOYSA-N 1 0 280.371 3.775 20 10 CHCDRO CSC1CCC(C[NH2+]Cc2cc(C)ccc2O)CC1 ZINC000720606679 1129669916 /nfs/dbraw/zinc/66/99/16/1129669916.db2.gz NJFATMGAVWZOFL-UHFFFAOYSA-N 1 0 279.449 3.712 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+][C@H](C)c2ccsc2)c1 ZINC000800889322 1129896898 /nfs/dbraw/zinc/89/68/98/1129896898.db2.gz NDJCWAJRDWVUQY-LLVKDONJSA-N 1 0 277.389 3.703 20 10 CHCDRO CSC(C)(C)C[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000788615305 1130198167 /nfs/dbraw/zinc/19/81/67/1130198167.db2.gz YVOCGNUJOLZCBR-LBPRGKRZSA-N 1 0 267.438 3.801 20 10 CHCDRO Cc1cccc(C[NH2+][C@H](C)CCc2ccc(O)cc2)c1O ZINC000158134048 1126747182 /nfs/dbraw/zinc/74/71/82/1126747182.db2.gz ZFUYNZLUQKAGHS-CQSZACIVSA-N 1 0 285.387 3.517 20 10 CHCDRO C[C@@H](O)c1ccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)cc1 ZINC000178546890 1126816274 /nfs/dbraw/zinc/81/62/74/1126816274.db2.gz KIXBMOWSJJGNCK-HUUCEWRRSA-N 1 0 298.430 3.657 20 10 CHCDRO COc1ccc([C@@H](C)[N@H+](C)Cc2ccccc2O)cc1 ZINC000179555697 1126829608 /nfs/dbraw/zinc/82/96/08/1126829608.db2.gz JLJUHTMMBGRRIW-CYBMUJFWSA-N 1 0 271.360 3.594 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)[C@@H](C)c1cccc(O)c1 ZINC000179560927 1126829873 /nfs/dbraw/zinc/82/98/73/1126829873.db2.gz SJHVDUILQIRPFR-ZDUSSCGKSA-N 1 0 271.360 3.681 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(Cl)cn1)c1ccc(N(C)C)cc1 ZINC000182118108 1126866490 /nfs/dbraw/zinc/86/64/90/1126866490.db2.gz XVKWUTRRRQCPIJ-LBPRGKRZSA-N 1 0 289.810 3.652 20 10 CHCDRO C[C@@H]([NH2+][C@H](c1ccccc1)[C@@H]1CCCO1)c1ccccc1O ZINC000183467345 1126887427 /nfs/dbraw/zinc/88/74/27/1126887427.db2.gz WAWHYULJGQOWFP-MDASCCDHSA-N 1 0 297.398 3.963 20 10 CHCDRO C[C@@H](C[C@H](O)c1cccs1)[NH2+][C@@H](C)c1ccccc1O ZINC000183587967 1126889658 /nfs/dbraw/zinc/88/96/58/1126889658.db2.gz AVXPUUSSKMEEBU-HUBLWGQQSA-N 1 0 291.416 3.617 20 10 CHCDRO COc1ccc(F)cc1C[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000187591449 1126911995 /nfs/dbraw/zinc/91/19/95/1126911995.db2.gz SJAUBERXOOKOIP-LBPRGKRZSA-N 1 0 289.350 3.699 20 10 CHCDRO COc1ccc(F)cc1C[NH2+][C@H](C)c1cc(F)ccc1O ZINC000187590606 1126912294 /nfs/dbraw/zinc/91/22/94/1126912294.db2.gz YQHKSUYEDFCSPH-SNVBAGLBSA-N 1 0 293.313 3.530 20 10 CHCDRO CCCN(Cc1cccnc1Cl)c1ccc(C[NH3+])cc1 ZINC000194979983 1126977459 /nfs/dbraw/zinc/97/74/59/1126977459.db2.gz CKCXIBAVQLWVNF-UHFFFAOYSA-N 1 0 289.810 3.610 20 10 CHCDRO COc1cccc(C[NH2+][C@H]2CC(C)(C)CC[C@H]2C)c1O ZINC000717522529 1126988876 /nfs/dbraw/zinc/98/88/76/1126988876.db2.gz BJVYOLXFXXXBFQ-OCCSQVGLSA-N 1 0 277.408 3.705 20 10 CHCDRO CCC(F)(F)C(C)(C)C[NH2+]Cc1cc(OC)ccc1O ZINC000699717317 1130912714 /nfs/dbraw/zinc/91/27/14/1130912714.db2.gz VUNNWCXOBZDYKI-UHFFFAOYSA-N 1 0 287.350 3.562 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](CO)c2ccccc2)cc1 ZINC000269046797 1127033952 /nfs/dbraw/zinc/03/39/52/1127033952.db2.gz YOXNOSVVQSGVNY-KXBFYZLASA-N 1 0 298.430 3.527 20 10 CHCDRO C[C@@H]1c2ccsc2CC[N@H+]1Cc1ccccc1O ZINC000271235793 1127073143 /nfs/dbraw/zinc/07/31/43/1127073143.db2.gz CJMCEKWHJKSWOQ-LLVKDONJSA-N 1 0 259.374 3.573 20 10 CHCDRO C[C@H]([NH2+]Cc1ccccc1N(C)C)c1ccc(N(C)C)cc1 ZINC000271555442 1127092292 /nfs/dbraw/zinc/09/22/92/1127092292.db2.gz WPURALJRQRZSDY-HNNXBMFYSA-N 1 0 297.446 3.669 20 10 CHCDRO CCOc1ccc(C[NH2+][C@@H](C)c2ccccc2O)cc1 ZINC000271674977 1127096876 /nfs/dbraw/zinc/09/68/76/1127096876.db2.gz OHBJIZNZDVNQMA-ZDUSSCGKSA-N 1 0 271.360 3.642 20 10 CHCDRO C[N@H+](Cc1cc(C(F)(F)F)ccc1O)C1CC(F)(F)C1 ZINC001237137945 1131053911 /nfs/dbraw/zinc/05/39/11/1131053911.db2.gz SNUBSZHCOJCKFO-UHFFFAOYSA-N 1 0 295.251 3.641 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)CCSC)c1ccc(N(C)C)cc1 ZINC000151091488 1127122022 /nfs/dbraw/zinc/12/20/22/1127122022.db2.gz WFGXVHWLDOIMCJ-CJNGLKHVSA-N 1 0 280.481 3.935 20 10 CHCDRO C[C@@H]1CCC[N@H+](Cc2cc(C(F)(F)F)ccc2O)C1 ZINC001237137108 1131055654 /nfs/dbraw/zinc/05/56/54/1131055654.db2.gz MCCQFMHAFLDERK-SNVBAGLBSA-N 1 0 273.298 3.643 20 10 CHCDRO CC[C@@H](CC(F)(F)F)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000760652582 1127143664 /nfs/dbraw/zinc/14/36/64/1127143664.db2.gz PUYDWGRRBGKQSL-NSHDSACASA-N 1 0 292.320 3.712 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+][C@H](CC)CC(F)(F)F)c1 ZINC000760658495 1127153878 /nfs/dbraw/zinc/15/38/78/1127153878.db2.gz LZTVIMRMLTYYTP-LLVKDONJSA-N 1 0 291.313 3.612 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CCc2ccccc2O)c(O)c1 ZINC000284214267 1127178386 /nfs/dbraw/zinc/17/83/86/1127178386.db2.gz SWJVIPCIFMOAPH-AWEZNQCLSA-N 1 0 285.387 3.608 20 10 CHCDRO C[C@@H]([NH2+][C@H]1C=CCC1)c1ccc2ccccc2c1O ZINC000698192235 1127185497 /nfs/dbraw/zinc/18/54/97/1127185497.db2.gz VETBCJWKJWAPNA-OCCSQVGLSA-N 1 0 253.345 3.915 20 10 CHCDRO CCOC1CC(CC[NH2+][C@H](C)c2c(C)cc(C)cc2O)C1 ZINC000284882235 1127210452 /nfs/dbraw/zinc/21/04/52/1127210452.db2.gz BKCUOEMNBRXRJV-QQFBHYJXSA-N 1 0 291.435 3.865 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CC[C@H]2CCO[C@H](C)C2)c(O)c1 ZINC000285293292 1127221868 /nfs/dbraw/zinc/22/18/68/1127221868.db2.gz RTRAVUKIILJEEH-PMPSAXMXSA-N 1 0 291.435 3.865 20 10 CHCDRO CC[C@H]1CC[C@@H]1[NH2+]Cc1c(C)c2ccccc2n1C ZINC000572790624 1127227202 /nfs/dbraw/zinc/22/72/02/1127227202.db2.gz GSMAOXKOUAESRK-ZFWWWQNUSA-N 1 0 256.393 3.765 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1CCCSC1)c1ccc(C)cc1O ZINC000286973792 1127277952 /nfs/dbraw/zinc/27/79/52/1127277952.db2.gz IQLGVXJTEMWDSR-UKRRQHHQSA-N 1 0 279.449 3.885 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCCSC2)c(O)c1C ZINC000286999287 1127280861 /nfs/dbraw/zinc/28/08/61/1127280861.db2.gz KAAXZPRIPOGDMW-KGLIPLIRSA-N 1 0 279.449 3.803 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1cc(O)cc(F)c1 ZINC000355120314 1127318594 /nfs/dbraw/zinc/31/85/94/1127318594.db2.gz JNODRAOJKZIXBQ-UHFFFAOYSA-N 1 0 298.361 3.621 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CC[C@@H](C)C1)c1cc(Br)ccc1O ZINC000783311243 1127363880 /nfs/dbraw/zinc/36/38/80/1127363880.db2.gz UDPFBRNQHMNWRM-FOGDFJRCSA-N 1 0 298.224 3.994 20 10 CHCDRO CCCOc1ccc(C[NH2+][C@@H]2CS[C@@H](C)C2)cc1C ZINC001308437241 1127384185 /nfs/dbraw/zinc/38/41/85/1127384185.db2.gz NFCPPGVSEOHOAF-ZFWWWQNUSA-N 1 0 279.449 3.767 20 10 CHCDRO CCCCOCCC[NH2+][C@H](C)c1cc(C)ccc1O ZINC000168732137 1127464189 /nfs/dbraw/zinc/46/41/89/1127464189.db2.gz QBFDKSYQILRHQK-CQSZACIVSA-N 1 0 265.397 3.558 20 10 CHCDRO CS[C@@H](C)C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000168851712 1127471439 /nfs/dbraw/zinc/47/14/39/1127471439.db2.gz OEOPWUYMNOBXQQ-RYUDHWBXSA-N 1 0 275.417 3.948 20 10 CHCDRO COCC1(CC[NH2+][C@H](C)c2ccc(C)c(C)c2O)CCC1 ZINC000293701923 1127513927 /nfs/dbraw/zinc/51/39/27/1127513927.db2.gz MEOSNCTVYKLVCF-OAHLLOKOSA-N 1 0 291.435 3.866 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CCC[C@H]2CCC[C@H]21 ZINC000228172732 1127535793 /nfs/dbraw/zinc/53/57/93/1127535793.db2.gz XOXFXVWVMDAPGB-BXUZGUMPSA-N 1 0 265.784 3.810 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC(C)(C)[C@@H]2c2ccncc2)c1 ZINC000294073741 1127547181 /nfs/dbraw/zinc/54/71/81/1127547181.db2.gz YOAGFSHQZAFEDW-KRWDZBQOSA-N 1 0 282.387 3.679 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CCC[C@@H](C)[C@@H]2C)c1O ZINC000228631304 1127576448 /nfs/dbraw/zinc/57/64/48/1127576448.db2.gz UOJRBWXJCDTQKG-MNOVXSKESA-N 1 0 283.799 3.675 20 10 CHCDRO CCC[C@H](CC)[NH2+]Cc1cc(Cl)cc(OC)c1O ZINC000228673669 1127583899 /nfs/dbraw/zinc/58/38/99/1127583899.db2.gz HULMTFRSMFTJQG-LBPRGKRZSA-N 1 0 271.788 3.723 20 10 CHCDRO C[C@H](CCc1ccco1)[NH2+][C@H]1CCc2cccc(O)c21 ZINC000295989586 1129220999 /nfs/dbraw/zinc/22/09/99/1129220999.db2.gz NRRIJSUUFWAVEG-DOMZBBRYSA-N 1 0 271.360 3.583 20 10 CHCDRO CCn1cc([C@@H](C)[NH2+][C@@H](C)c2cc(Cl)ccc2O)cn1 ZINC000295964542 1127658702 /nfs/dbraw/zinc/65/87/02/1127658702.db2.gz NIKXYLOWEJPUOC-MNOVXSKESA-N 1 0 293.798 3.674 20 10 CHCDRO CCCNc1ccc(C[NH2+][C@H]2CCc3cccc(O)c32)cc1 ZINC000296611535 1127678623 /nfs/dbraw/zinc/67/86/23/1127678623.db2.gz YNBUSUYFFQGIKV-KRWDZBQOSA-N 1 0 296.414 3.991 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]Cc1nc(C3CC3)cs1)CC2 ZINC000297089247 1127688551 /nfs/dbraw/zinc/68/85/51/1127688551.db2.gz XEKDHNKXSUAYKA-GFCCVEGCSA-N 1 0 286.400 3.503 20 10 CHCDRO C[C@H]([NH2+]CCC(C)(F)F)c1cc(Cl)ccc1O ZINC000297477474 1127697908 /nfs/dbraw/zinc/69/79/08/1127697908.db2.gz YYSXCSGDYADDNR-QMMMGPOBSA-N 1 0 263.715 3.742 20 10 CHCDRO Cc1ccc2c(c1)CC[C@@H]2[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000297606062 1127701384 /nfs/dbraw/zinc/70/13/84/1127701384.db2.gz IFVFAMAJBSURON-DLBZAZTESA-N 1 0 279.383 3.965 20 10 CHCDRO CO[C@@]1(C)CCC[N@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000230300063 1127751628 /nfs/dbraw/zinc/75/16/28/1127751628.db2.gz DSFLHUOTDLQUBX-SFHVURJKSA-N 1 0 285.387 3.546 20 10 CHCDRO CCCC1(C[NH2+][C@H](C)c2cc(F)ccc2O)CC1 ZINC000230668552 1127771177 /nfs/dbraw/zinc/77/11/77/1127771177.db2.gz NRFBAJVRROCYFH-LLVKDONJSA-N 1 0 251.345 3.762 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2OCCc3ccccc32)c1 ZINC000371870657 1127782751 /nfs/dbraw/zinc/78/27/51/1127782751.db2.gz RRFLADLIBWVLFC-AUUYWEPGSA-N 1 0 297.398 3.665 20 10 CHCDRO C[C@@H]([NH2+]CCc1nccs1)c1ccc2ccccc2c1O ZINC000063133432 1127798078 /nfs/dbraw/zinc/79/80/78/1127798078.db2.gz DMICIVVYILQBJO-GFCCVEGCSA-N 1 0 298.411 3.895 20 10 CHCDRO CC[C@@H]([NH2+]CCOCC1CCCC1)c1ccccc1O ZINC000313291447 1128113677 /nfs/dbraw/zinc/11/36/77/1128113677.db2.gz GVKGYWHZJKVAKM-MRXNPFEDSA-N 1 0 277.408 3.640 20 10 CHCDRO CC[C@@](C)([NH2+]Cc1cc(Cl)ccc1O)c1nccs1 ZINC000152664835 1128145065 /nfs/dbraw/zinc/14/50/65/1128145065.db2.gz UNUIHSHGURNTDA-CQSZACIVSA-N 1 0 296.823 3.917 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccccc2)cc1 ZINC000152945956 1128158010 /nfs/dbraw/zinc/15/80/10/1128158010.db2.gz PLYWVAYMCOORCX-OAHLLOKOSA-N 1 0 268.404 3.994 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccc3c(c2)C[C@H](C)O3)c1 ZINC000926920999 1128203031 /nfs/dbraw/zinc/20/30/31/1128203031.db2.gz UHTQUZNACPOKPS-KBPBESRZSA-N 1 0 297.398 3.875 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCCC2(CCC2)O1)c1ccccc1O ZINC000927016793 1128208355 /nfs/dbraw/zinc/20/83/55/1128208355.db2.gz KZRQOFWMIKXVLQ-KGLIPLIRSA-N 1 0 275.392 3.535 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCS[C@H](C)C1)c1cc(Cl)ccc1O ZINC000927028458 1128208972 /nfs/dbraw/zinc/20/89/72/1128208972.db2.gz ADDHDUFTMDCXMQ-JFGNBEQYSA-N 1 0 285.840 3.980 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCS[C@@H](C)C2)c(O)c1 ZINC000927032730 1128209498 /nfs/dbraw/zinc/20/94/98/1128209498.db2.gz OPYVQMQTQJJAPC-AVGNSLFASA-N 1 0 265.422 3.635 20 10 CHCDRO CCCC[N@H+](CC)Cc1c(O)ccc2ccncc21 ZINC000914567441 1128211705 /nfs/dbraw/zinc/21/17/05/1128211705.db2.gz ZMTJGJVSLLUGGN-UHFFFAOYSA-N 1 0 258.365 3.562 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(C2CC2)nn1C)c1ccc(C)cc1O ZINC000927103147 1128218519 /nfs/dbraw/zinc/21/85/19/1128218519.db2.gz YJHFILZAMWJVAI-INIZCTEOSA-N 1 0 299.418 3.552 20 10 CHCDRO C[C@@H]([NH2+]CC[C@@H]1CCC2(CCC2)O1)c1cc(F)ccc1O ZINC000927127210 1128220503 /nfs/dbraw/zinc/22/05/03/1128220503.db2.gz GOAVHEHNQXMPRE-OCCSQVGLSA-N 1 0 293.382 3.674 20 10 CHCDRO C[C@H](Cc1cccc(F)c1)[N@H+](C)Cc1ccccc1O ZINC000777824871 1128288667 /nfs/dbraw/zinc/28/86/67/1128288667.db2.gz JMIXBSZHKDOZAM-CYBMUJFWSA-N 1 0 273.351 3.594 20 10 CHCDRO CCCN(CCC)c1ccc(C[NH2+]CC2CC2)cc1 ZINC000915226981 1128293636 /nfs/dbraw/zinc/29/36/36/1128293636.db2.gz CQFJXAWQYCJELA-UHFFFAOYSA-N 1 0 260.425 3.813 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccccc2CF)c1 ZINC000930216661 1128307666 /nfs/dbraw/zinc/30/76/66/1128307666.db2.gz NBHSAVBZQGMGMO-GFCCVEGCSA-N 1 0 289.350 3.721 20 10 CHCDRO Cc1c(C[N@H+](C)CC2CC(F)(F)C2)c2ccccc2n1C ZINC001138258141 1128311065 /nfs/dbraw/zinc/31/10/65/1128311065.db2.gz NCSZLBQEZUBFRT-UHFFFAOYSA-N 1 0 292.373 3.964 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCOC[C@H]1C)c1cc(Cl)ccc1O ZINC000762650717 1128312853 /nfs/dbraw/zinc/31/28/53/1128312853.db2.gz RJKYXXXICACUCT-DDTOSNHZSA-N 1 0 283.799 3.511 20 10 CHCDRO Oc1cc2c(cc1C[NH+]1CCCCCCC1)CCC2 ZINC000915794908 1128339070 /nfs/dbraw/zinc/33/90/70/1128339070.db2.gz XBMMJRIEMLSJLV-UHFFFAOYSA-N 1 0 259.393 3.647 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2cc3c(cc2O)CCC3)cc1 ZINC000915810180 1128340593 /nfs/dbraw/zinc/34/05/93/1128340593.db2.gz JZEWHLIMENNBEF-UHFFFAOYSA-N 1 0 281.399 3.821 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@H+](C)Cc2ccc(F)cc2)c1 ZINC000915826245 1128349917 /nfs/dbraw/zinc/34/99/17/1128349917.db2.gz ZZRCBDOJQGUISD-UHFFFAOYSA-N 1 0 273.351 3.780 20 10 CHCDRO CC(C)(C)c1cc(O)c(O)c(C[N@@H+]2CC[C@H](C3CC3)C2)c1 ZINC000763330893 1128391989 /nfs/dbraw/zinc/39/19/89/1128391989.db2.gz FXKWBAGAOUREDF-ZDUSSCGKSA-N 1 0 289.419 3.627 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc2c(c1)COC2)c1ccccc1O ZINC000778236890 1128458532 /nfs/dbraw/zinc/45/85/32/1128458532.db2.gz OLTXWVHKGQKSLF-KRWDZBQOSA-N 1 0 283.371 3.663 20 10 CHCDRO CCC(C)(C)CC[NH2+][C@H](C)c1cc(OC)ccc1O ZINC000686312326 1128487222 /nfs/dbraw/zinc/48/72/22/1128487222.db2.gz VIVZEONEFAJXQH-GFCCVEGCSA-N 1 0 265.397 3.878 20 10 CHCDRO Cc1ccc(CCC[NH2+]Cc2ccc3c(c2)CCO3)c(C)c1 ZINC000917392861 1128497361 /nfs/dbraw/zinc/49/73/61/1128497361.db2.gz QUFJYOQZKRLFSP-UHFFFAOYSA-N 1 0 295.426 3.961 20 10 CHCDRO CC1CCC([N@H+](C)Cc2cc3c(cc2O)CCC3)CC1 ZINC000917457044 1128500654 /nfs/dbraw/zinc/50/06/54/1128500654.db2.gz YHCUIYAUZDDTJU-UHFFFAOYSA-N 1 0 273.420 3.891 20 10 CHCDRO CC[C@H]([NH2+]CCN(C)Cc1ccccc1)c1ccccc1O ZINC000155272928 1128604048 /nfs/dbraw/zinc/60/40/48/1128604048.db2.gz DOBMJFXWORDIBX-SFHVURJKSA-N 1 0 298.430 3.565 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CC(C)(C)OC1(C)C)c1ccccc1O ZINC000157881420 1128662671 /nfs/dbraw/zinc/66/26/71/1128662671.db2.gz OATQJUNYPQJBKZ-UKRRQHHQSA-N 1 0 277.408 3.779 20 10 CHCDRO CC[N@H+](Cc1ccc(C)cc1)Cc1cc(F)ccc1O ZINC000778996416 1128674943 /nfs/dbraw/zinc/67/49/43/1128674943.db2.gz OHNGRTDZVBCTKZ-UHFFFAOYSA-N 1 0 273.351 3.862 20 10 CHCDRO C[N@H+](CCCc1ccccc1)Cc1cc(F)ccc1O ZINC000778996571 1128675632 /nfs/dbraw/zinc/67/56/32/1128675632.db2.gz QMUWCRLMUIOXDB-UHFFFAOYSA-N 1 0 273.351 3.596 20 10 CHCDRO CCOc1ccc(C[N@H+](C)Cc2cc(F)ccc2O)cc1 ZINC000778993762 1128675852 /nfs/dbraw/zinc/67/58/52/1128675852.db2.gz XLCSESXIBOTVJA-UHFFFAOYSA-N 1 0 289.350 3.562 20 10 CHCDRO Oc1ccccc1C[NH+]1CCC(c2ccccc2F)CC1 ZINC000779017845 1128682842 /nfs/dbraw/zinc/68/28/42/1128682842.db2.gz CDGLLFPKRDBOHU-UHFFFAOYSA-N 1 0 285.362 3.911 20 10 CHCDRO C[C@@H]1CCC[C@@H](C)[N@H+](Cc2cc(F)ccc2O)C1 ZINC000779019101 1128683142 /nfs/dbraw/zinc/68/31/42/1128683142.db2.gz DSLXUECPAYBSNP-VXGBXAGGSA-N 1 0 251.345 3.542 20 10 CHCDRO C[C@@H]1CCC[C@H](C)C[N@H+]1Cc1cc(F)ccc1O ZINC000779019097 1128683604 /nfs/dbraw/zinc/68/36/04/1128683604.db2.gz DSLXUECPAYBSNP-NWDGAFQWSA-N 1 0 251.345 3.542 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCCSC1)c1ccc(N(C)C)cc1 ZINC000159583444 1128712059 /nfs/dbraw/zinc/71/20/59/1128712059.db2.gz FVRJYHVMFWRVDB-ZBFHGGJFSA-N 1 0 278.465 3.689 20 10 CHCDRO Cc1ccccc1CC(C)(C)[NH2+]Cc1cc(F)ccc1O ZINC000779076506 1128720464 /nfs/dbraw/zinc/72/04/64/1128720464.db2.gz BPINXKQNHOQZQE-UHFFFAOYSA-N 1 0 287.378 3.951 20 10 CHCDRO C[C@@]1([NH2+]Cc2cc(F)ccc2O)CCCc2ccccc21 ZINC000779079423 1128722932 /nfs/dbraw/zinc/72/29/32/1128722932.db2.gz RPEFEWGQMGBNSX-GOSISDBHSA-N 1 0 285.362 3.873 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+][C@@H]2CC23CCCC3)c1O ZINC000763458868 1128730782 /nfs/dbraw/zinc/73/07/82/1128730782.db2.gz SJZZYYLOSRNMEA-CYBMUJFWSA-N 1 0 265.784 3.776 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]Cc1ccc(C(F)F)cc1 ZINC000184987976 1117746747 /nfs/dbraw/zinc/74/67/47/1117746747.db2.gz DTMIRESHCBCJSE-UHFFFAOYSA-N 1 0 281.277 3.759 20 10 CHCDRO Cc1cccc([C@H](C)[N@H+](C)Cc2ccccc2O)c1 ZINC000072629620 1117782522 /nfs/dbraw/zinc/78/25/22/1117782522.db2.gz UMHSCKGLBIKFBV-AWEZNQCLSA-N 1 0 255.361 3.894 20 10 CHCDRO CSCCCCC[NH2+][C@H](C)c1ccc(C)cc1O ZINC000186771053 1117783583 /nfs/dbraw/zinc/78/35/83/1117783583.db2.gz MMKUSGTWGJBIHH-CYBMUJFWSA-N 1 0 267.438 3.885 20 10 CHCDRO CCCC[C@@H](COC)[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000185494632 1117830323 /nfs/dbraw/zinc/83/03/23/1117830323.db2.gz ZYCGQRNFRUQWIF-KBPBESRZSA-N 1 0 265.397 3.556 20 10 CHCDRO CCOc1cccc(C[NH2+]C2(CC)CCCC2)c1O ZINC000382572005 1117832885 /nfs/dbraw/zinc/83/28/85/1117832885.db2.gz RWZPOFQGWCIQCU-UHFFFAOYSA-N 1 0 263.381 3.603 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H](CCO)c2ccccc2)c1 ZINC000185525282 1117837797 /nfs/dbraw/zinc/83/77/97/1117837797.db2.gz VBUMLLWZVWBSRB-RDJZCZTQSA-N 1 0 299.414 3.517 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H](C2CC2)C2CCC2)c1 ZINC000325064048 1117842630 /nfs/dbraw/zinc/84/26/30/1117842630.db2.gz UCQRPVVUNFEKPB-PXAZEXFGSA-N 1 0 259.393 3.930 20 10 CHCDRO CCO[C@@H](CC[NH2+][C@H](C)c1cc(F)ccc1O)C(C)C ZINC000185625825 1117859892 /nfs/dbraw/zinc/85/98/92/1117859892.db2.gz VAZNXVKRZLNBOH-WBMJQRKESA-N 1 0 283.387 3.633 20 10 CHCDRO CCO[C@@H](CC[NH2+][C@@H](C)c1cc(F)ccc1O)C(C)C ZINC000185625798 1117859913 /nfs/dbraw/zinc/85/99/13/1117859913.db2.gz VAZNXVKRZLNBOH-LRDDRELGSA-N 1 0 283.387 3.633 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCOCc2ccccc2)c(O)c1 ZINC000185633193 1117860307 /nfs/dbraw/zinc/86/03/07/1117860307.db2.gz FZOASPSUMWJMNF-HNNXBMFYSA-N 1 0 285.387 3.568 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCc2cc(F)ccc2F)c(O)c1 ZINC000185633847 1117860774 /nfs/dbraw/zinc/86/07/74/1117860774.db2.gz DKAHOAUSOUAQIE-GFCCVEGCSA-N 1 0 291.341 3.872 20 10 CHCDRO C[C@@H]([NH2+][C@@H](CCO)C1CCCCC1)c1cc(F)ccc1O ZINC000185829551 1117914275 /nfs/dbraw/zinc/91/42/75/1117914275.db2.gz PVQRICXYYLIYQF-WBMJQRKESA-N 1 0 295.398 3.513 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2C[C@@H]2c2ccccc2)c1 ZINC000186017667 1117968545 /nfs/dbraw/zinc/96/85/45/1117968545.db2.gz ULOXNRDAIYBAJR-DHSIGJKJSA-N 1 0 297.398 3.855 20 10 CHCDRO Cc1ccc(O)c(C[NH+]2CCC(OCCC(C)C)CC2)c1 ZINC000179333149 1117979064 /nfs/dbraw/zinc/97/90/64/1117979064.db2.gz HPRHOLWJRNBNMW-UHFFFAOYSA-N 1 0 291.435 3.728 20 10 CHCDRO CCCC1(C[NH2+][C@@H](C)c2cc(OC)ccc2O)CC1 ZINC000186105986 1117997132 /nfs/dbraw/zinc/99/71/32/1117997132.db2.gz QCPZLRLGBPXCMZ-LBPRGKRZSA-N 1 0 263.381 3.632 20 10 CHCDRO C[C@H]1C[C@H](c2ccccc2)C[N@@H+]1Cc1ccccc1O ZINC000179576738 1128749800 /nfs/dbraw/zinc/74/98/00/1128749800.db2.gz YLCRFNSYHOGBER-YOEHRIQHSA-N 1 0 267.372 3.770 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C2C[C@H](C)O[C@@H](C)C2)cc1 ZINC000128768988 1118025102 /nfs/dbraw/zinc/02/51/02/1118025102.db2.gz ZKZCMEIJCGVXTA-GJZGRUSLSA-N 1 0 290.451 3.578 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH+]1CCc2ccccc2CC1 ZINC000211401039 1118026139 /nfs/dbraw/zinc/02/61/39/1118026139.db2.gz HDOBJJARMZFEJO-UHFFFAOYSA-N 1 0 287.790 3.646 20 10 CHCDRO CC[C@H]([NH2+]CCOc1ccccc1)c1ccc(N(C)C)cc1 ZINC000764581809 1118099824 /nfs/dbraw/zinc/09/98/24/1118099824.db2.gz AJTVRKADZFVNKI-IBGZPJMESA-N 1 0 298.430 3.872 20 10 CHCDRO C[C@@H](CSC(C)(C)C)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000764635836 1118103783 /nfs/dbraw/zinc/10/37/83/1118103783.db2.gz RDSTYVOGHDEDQN-ZDUSSCGKSA-N 1 0 280.481 3.762 20 10 CHCDRO CCCCOCC[NH2+][C@H](CC)c1ccc(N(C)C)cc1 ZINC000765455110 1118153318 /nfs/dbraw/zinc/15/33/18/1118153318.db2.gz UUUXPFACPJDHTR-QGZVFWFLSA-N 1 0 278.440 3.610 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)Cc2ccc(C)nc2)cc1 ZINC000765567445 1118171401 /nfs/dbraw/zinc/17/14/01/1118171401.db2.gz UGOILNBZDZSMGX-UHFFFAOYSA-N 1 0 297.446 3.868 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCN(CC)C(C)C)cc1 ZINC000765626841 1118184557 /nfs/dbraw/zinc/18/45/57/1118184557.db2.gz DGNGROLLNDLBNP-MRXNPFEDSA-N 1 0 291.483 3.524 20 10 CHCDRO C[C@@H]([NH2+]CCOC1CCCCCC1)c1ccccc1O ZINC000179875642 1128763621 /nfs/dbraw/zinc/76/36/21/1128763621.db2.gz UIXGQWGMVQZBDZ-CQSZACIVSA-N 1 0 277.408 3.782 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@](C)(O)C2CCCCC2)c1 ZINC000188671583 1128763848 /nfs/dbraw/zinc/76/38/48/1128763848.db2.gz VAWVTJWZDUUJKS-KSSFIOAISA-N 1 0 291.435 3.683 20 10 CHCDRO C[C@H]([NH2+]C[C@@](C)(O)C1CCCCC1)c1cc(F)ccc1O ZINC000188664706 1128764390 /nfs/dbraw/zinc/76/43/90/1128764390.db2.gz PZRPTNKZJJUEBN-YVEFUNNKSA-N 1 0 295.398 3.513 20 10 CHCDRO COc1cnccc1[C@H](C)[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000188782247 1128765067 /nfs/dbraw/zinc/76/50/67/1128765067.db2.gz XYULIXUVXMSLIV-STQMWFEESA-N 1 0 286.375 3.516 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCC3(CCCC3)C2)c1O ZINC001140182537 1118250889 /nfs/dbraw/zinc/25/08/89/1118250889.db2.gz UQPSQNJDGCKSHN-UHFFFAOYSA-N 1 0 259.393 3.775 20 10 CHCDRO C[C@H](c1ccccc1F)[N@H+](C)Cc1cc(F)ccc1O ZINC000179923913 1128768053 /nfs/dbraw/zinc/76/80/53/1128768053.db2.gz PMDIKLARWABSRG-LLVKDONJSA-N 1 0 277.314 3.863 20 10 CHCDRO COc1ccc([C@H]2CC[N@H+](Cc3cccc(C)c3O)C2)cc1 ZINC000179955136 1128769039 /nfs/dbraw/zinc/76/90/39/1128769039.db2.gz FFHPLQQEPSKFCA-INIZCTEOSA-N 1 0 297.398 3.699 20 10 CHCDRO CC[C@H]([NH2+]C[C@@](C)(O)C1CCCCC1)c1ccccc1O ZINC000188660444 1118326170 /nfs/dbraw/zinc/32/61/70/1118326170.db2.gz CJFAGPCKXPBMNE-FUHWJXTLSA-N 1 0 291.435 3.764 20 10 CHCDRO Cc1ccc(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)cn1 ZINC000062050913 1118347768 /nfs/dbraw/zinc/34/77/68/1118347768.db2.gz YYPGKJZIHFRPHS-WFASDCNBSA-N 1 0 282.387 3.742 20 10 CHCDRO Cc1cccc(C[NH2+][C@H](C)CCc2ccccc2)c1O ZINC000083515071 1118355584 /nfs/dbraw/zinc/35/55/84/1118355584.db2.gz FNECNFCDZBBXLY-OAHLLOKOSA-N 1 0 269.388 3.812 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2cc(F)ccc2O)s1 ZINC000180068041 1128774038 /nfs/dbraw/zinc/77/40/38/1128774038.db2.gz LUGDDYZISKKPNF-UHFFFAOYSA-N 1 0 265.353 3.533 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]CCc1cscn1 ZINC000111627245 1118523111 /nfs/dbraw/zinc/52/31/11/1118523111.db2.gz UMVBSBDZBDWEIG-DGCLKSJQSA-N 1 0 288.416 3.538 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@H]1CC=CCC1 ZINC000088747898 1118524650 /nfs/dbraw/zinc/52/46/50/1118524650.db2.gz CKTJWYOUHVQFLN-HZSPNIEDSA-N 1 0 257.377 3.947 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]CC2CCC(F)(F)CC2)c1 ZINC000693331639 1118544222 /nfs/dbraw/zinc/54/42/22/1118544222.db2.gz GNEBTUOXKRSOBM-UHFFFAOYSA-N 1 0 269.335 3.616 20 10 CHCDRO Cc1cccc(C[NH2+]CC2CCC(F)(F)CC2)c1O ZINC000693331690 1118544255 /nfs/dbraw/zinc/54/42/55/1118544255.db2.gz GYWIONCDUAYOOT-UHFFFAOYSA-N 1 0 269.335 3.616 20 10 CHCDRO C[C@H]1C[C@H](C)C[NH+](Cc2c(O)cccc2Br)C1 ZINC000707145860 1118648231 /nfs/dbraw/zinc/64/82/31/1118648231.db2.gz JJWUYTCHYYMASP-QWRGUYRKSA-N 1 0 298.224 3.633 20 10 CHCDRO CCC[C@@H]1CCCC[N@@H+]1Cc1ccc(OC)cc1O ZINC000213659444 1118817679 /nfs/dbraw/zinc/81/76/79/1118817679.db2.gz ISHDOSVEVVBIOQ-CQSZACIVSA-N 1 0 263.381 3.555 20 10 CHCDRO CCCC1CCC([NH2+]Cc2cccc(OC)c2O)CC1 ZINC000049543351 1119103463 /nfs/dbraw/zinc/10/34/63/1119103463.db2.gz ZSTSGJPSPYNGJX-UHFFFAOYSA-N 1 0 277.408 3.849 20 10 CHCDRO CCOc1ccc(N2C(C)(C)CC([NH3+])CC2(C)C)cc1C ZINC001167625695 1119231829 /nfs/dbraw/zinc/23/18/29/1119231829.db2.gz YUVPHZQPQOQLCD-UHFFFAOYSA-N 1 0 290.451 3.878 20 10 CHCDRO Cc1cc(O)c(C[NH+]2CCC(OC(C)(C)C)CC2)cc1C ZINC000120579194 1119243512 /nfs/dbraw/zinc/24/35/12/1119243512.db2.gz POKWDOSQPVSFRB-UHFFFAOYSA-N 1 0 291.435 3.789 20 10 CHCDRO C[C@H]([NH2+]CCCC(F)(F)F)c1cc(F)ccc1O ZINC000148592952 1119336491 /nfs/dbraw/zinc/33/64/91/1119336491.db2.gz UEYPGXGIPPAGKK-QMMMGPOBSA-N 1 0 265.250 3.524 20 10 CHCDRO C[C@H](c1nc2ccccc2o1)[N@H+](C)Cc1ccccc1O ZINC000181171262 1128841143 /nfs/dbraw/zinc/84/11/43/1128841143.db2.gz ZPEUKKCVZVFEMP-GFCCVEGCSA-N 1 0 282.343 3.726 20 10 CHCDRO CSC1(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)CC1 ZINC000228024601 1119388801 /nfs/dbraw/zinc/38/88/01/1119388801.db2.gz ZGHPVUDLJPGZMS-RYUDHWBXSA-N 1 0 277.433 3.734 20 10 CHCDRO CC(C)(C)[C@H]1CCC[N@H+](Cc2cc(F)ccc2O)C1 ZINC000708455632 1119468687 /nfs/dbraw/zinc/46/86/87/1119468687.db2.gz XDYLXSSLERIJFR-ZDUSSCGKSA-N 1 0 265.372 3.789 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CC[C@@H]1CCCCO1 ZINC000230672122 1119541111 /nfs/dbraw/zinc/54/11/11/1119541111.db2.gz UFILLDSDJLSVEF-ILXRZTDVSA-N 1 0 289.419 3.798 20 10 CHCDRO Clc1cnc(SCCC[NH+]2CCCCC2)s1 ZINC000850000334 1119600177 /nfs/dbraw/zinc/60/01/77/1119600177.db2.gz QOAAVYNCRZWJCF-UHFFFAOYSA-N 1 0 276.858 3.765 20 10 CHCDRO C[C@@H]([NH2+]CCc1c[nH]c2ccccc12)c1cc(F)ccc1O ZINC000176981110 1119682410 /nfs/dbraw/zinc/68/24/10/1119682410.db2.gz LRTRENPNXSJSNY-GFCCVEGCSA-N 1 0 298.361 3.906 20 10 CHCDRO C[C@H]([NH2+]CCc1c[nH]c2ccccc12)c1cc(F)ccc1O ZINC000176981098 1119682755 /nfs/dbraw/zinc/68/27/55/1119682755.db2.gz LRTRENPNXSJSNY-LBPRGKRZSA-N 1 0 298.361 3.906 20 10 CHCDRO Cc1ccc([C@H](C)[N@H+](C)Cc2ccccc2O)cc1 ZINC000179557081 1119751818 /nfs/dbraw/zinc/75/18/18/1119751818.db2.gz BUSWAMKOELKSDA-AWEZNQCLSA-N 1 0 255.361 3.894 20 10 CHCDRO CC(C)CSCCC[NH2+][C@H](C)c1ccccc1O ZINC000179901976 1119792713 /nfs/dbraw/zinc/79/27/13/1119792713.db2.gz HZCSUKUWWNRCDX-CYBMUJFWSA-N 1 0 267.438 3.822 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]C[C@@H]2CCC[C@@H]3C[C@@H]32)c1O ZINC000694289316 1119836191 /nfs/dbraw/zinc/83/61/91/1119836191.db2.gz SAPXOHCNZJCAEB-SUNKGSAMSA-N 1 0 295.810 3.580 20 10 CHCDRO C[C@@H]([NH2+]CC1CC1)c1ccc(N2CCCCC2)cc1 ZINC000177835349 1119868264 /nfs/dbraw/zinc/86/82/64/1119868264.db2.gz OWWYPCZBRZPKHN-CQSZACIVSA-N 1 0 258.409 3.738 20 10 CHCDRO CC[C@@H]([NH2+]C1CC(C)C1)c1cc(Br)ccc1O ZINC000163655574 1120018723 /nfs/dbraw/zinc/01/87/23/1120018723.db2.gz KXPGYNBPUCKAKF-QEIKUCIBSA-N 1 0 298.224 3.994 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2cc(F)ccc2F)c(O)c1 ZINC000107929045 1120062564 /nfs/dbraw/zinc/06/25/64/1120062564.db2.gz SHFNFUSABBXYFE-NSHDSACASA-N 1 0 277.314 3.830 20 10 CHCDRO CCOc1c(Cl)cccc1C[NH2+]Cc1ccccc1O ZINC000785446444 1120094552 /nfs/dbraw/zinc/09/45/52/1120094552.db2.gz RGHHYVXNMLUILR-UHFFFAOYSA-N 1 0 291.778 3.734 20 10 CHCDRO CCCN(CCC)c1ccc(C[NH2+][C@H](C)C[C@H](C)O)cc1 ZINC000782977983 1120103626 /nfs/dbraw/zinc/10/36/26/1120103626.db2.gz HUOUWKJEPQIVFM-CVEARBPZSA-N 1 0 292.467 3.562 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CC3CCC2CC3)c(O)c1 ZINC000311858332 1120113156 /nfs/dbraw/zinc/11/31/56/1120113156.db2.gz JZWCFEQPSUPJAP-WOICTCIZSA-N 1 0 259.393 3.930 20 10 CHCDRO Oc1ccccc1C[NH2+][C@H]1CC[C@@H](Cc2ccccc2)C1 ZINC000780520395 1120159240 /nfs/dbraw/zinc/15/92/40/1120159240.db2.gz OMVJJOBLOXKYJU-WMZOPIPTSA-N 1 0 281.399 3.893 20 10 CHCDRO CCCC[C@H](C)[N@H+](C)Cc1cccc(OCC)c1O ZINC000311996827 1120210407 /nfs/dbraw/zinc/21/04/07/1120210407.db2.gz QXDYEXSGASYBRF-ZDUSSCGKSA-N 1 0 265.397 3.801 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CC(C)(C)OC2(C)C)c1 ZINC000186499731 1120241760 /nfs/dbraw/zinc/24/17/60/1120241760.db2.gz SLPAYZGDKRJZJA-WFASDCNBSA-N 1 0 277.408 3.697 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCC[C@H](Nc3ccccc3)C2)c1O ZINC000180488833 1120276013 /nfs/dbraw/zinc/27/60/13/1120276013.db2.gz ARAMZQRRWCLZAR-SFHVURJKSA-N 1 0 296.414 3.777 20 10 CHCDRO C[C@H]1C[C@H]([NH2+]CCc2cccs2)c2c1c(F)ccc2O ZINC000756373115 1120276141 /nfs/dbraw/zinc/27/61/41/1120276141.db2.gz SZTRYKSZAYZRDK-GWCFXTLKSA-N 1 0 291.391 3.973 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CC2CCSCC2)cc1 ZINC000765959446 1120294240 /nfs/dbraw/zinc/29/42/40/1120294240.db2.gz FOSKQVDXNHQABU-AWEZNQCLSA-N 1 0 292.492 3.937 20 10 CHCDRO CC[C@@H]([NH2+]CC1CCSCC1)c1ccc(N(C)C)cc1 ZINC000765962236 1120305142 /nfs/dbraw/zinc/30/51/42/1120305142.db2.gz TVXFCWWBYISKIW-QGZVFWFLSA-N 1 0 292.492 3.937 20 10 CHCDRO CC[N@@H+](Cc1c(O)ccc2ccccc21)CC1CC1 ZINC000069797430 1128908733 /nfs/dbraw/zinc/90/87/33/1128908733.db2.gz NUVRONPMBWVVAL-UHFFFAOYSA-N 1 0 255.361 3.777 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccnn1C1CCC1)c1ccc(N(C)C)cc1 ZINC000922015437 1120336782 /nfs/dbraw/zinc/33/67/82/1120336782.db2.gz PTCNVJFIYVOSMP-CQSZACIVSA-N 1 0 298.434 3.525 20 10 CHCDRO CC[C@H]([NH2+]CCOc1cccc(F)c1)c1ccccc1O ZINC000183322537 1120340288 /nfs/dbraw/zinc/34/02/88/1120340288.db2.gz KHFSSWGVUMTVOU-INIZCTEOSA-N 1 0 289.350 3.651 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1c(C)noc1C)c1ccccc1O ZINC000092327880 1120356873 /nfs/dbraw/zinc/35/68/73/1120356873.db2.gz MXXMWIQLBNGNBV-IINYFYTJSA-N 1 0 274.364 3.799 20 10 CHCDRO FC1(F)CC[C@@H](C[NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC000922085250 1120358529 /nfs/dbraw/zinc/35/85/29/1120358529.db2.gz PVLDEYLCUGYUQE-CYBMUJFWSA-N 1 0 281.346 3.537 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCOc2ccccc2C)c1 ZINC000756482707 1120370884 /nfs/dbraw/zinc/37/08/84/1120370884.db2.gz KAXMCXLAXLPWMJ-HNNXBMFYSA-N 1 0 285.387 3.739 20 10 CHCDRO CC(C)C1(C[NH2+][C@H](C)c2cc(F)ccc2O)CC1 ZINC000186100020 1120390926 /nfs/dbraw/zinc/39/09/26/1120390926.db2.gz OPSKVSVREVBUMG-LLVKDONJSA-N 1 0 251.345 3.618 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC(C)(C)OC2(C)C)c1 ZINC000186499695 1120400334 /nfs/dbraw/zinc/40/03/34/1120400334.db2.gz SLPAYZGDKRJZJA-SWLSCSKDSA-N 1 0 277.408 3.697 20 10 CHCDRO Cc1ccccc1CC[NH2+][C@H]1CCc2cccc(O)c21 ZINC000312458673 1120429867 /nfs/dbraw/zinc/42/98/67/1120429867.db2.gz ADPBHBMPFBJENH-INIZCTEOSA-N 1 0 267.372 3.520 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCCO2)c1ccccc1O ZINC000922328654 1120514281 /nfs/dbraw/zinc/51/42/81/1120514281.db2.gz GRGOMRVVXBUDIR-CYBMUJFWSA-N 1 0 283.371 3.568 20 10 CHCDRO Cc1cccc(CC[NH2+][C@@H]2CCc3cccc(O)c32)c1 ZINC000312650572 1120523114 /nfs/dbraw/zinc/52/31/14/1120523114.db2.gz FLFWIAUCIUJIFI-MRXNPFEDSA-N 1 0 267.372 3.520 20 10 CHCDRO CC1(C)CC[C@@H]([NH2+]Cc2cc(Cl)ccc2O)C1 ZINC000162717801 1120590522 /nfs/dbraw/zinc/59/05/22/1120590522.db2.gz AJCUBKBHDQZRTJ-GFCCVEGCSA-N 1 0 253.773 3.714 20 10 CHCDRO CC[C@H](N[C@H]1CCCC1(F)F)c1ccccc1O ZINC000397992201 1120543429 /nfs/dbraw/zinc/54/34/29/1120543429.db2.gz AVVMLQRTJCJWMC-AAEUAGOBSA-N 1 0 255.308 3.621 20 10 CHCDRO c1ccc([C@@H]([NH2+]Cc2ccc3c(c2)CCCO3)C2CC2)nc1 ZINC000922583437 1120557282 /nfs/dbraw/zinc/55/72/82/1120557282.db2.gz XPSJKEHGGFVSEP-IBGZPJMESA-N 1 0 294.398 3.648 20 10 CHCDRO Cc1cnc(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)s1 ZINC000756612299 1120605644 /nfs/dbraw/zinc/60/56/44/1120605644.db2.gz ZLOMWRXIDVVELH-LDYMZIIASA-N 1 0 292.379 3.634 20 10 CHCDRO C[C@@H]1CC[C@@H]([NH2+]Cc2ccc3c(c2)CCCN3C)C[C@@H]1C ZINC000085039315 1120703837 /nfs/dbraw/zinc/70/38/37/1120703837.db2.gz WTHPTFSTBZQOCU-RVKKMQEKSA-N 1 0 286.463 3.983 20 10 CHCDRO C[C@@H]1CC[C@H]([NH2+]Cc2ccc3c(c2)CCO3)[C@H](C)C1 ZINC000070112591 1128941486 /nfs/dbraw/zinc/94/14/86/1128941486.db2.gz OPIGJTGXGYEGKP-IOASZLSFSA-N 1 0 259.393 3.536 20 10 CHCDRO C[C@H]([NH2+]CCc1ccc(F)c(F)c1)c1cc(F)ccc1O ZINC000191516177 1128942013 /nfs/dbraw/zinc/94/20/13/1128942013.db2.gz YGERUIRLFJDSDW-JTQLQIEISA-N 1 0 295.304 3.703 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CCCOCC2CC2)cc1 ZINC000162860815 1120902599 /nfs/dbraw/zinc/90/25/99/1120902599.db2.gz UGYREYCVENHMOL-HNNXBMFYSA-N 1 0 290.451 3.610 20 10 CHCDRO CCN(CC[NH2+][C@@H](C)c1ccc2ccccc2c1O)C1CC1 ZINC000185308093 1120910761 /nfs/dbraw/zinc/91/07/61/1120910761.db2.gz RGTQBAWZSFTHJY-AWEZNQCLSA-N 1 0 298.430 3.680 20 10 CHCDRO Oc1ccccc1C[NH2+][C@H]1CCCCC12CCCC2 ZINC000312010508 1120982939 /nfs/dbraw/zinc/98/29/39/1120982939.db2.gz WGPZCKMBMGVJHA-INIZCTEOSA-N 1 0 259.393 3.985 20 10 CHCDRO Cc1cc(C[NH2+][C@@H](C)[C@@H]2CCOC2)c(C)n1-c1ccccc1 ZINC000317698835 1121037086 /nfs/dbraw/zinc/03/70/86/1121037086.db2.gz HAEVCOFHHRGQQP-DOTOQJQBSA-N 1 0 298.430 3.609 20 10 CHCDRO COc1ccc2ccc(O)c(C[NH+]3CCC(C)CC3)c2c1 ZINC000006209050 1121043914 /nfs/dbraw/zinc/04/39/14/1121043914.db2.gz XHXATCXJJZRNED-UHFFFAOYSA-N 1 0 285.387 3.786 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2C[C@@H](c3ccccc3)[C@@H]2C)c(O)c1 ZINC000763517894 1128960555 /nfs/dbraw/zinc/96/05/55/1128960555.db2.gz JUBRULBOYPIDJX-MORSLUCNSA-N 1 0 297.398 3.683 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCCC1(C)C)c1cc(F)ccc1O ZINC000094618524 1121087177 /nfs/dbraw/zinc/08/71/77/1121087177.db2.gz UMMBXKNWSZVRDR-HZMBPMFUSA-N 1 0 251.345 3.761 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCCC1(C)C)c1cc(F)ccc1O ZINC000094618523 1121087660 /nfs/dbraw/zinc/08/76/60/1121087660.db2.gz UMMBXKNWSZVRDR-QMTHXVAHSA-N 1 0 251.345 3.761 20 10 CHCDRO CCc1cnccc1[C@H](C)[NH2+]Cc1cc(C)c(C)cc1O ZINC000773428536 1121116389 /nfs/dbraw/zinc/11/63/89/1121116389.db2.gz QCSKORQSWPSFNU-AWEZNQCLSA-N 1 0 284.403 3.817 20 10 CHCDRO C[C@H](c1ccccc1)N1CCCc2cc(C[NH3+])ccc21 ZINC000700868257 1121124821 /nfs/dbraw/zinc/12/48/21/1121124821.db2.gz OIDVRTQBGVNCJO-CQSZACIVSA-N 1 0 266.388 3.659 20 10 CHCDRO CC[C@H](CC(F)F)CN1CCCc2cc(C[NH3+])ccc21 ZINC000700861222 1121124992 /nfs/dbraw/zinc/12/49/92/1121124992.db2.gz MAUIDSROUJAFKY-GFCCVEGCSA-N 1 0 282.378 3.579 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cccc(F)c2F)c1 ZINC000182405584 1128966310 /nfs/dbraw/zinc/96/63/10/1128966310.db2.gz QHGHDGXKBVVYPT-SNVBAGLBSA-N 1 0 293.313 3.530 20 10 CHCDRO C[C@@H]([NH2+]CCCSc1nccs1)[C@@H]1CC1(C)C ZINC000785473300 1121156997 /nfs/dbraw/zinc/15/69/97/1121156997.db2.gz MDNXTXOIWOGIJW-MNOVXSKESA-N 1 0 270.467 3.650 20 10 CHCDRO CCOc1ccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)o1 ZINC000893683550 1121166041 /nfs/dbraw/zinc/16/60/41/1121166041.db2.gz JLGCBVKFONAVPM-ZDUSSCGKSA-N 1 0 288.391 3.595 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCc2cc(F)cc(F)c2)c1 ZINC000060717812 1121173383 /nfs/dbraw/zinc/17/33/83/1121173383.db2.gz CEDDFJDVFVIDFG-GFCCVEGCSA-N 1 0 291.341 3.872 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2c(O)ccc3ccccc32)CC(C)(C)O1 ZINC000065224535 1121203441 /nfs/dbraw/zinc/20/34/41/1121203441.db2.gz FPWFSFMGJVHHCU-CYBMUJFWSA-N 1 0 285.387 3.545 20 10 CHCDRO C[C@@H](F)CC[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000702625087 1121206314 /nfs/dbraw/zinc/20/63/14/1121206314.db2.gz XCGMDEOENOIJOI-VXGBXAGGSA-N 1 0 261.340 3.944 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CCCC(F)(F)CC1 ZINC000702771530 1121212270 /nfs/dbraw/zinc/21/22/70/1121212270.db2.gz SSTCZNJNCZZHPF-UHFFFAOYSA-N 1 0 275.726 3.667 20 10 CHCDRO CCc1ccccc1C[NH2+]Cc1cccc(C)c1O ZINC000124839700 1121324392 /nfs/dbraw/zinc/32/43/92/1121324392.db2.gz JNASLUJQUKKDLI-UHFFFAOYSA-N 1 0 255.361 3.553 20 10 CHCDRO CC[N@H+](Cc1cc(F)cc(C(C)=O)c1[O-])[C@@H](C)C(C)C ZINC000706462936 1121429424 /nfs/dbraw/zinc/42/94/24/1121429424.db2.gz ZRFMYNKJUYBLDT-NSHDSACASA-N 1 0 281.371 3.600 20 10 CHCDRO COc1cccc(C[NH2+]CC[C@H]2CCC[C@H](C)C2)c1O ZINC000070546718 1128984873 /nfs/dbraw/zinc/98/48/73/1128984873.db2.gz NPKBEOIUSFMCMZ-UONOGXRCSA-N 1 0 277.408 3.707 20 10 CHCDRO CCc1cccc(C[NH2+][C@@H](C)c2ccsc2)c1O ZINC000709425027 1121470864 /nfs/dbraw/zinc/47/08/64/1121470864.db2.gz UJZJFAVIHYVRML-NSHDSACASA-N 1 0 261.390 3.867 20 10 CHCDRO COc1cccc(C[NH2+][C@H](C)CC2CCCCC2)c1O ZINC000709875910 1121472093 /nfs/dbraw/zinc/47/20/93/1121472093.db2.gz IJPWHHQXHYTXCY-CYBMUJFWSA-N 1 0 277.408 3.849 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H]2CCOC(C)(C)C2)cc1 ZINC000246368475 1121498760 /nfs/dbraw/zinc/49/87/60/1121498760.db2.gz JAVZGDKXQGJMGP-ZBFHGGJFSA-N 1 0 290.451 3.751 20 10 CHCDRO Cc1cc(Nc2cc(Cl)c(Cl)cc2O)cc(C)[nH+]1 ZINC001176056702 1121542847 /nfs/dbraw/zinc/54/28/47/1121542847.db2.gz BZQWPSXEQMCEIY-UHFFFAOYSA-N 1 0 283.158 3.876 20 10 CHCDRO Nc1ccc(Nc2cccc(C[NH+]3CCCC3)c2)cc1 ZINC001176199314 1121586179 /nfs/dbraw/zinc/58/61/79/1121586179.db2.gz SFNAQVYMDIQMBZ-UHFFFAOYSA-N 1 0 267.376 3.608 20 10 CHCDRO CC[C@H]([NH2+]CCSC(C)C)c1ccccc1O ZINC000283084273 1121588262 /nfs/dbraw/zinc/58/82/62/1121588262.db2.gz KXAMEEHLQSCFDB-ZDUSSCGKSA-N 1 0 253.411 3.575 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc2c(cc1O)OCO2)c1ccc(C)cc1 ZINC000237024248 1121610472 /nfs/dbraw/zinc/61/04/72/1121610472.db2.gz OXZQWWCKWOAORC-OAHLLOKOSA-N 1 0 299.370 3.670 20 10 CHCDRO CSCCCC[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC000168784428 1121610657 /nfs/dbraw/zinc/61/06/57/1121610657.db2.gz OKHCJWBSMICFNK-OLZOCXBDSA-N 1 0 279.449 3.982 20 10 CHCDRO CCC[N@H+](Cc1nc2ccccc2o1)Cc1ccccc1O ZINC000727831072 1121751118 /nfs/dbraw/zinc/75/11/18/1121751118.db2.gz HAJGFFQHFYWCSE-UHFFFAOYSA-N 1 0 296.370 3.946 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@@]2(C)CCCS2)c(Cl)c1 ZINC001178161606 1121768103 /nfs/dbraw/zinc/76/81/03/1121768103.db2.gz PKGWWPGWWBVXBT-CQSZACIVSA-N 1 0 285.840 3.729 20 10 CHCDRO CCCOc1ccc(C[NH2+]CCc2ccncc2C)cc1C ZINC001178211739 1121772525 /nfs/dbraw/zinc/77/25/25/1121772525.db2.gz AQVUSGGHHFLAIO-UHFFFAOYSA-N 1 0 298.430 3.820 20 10 CHCDRO CCN(C)c1ccc(C[N@H+](C)Cc2ccoc2C)cc1 ZINC000773746292 1121788180 /nfs/dbraw/zinc/78/81/80/1121788180.db2.gz JGYRCPQYHXNRNA-UHFFFAOYSA-N 1 0 272.392 3.676 20 10 CHCDRO COc1ccc(C[NH2+]C[C@H]2CSc3ccccc32)cc1C ZINC001178787360 1121815984 /nfs/dbraw/zinc/81/59/84/1121815984.db2.gz RLHDTMMYVFBDQF-HNNXBMFYSA-N 1 0 299.439 3.983 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2C[C@@H]3CC[C@@H](C3)C2)c1 ZINC001179054222 1121842970 /nfs/dbraw/zinc/84/29/70/1121842970.db2.gz SGWLJJBQWGWVTL-FQUUOJAGSA-N 1 0 275.392 3.630 20 10 CHCDRO C[C@H](CC1CCC1)[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001179285142 1121865673 /nfs/dbraw/zinc/86/56/73/1121865673.db2.gz GWRAJPMUDBNKQQ-LLVKDONJSA-N 1 0 282.378 3.699 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[NH2+][C@@H]1C[C@@H]2CCC[C@H]12 ZINC001179767649 1121906214 /nfs/dbraw/zinc/90/62/14/1121906214.db2.gz BXRPPCAVXVFYOG-RYQLBKOJSA-N 1 0 270.420 3.565 20 10 CHCDRO COc1cc(C)cc(C[NH2+][C@@H]2CCc3ccc(C)cc32)c1O ZINC000894241449 1121911686 /nfs/dbraw/zinc/91/16/86/1121911686.db2.gz ZWMARPPEZZKEMH-QGZVFWFLSA-N 1 0 297.398 3.795 20 10 CHCDRO CC(C)[C@H]1CC[N@H+](Cc2ccc(Cl)cc2O)C1 ZINC001179974145 1121931482 /nfs/dbraw/zinc/93/14/82/1121931482.db2.gz KIFNRMAJLXERPS-NSHDSACASA-N 1 0 253.773 3.524 20 10 CHCDRO CCC[C@](C)(O)C[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000732819897 1121941175 /nfs/dbraw/zinc/94/11/75/1121941175.db2.gz BXFPVPSAFLLEHJ-IBGZPJMESA-N 1 0 299.414 3.700 20 10 CHCDRO CC[C@@H](C)[C@@H](O)C[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000732820618 1121941395 /nfs/dbraw/zinc/94/13/95/1121941395.db2.gz NDLZZIIQMBQPGJ-KUHUBIRLSA-N 1 0 299.414 3.556 20 10 CHCDRO CC[C@@H]1C[C@H](C)C[N@@H+]1C/C=C/c1ccc(N(C)C)cc1 ZINC001180203299 1121962459 /nfs/dbraw/zinc/96/24/59/1121962459.db2.gz OFHJXFDUKUCKMF-WWJLMDQWSA-N 1 0 272.436 3.886 20 10 CHCDRO CCC[N@@H+](Cc1ccccc1O)C[C@H](OC)[C@H](C)CC ZINC001180194734 1121965681 /nfs/dbraw/zinc/96/56/81/1121965681.db2.gz MAEQHOWKZHSHKO-PBHICJAKSA-N 1 0 279.424 3.665 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2cnc3ccccc3c2)c1 ZINC000733326314 1121977435 /nfs/dbraw/zinc/97/74/35/1121977435.db2.gz WLWWVSFMEHHPPM-UHFFFAOYSA-N 1 0 278.355 3.539 20 10 CHCDRO CC[N@H+](CCC1CC1)Cc1cc(Cl)c(C)cc1O ZINC001180614214 1122000228 /nfs/dbraw/zinc/00/02/28/1122000228.db2.gz ZJIMLRFHWYOMBU-UHFFFAOYSA-N 1 0 267.800 3.976 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2ccc(Cl)s2)c1 ZINC000070988819 1129026333 /nfs/dbraw/zinc/02/63/33/1129026333.db2.gz HBAJSXWZIBLAAJ-UHFFFAOYSA-N 1 0 267.781 3.705 20 10 CHCDRO Cc1ncsc1C[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C ZINC000071212514 1122033112 /nfs/dbraw/zinc/03/31/12/1122033112.db2.gz IPKKCWLUXQBJBE-CMPLNLGQSA-N 1 0 288.416 3.804 20 10 CHCDRO CC(C)c1ccc(O)c(C[N@@H+]2CCCC[C@@H]2c2cc[nH]n2)c1 ZINC001181696867 1122073160 /nfs/dbraw/zinc/07/31/60/1122073160.db2.gz CGZGADSWAFHUOH-QGZVFWFLSA-N 1 0 299.418 3.966 20 10 CHCDRO CCN(CC)c1ccc(C[NH+]2CCC(C)(OC)CC2)cc1 ZINC000779597702 1129029680 /nfs/dbraw/zinc/02/96/80/1129029680.db2.gz DQGDJODVUVRLGD-UHFFFAOYSA-N 1 0 290.451 3.534 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CC[C@@H](C)C3(CCC3)C2)c(O)c1 ZINC000779605575 1129032184 /nfs/dbraw/zinc/03/21/84/1129032184.db2.gz UUFJBDBYCLJZAK-CQSZACIVSA-N 1 0 289.419 3.803 20 10 CHCDRO CC(C)[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cccnc1 ZINC000774407706 1122162152 /nfs/dbraw/zinc/16/21/52/1122162152.db2.gz XZJGFHCIOBPDPS-GOSISDBHSA-N 1 0 282.387 3.503 20 10 CHCDRO CCc1cccc(C[N@@H+]2CCSC[C@@H]2C2CCC2)c1O ZINC001182463709 1122166918 /nfs/dbraw/zinc/16/69/18/1122166918.db2.gz WLFXXMMBRJFECK-MRXNPFEDSA-N 1 0 291.460 3.672 20 10 CHCDRO Cc1ccc(C[NH2+]CC(C)(C)c2ccccc2)c(O)c1 ZINC001182795694 1122186977 /nfs/dbraw/zinc/18/69/77/1122186977.db2.gz JLRSMPLETJAAAS-UHFFFAOYSA-N 1 0 269.388 3.768 20 10 CHCDRO COc1cc(C)c(C[NH2+]CCc2ccc(C)c(C)c2)c(O)c1 ZINC001182817036 1122190339 /nfs/dbraw/zinc/19/03/39/1122190339.db2.gz PGTOMRKJYSHQSS-UHFFFAOYSA-N 1 0 299.414 3.658 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]C[C@@H]1CCC[C@@H]2C[C@@H]21 ZINC001182919236 1122193477 /nfs/dbraw/zinc/19/34/77/1122193477.db2.gz XKWTVCCTYRRNPU-HFTRVMKXSA-N 1 0 272.436 3.587 20 10 CHCDRO CCC[C@@H](C[NH2+]Cc1cc(Cl)c(C)cc1O)OCC ZINC001183065274 1122204323 /nfs/dbraw/zinc/20/43/23/1122204323.db2.gz JTOWMSNZHDOKEF-ZDUSSCGKSA-N 1 0 285.815 3.649 20 10 CHCDRO CC[C@@H]1Cc2ccccc2C[N@@H+]1Cc1cccc(F)c1[O-] ZINC001205254345 1122206226 /nfs/dbraw/zinc/20/62/26/1122206226.db2.gz ZGJORNOSLBMNMM-MRXNPFEDSA-N 1 0 285.362 3.868 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]C[C@H]1CCCC12CC2 ZINC001183196728 1122210259 /nfs/dbraw/zinc/21/02/59/1122210259.db2.gz HPODEAPCRDMLEF-MRXNPFEDSA-N 1 0 272.436 3.731 20 10 CHCDRO CCc1cccc(C[NH2+]Cc2ccc3cccnc3c2)c1O ZINC001183291580 1122215839 /nfs/dbraw/zinc/21/58/39/1122215839.db2.gz JZMWYOOUKCCFQH-UHFFFAOYSA-N 1 0 292.382 3.793 20 10 CHCDRO Cc1cc(C[NH2+][C@H]2CCO[C@@H]2C)c(C)n1-c1cccc(C)c1 ZINC001183268609 1122216571 /nfs/dbraw/zinc/21/65/71/1122216571.db2.gz HUMXOHJWYVCFGV-APWZRJJASA-N 1 0 298.430 3.670 20 10 CHCDRO CC[C@H]1[C@@H](C)CC[N@@H+]1Cc1c(O)ccc2ccncc21 ZINC000774623150 1122221376 /nfs/dbraw/zinc/22/13/76/1122221376.db2.gz ZFRNCQVXRZNZAU-LRDDRELGSA-N 1 0 270.376 3.561 20 10 CHCDRO Oc1cccc2c1C[N@H+](C/C=C\c1ccc(F)cc1)C2 ZINC001183454768 1122223893 /nfs/dbraw/zinc/22/38/93/1122223893.db2.gz NNLMGLKHRJQLJF-IHWYPQMZSA-N 1 0 269.319 3.560 20 10 CHCDRO CCOc1ccc(C[NH2+][C@@H](C)c2cc(C)ccc2O)cc1 ZINC000273384813 1122229934 /nfs/dbraw/zinc/22/99/34/1122229934.db2.gz JBOKNFLFMQBHIV-AWEZNQCLSA-N 1 0 285.387 3.950 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2cccc(N(C)C)c2)c(O)c1 ZINC000273368969 1122230377 /nfs/dbraw/zinc/23/03/77/1122230377.db2.gz CEBLMPLVYAIWFF-AWEZNQCLSA-N 1 0 284.403 3.617 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)cn1 ZINC000273382779 1122230533 /nfs/dbraw/zinc/23/05/33/1122230533.db2.gz IPWAUSOOGHTRLR-CQSZACIVSA-N 1 0 296.414 3.825 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2cccc(N(C)C)c2)c(O)c1 ZINC000273368971 1122230735 /nfs/dbraw/zinc/23/07/35/1122230735.db2.gz CEBLMPLVYAIWFF-CQSZACIVSA-N 1 0 284.403 3.617 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC[C@@H]2CCO[C@H](C)C2)c(O)c1 ZINC000273386367 1122230824 /nfs/dbraw/zinc/23/08/24/1122230824.db2.gz CTMJLAVDHLXHEI-QLFBSQMISA-N 1 0 277.408 3.556 20 10 CHCDRO COCC[C@@H]([NH2+][C@H](C)c1cc(F)ccc1O)c1ccco1 ZINC000273391110 1122231518 /nfs/dbraw/zinc/23/15/18/1122231518.db2.gz DNDKQVORCMZDNW-BXUZGUMPSA-N 1 0 293.338 3.553 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccccn2)c(O)c1C ZINC000273427570 1122232425 /nfs/dbraw/zinc/23/24/25/1122232425.db2.gz UREUJQODVBPUCE-UONOGXRCSA-N 1 0 270.376 3.816 20 10 CHCDRO Cc1nc(CC[NH2+][C@H](C)c2cc(Cl)ccc2O)cs1 ZINC000273427481 1122233198 /nfs/dbraw/zinc/23/31/98/1122233198.db2.gz UPIJIFBKJUGLAI-SECBINFHSA-N 1 0 296.823 3.704 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCOC2(CCC2)C1)c1cc(Cl)ccc1O ZINC000273491825 1122236231 /nfs/dbraw/zinc/23/62/31/1122236231.db2.gz OKIKZCKABGZJPX-YPMHNXCESA-N 1 0 295.810 3.798 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCO[C@H](C(C)C)C2)c1 ZINC000273491807 1122236598 /nfs/dbraw/zinc/23/65/98/1122236598.db2.gz OKDBLFJBAMCUFA-ZQIUZPCESA-N 1 0 277.408 3.555 20 10 CHCDRO Cc1noc(C)c1CC[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000273607299 1122239899 /nfs/dbraw/zinc/23/98/99/1122239899.db2.gz UOABMCUXVSQBRR-LBPRGKRZSA-N 1 0 288.391 3.507 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCc3c2cccc3O)c1 ZINC000273578145 1122240160 /nfs/dbraw/zinc/24/01/60/1122240160.db2.gz MFFWYQJZVKVKRG-MLGOLLRUSA-N 1 0 283.371 3.744 20 10 CHCDRO Cc1ncc(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)s1 ZINC000273619249 1122240992 /nfs/dbraw/zinc/24/09/92/1122240992.db2.gz YMHUZOZGNBDSIQ-LLVKDONJSA-N 1 0 276.405 3.625 20 10 CHCDRO CC[C@H](C)C[C@H](CC)[NH2+]Cc1c([O-])cccc1F ZINC001183920008 1122248008 /nfs/dbraw/zinc/24/80/08/1122248008.db2.gz SKOPYHSGBAIYLS-RYUDHWBXSA-N 1 0 253.361 3.836 20 10 CHCDRO CCCOc1ccc(C[NH2+]Cc2ccc(C)o2)cc1C ZINC001203271727 1122274396 /nfs/dbraw/zinc/27/43/96/1122274396.db2.gz XDLHIPNEIJIPIU-UHFFFAOYSA-N 1 0 273.376 3.975 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCC[C@H](C)[C@H](C)C2)c1O ZINC001203602260 1122302768 /nfs/dbraw/zinc/30/27/68/1122302768.db2.gz LSTGZLFKRPTXRI-UONOGXRCSA-N 1 0 277.408 3.659 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCC[C@@H]2C)cc1 ZINC000071205991 1129045805 /nfs/dbraw/zinc/04/58/05/1129045805.db2.gz ILMJYGSBMUZUDR-YOEHRIQHSA-N 1 0 260.425 3.811 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)C[C@@H]2CCC=CO2)cc1 ZINC000774820873 1122318099 /nfs/dbraw/zinc/31/80/99/1122318099.db2.gz IMCQTRRUZUPQCG-SFHVURJKSA-N 1 0 288.435 3.657 20 10 CHCDRO C[C@@H](C[NH2+][C@@H](C)c1ccccc1O)N(C)c1ccccc1 ZINC000183419192 1129053409 /nfs/dbraw/zinc/05/34/09/1129053409.db2.gz DOZBMEWVSPJCRK-GJZGRUSLSA-N 1 0 284.403 3.568 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H]1CCO[C@@H](C(C)C)C1 ZINC000775140238 1122439675 /nfs/dbraw/zinc/43/96/75/1122439675.db2.gz LGPXMZXNXAPMCH-QZTJIDSGSA-N 1 0 290.451 3.565 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H](C)CC1CCOCC1 ZINC000775140975 1122440234 /nfs/dbraw/zinc/44/02/34/1122440234.db2.gz RUKYIJPVCXOBCR-HNNXBMFYSA-N 1 0 290.451 3.567 20 10 CHCDRO CCCN(Cc1sccc1OC)c1ccc(C[NH3+])cc1 ZINC000775141014 1122440525 /nfs/dbraw/zinc/44/05/25/1122440525.db2.gz SZWKMJGQZLNWTH-UHFFFAOYSA-N 1 0 290.432 3.632 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C[C@H]2CCCCS2)cc1 ZINC000156318832 1122472639 /nfs/dbraw/zinc/47/26/39/1122472639.db2.gz OGAXVYOSFJUFPR-QGZVFWFLSA-N 1 0 292.492 3.908 20 10 CHCDRO C[C@@H](C1CCCCC1)[N@H+](C)Cc1cc2c(cc1O)OCO2 ZINC000775206302 1122481372 /nfs/dbraw/zinc/48/13/72/1122481372.db2.gz MIDOSQAOPOCTQN-LBPRGKRZSA-N 1 0 291.391 3.522 20 10 CHCDRO COc1cccc(C[NH2+]Cc2cccc(C(C)C)c2)c1O ZINC000775330677 1122517285 /nfs/dbraw/zinc/51/72/85/1122517285.db2.gz VWAZHJRLJGZMAU-UHFFFAOYSA-N 1 0 285.387 3.814 20 10 CHCDRO C[C@@H]([NH2+]C/C=C/c1ccccc1)c1ccccc1O ZINC000183510843 1129060362 /nfs/dbraw/zinc/06/03/62/1129060362.db2.gz WDVPTBKWXMSDLB-DNGMOHDESA-N 1 0 253.345 3.756 20 10 CHCDRO CCc1ncc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)s1 ZINC000775364373 1122526907 /nfs/dbraw/zinc/52/69/07/1122526907.db2.gz POEAMNURUASDND-GFCCVEGCSA-N 1 0 289.448 3.622 20 10 CHCDRO CCc1ccc(CC[NH2+][C@@H](C)c2cc(OC)ccc2O)cc1 ZINC000775363454 1122528464 /nfs/dbraw/zinc/52/84/64/1122528464.db2.gz LHYIUQXKUCSWGW-AWEZNQCLSA-N 1 0 299.414 3.857 20 10 CHCDRO COc1cccc(F)c1[C@@H](C)[NH2+][C@@H](C)c1ccccc1O ZINC000183533447 1129060767 /nfs/dbraw/zinc/06/07/67/1129060767.db2.gz PSCRNVLYHKQOMX-NWDGAFQWSA-N 1 0 289.350 3.952 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H]2CCC[C@H]2OC)cc1 ZINC000775417561 1122558818 /nfs/dbraw/zinc/55/88/18/1122558818.db2.gz NCSRQESRKCYZMO-QILLFSRXSA-N 1 0 290.451 3.608 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccccc1O ZINC000775500895 1122629640 /nfs/dbraw/zinc/62/96/40/1122629640.db2.gz MEVMGYNDPFVXMK-INIZCTEOSA-N 1 0 283.371 3.568 20 10 CHCDRO CC[C@H]([NH2+][C@H]1C[C@@](C)(OC)C1(C)C)c1ccccc1O ZINC000775513164 1122633814 /nfs/dbraw/zinc/63/38/14/1122633814.db2.gz OONHHJIOUSRLHJ-JLJPHGGASA-N 1 0 277.408 3.637 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](COC)C1CC1)c1cc(Cl)ccc1O ZINC000775524605 1122642972 /nfs/dbraw/zinc/64/29/72/1122642972.db2.gz SUMNAYVHOBBEDA-KGLIPLIRSA-N 1 0 283.799 3.511 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(OC)cc1F)c1ccccc1O ZINC000775526512 1122644163 /nfs/dbraw/zinc/64/41/63/1122644163.db2.gz KWBBLHSABMKOHJ-MRXNPFEDSA-N 1 0 289.350 3.781 20 10 CHCDRO CC[C@@H]1CC[C@@H](C)[N@@H+]1Cc1ccc(N(C)CC)cc1 ZINC001192645539 1122654757 /nfs/dbraw/zinc/65/47/57/1122654757.db2.gz OJSPZLDCYYXLOD-GDBMZVCRSA-N 1 0 260.425 3.906 20 10 CHCDRO CC[C@H]([NH2+]CC1(CO)CCCC1)c1cc(Cl)ccc1O ZINC000775554112 1122662852 /nfs/dbraw/zinc/66/28/52/1122662852.db2.gz HLGMFGPAIBZDSK-AWEZNQCLSA-N 1 0 297.826 3.639 20 10 CHCDRO Cc1cc(C[NH2+][C@@H]2CCC[C@@H](C)[C@H]2C)ccc1N(C)C ZINC001193593150 1122699780 /nfs/dbraw/zinc/69/97/80/1122699780.db2.gz JGXREJXDLAEKFC-FRFSOERESA-N 1 0 274.452 3.975 20 10 CHCDRO COCC1(CC[NH2+][C@H](C)c2ccc(C)cc2O)CCC1 ZINC000293624807 1122715751 /nfs/dbraw/zinc/71/57/51/1122715751.db2.gz FZONSZSUEIQVJY-CQSZACIVSA-N 1 0 277.408 3.558 20 10 CHCDRO Cc1ccoc1C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000266177008 1129085007 /nfs/dbraw/zinc/08/50/07/1129085007.db2.gz DVZKUQYTJPSSIR-UHFFFAOYSA-N 1 0 284.403 3.868 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCCO[C@@H](c3ccccc3)C2)c1O ZINC000775679294 1122901279 /nfs/dbraw/zinc/90/12/79/1122901279.db2.gz VTBMSPGXHUFOOA-GOSISDBHSA-N 1 0 297.398 3.664 20 10 CHCDRO Cc1cccc(C[N@@H+]2CC[C@@H](c3ccc(F)cc3)C2)c1O ZINC000775690580 1122911200 /nfs/dbraw/zinc/91/12/00/1122911200.db2.gz PQIAOWKWFNUTCJ-OAHLLOKOSA-N 1 0 285.362 3.829 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCO[C@H](c3ccccc3C)C2)c1O ZINC000775703139 1122915186 /nfs/dbraw/zinc/91/51/86/1122915186.db2.gz KVQXCMMLCZLGMV-SFHVURJKSA-N 1 0 297.398 3.583 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCO[C@@H](c3ccccc3C)C2)c1O ZINC000775703138 1122915724 /nfs/dbraw/zinc/91/57/24/1122915724.db2.gz KVQXCMMLCZLGMV-GOSISDBHSA-N 1 0 297.398 3.583 20 10 CHCDRO CO[C@@H](C)C[N@H+](Cc1cc(Cl)cc(C)c1O)C(C)C ZINC000775715231 1122922383 /nfs/dbraw/zinc/92/23/83/1122922383.db2.gz USTMPIKYXLLAHV-LBPRGKRZSA-N 1 0 285.815 3.599 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CC[C@](C)(c3ccccc3)C2)c1 ZINC000775724864 1122925770 /nfs/dbraw/zinc/92/57/70/1122925770.db2.gz JARSKIKVQPFBPT-IBGZPJMESA-N 1 0 297.398 3.564 20 10 CHCDRO CC(C)C[N@H+](Cc1ccccc1)Cc1ccc(O)c(O)c1 ZINC001203875187 1122952984 /nfs/dbraw/zinc/95/29/84/1122952984.db2.gz JTHZXTLBMDAPPZ-UHFFFAOYSA-N 1 0 285.387 3.756 20 10 CHCDRO Oc1ccc(C[N@@H+]2CC[C@@H](C3CCCCC3)C2)cc1O ZINC001203879177 1122958156 /nfs/dbraw/zinc/95/81/56/1122958156.db2.gz GTCSFDBWGKIOPM-OAHLLOKOSA-N 1 0 275.392 3.500 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]CC1(c2ccccc2)CC1 ZINC000775919546 1123016782 /nfs/dbraw/zinc/01/67/82/1123016782.db2.gz MHWFBAZUZSKLAU-UHFFFAOYSA-N 1 0 287.790 3.867 20 10 CHCDRO Cc1ccsc1C[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC001199842264 1123042470 /nfs/dbraw/zinc/04/24/70/1123042470.db2.gz HGHSIZRSZCENEN-SNAWJCMRSA-N 1 0 286.444 3.926 20 10 CHCDRO Oc1c(C[NH+]2CC(C(F)(F)F)C2)ccc2ccccc21 ZINC000894891344 1123043932 /nfs/dbraw/zinc/04/39/32/1123043932.db2.gz BBRQZTLWFZRZLA-UHFFFAOYSA-N 1 0 281.277 3.540 20 10 CHCDRO COc1ccc(O)c(C[NH2+]C2CC(C)(c3ccccc3)C2)c1 ZINC000776169805 1123100902 /nfs/dbraw/zinc/10/09/02/1123100902.db2.gz QDCFCLOWLCNUBP-UHFFFAOYSA-N 1 0 297.398 3.611 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H]2CC[C@H]3CCC[C@@H]3C2)c1O ZINC000776174877 1123101430 /nfs/dbraw/zinc/10/14/30/1123101430.db2.gz IMUAJWNGRJYPNX-IIAWOOMASA-N 1 0 259.393 3.759 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@]2(C)CCCc3ccccc32)c1 ZINC000776175323 1123102367 /nfs/dbraw/zinc/10/23/67/1123102367.db2.gz LBONQPXOBTXIAO-LJQANCHMSA-N 1 0 297.398 3.742 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]Cc2coc3ccccc23)c1 ZINC000776175171 1123102626 /nfs/dbraw/zinc/10/26/26/1123102626.db2.gz LVGODSVMWCEKFZ-UHFFFAOYSA-N 1 0 297.354 3.827 20 10 CHCDRO Cc1cccc(C[NH2+][C@H](C)[C@@H]2Oc3ccccc3[C@@H]2C)c1O ZINC000776230449 1123159555 /nfs/dbraw/zinc/15/95/55/1123159555.db2.gz ITQPILMLPXRSQT-IQUTYRLHSA-N 1 0 297.398 3.743 20 10 CHCDRO CCOc1ccc(N2CC[NH+](CCC(C)(C)C)CC2)cc1 ZINC001202114606 1123175542 /nfs/dbraw/zinc/17/55/42/1123175542.db2.gz AYNMLYRFAMMIEA-UHFFFAOYSA-N 1 0 290.451 3.644 20 10 CHCDRO CCCN(CCC)c1ccc(C[NH2+][C@@H](CC)[C@@H](C)O)cc1 ZINC001202381517 1123204441 /nfs/dbraw/zinc/20/44/41/1123204441.db2.gz OSEMNMLXBJDLHQ-QAPCUYQASA-N 1 0 292.467 3.562 20 10 CHCDRO CN(C)c1ccc(C[NH2+]CC(C)(C)C2CCC2)cc1F ZINC001202444643 1123209203 /nfs/dbraw/zinc/20/92/03/1123209203.db2.gz JWZBBOVUSOJRBK-UHFFFAOYSA-N 1 0 278.415 3.808 20 10 CHCDRO CCOC1CC[NH+](Cc2cc(C(C)C)c(C)cc2O)CC1 ZINC000193711350 1129107098 /nfs/dbraw/zinc/10/70/98/1129107098.db2.gz WZGBUZUMOQRXRJ-UHFFFAOYSA-N 1 0 291.435 3.825 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C[C@H](C)c2ccccn2)cc1 ZINC000850343081 1123254571 /nfs/dbraw/zinc/25/45/71/1123254571.db2.gz YXOOVWVENQVCKL-INIZCTEOSA-N 1 0 297.446 3.821 20 10 CHCDRO C[C@@H](C[NH2+]C/C=C\c1ccc(N(C)C)cc1)c1ccccn1 ZINC000850342303 1123254832 /nfs/dbraw/zinc/25/48/32/1123254832.db2.gz KPLTVXCSSJGUKU-WLMCBFPDSA-N 1 0 295.430 3.554 20 10 CHCDRO CSCC1(CC[NH2+]Cc2ccc(N(C)C)c(F)c2)CC1 ZINC000850355248 1123255782 /nfs/dbraw/zinc/25/57/82/1123255782.db2.gz CKWHFPXAZZPIQZ-UHFFFAOYSA-N 1 0 296.455 3.515 20 10 CHCDRO CCOc1ccc(C[NH2+][C@@H]2CCc3ccccc32)c(O)c1 ZINC000850373279 1123259650 /nfs/dbraw/zinc/25/96/50/1123259650.db2.gz HDWUWAODAFFXHE-QGZVFWFLSA-N 1 0 283.371 3.568 20 10 CHCDRO CCOCc1cc(C[NH2+][C@@H](C(C)C)C2CC2)ccc1OC ZINC000850396803 1123263087 /nfs/dbraw/zinc/26/30/87/1123263087.db2.gz AVRUIRGUAJYUFS-SFHVURJKSA-N 1 0 291.435 3.756 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](C)c1ccccn1)c1ccc(C)cc1O ZINC000850481643 1123273551 /nfs/dbraw/zinc/27/35/51/1123273551.db2.gz IHMFWOAETPCYHH-ZBFHGGJFSA-N 1 0 284.403 3.940 20 10 CHCDRO CC[C@H](COCC1CC1)[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000850492212 1123274628 /nfs/dbraw/zinc/27/46/28/1123274628.db2.gz BRMBJYPJVNESKE-GDBMZVCRSA-N 1 0 291.435 3.865 20 10 CHCDRO CC[C@@H](COCC1CC1)[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000850495102 1123275386 /nfs/dbraw/zinc/27/53/86/1123275386.db2.gz WKCSYJQFSOKJRK-PBHICJAKSA-N 1 0 290.451 3.608 20 10 CHCDRO C[C@H]([NH2+][C@@H]1C=CCC1)c1cc(Br)ccc1O ZINC000850507185 1123276935 /nfs/dbraw/zinc/27/69/35/1123276935.db2.gz DOONKBVDHDCJHK-GXSJLCMTSA-N 1 0 282.181 3.524 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1C=CCC1)c1cc(Cl)ccc1O ZINC000850510354 1123277634 /nfs/dbraw/zinc/27/76/34/1123277634.db2.gz SUDWVOKEVOCSAA-YPMHNXCESA-N 1 0 251.757 3.805 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1cscn1)c1ccc(C)cc1O ZINC000850511707 1123278170 /nfs/dbraw/zinc/27/81/70/1123278170.db2.gz LRDYUYQLOMRFSK-AAEUAGOBSA-N 1 0 276.405 3.959 20 10 CHCDRO CC[C@H]([NH2+][C@H]1C[C@@H](O)c2ccccc21)c1ccc(C)cc1O ZINC000850530584 1123285445 /nfs/dbraw/zinc/28/54/45/1123285445.db2.gz ZZQQAKACHAVTQC-JENIJYKNSA-N 1 0 297.398 3.920 20 10 CHCDRO CC[C@H]([NH2+][C@H]1C[C@H](O)c2ccccc21)c1ccccc1O ZINC000850530241 1123285452 /nfs/dbraw/zinc/28/54/52/1123285452.db2.gz XTTKWQMIMRVCPM-BQFCYCMXSA-N 1 0 283.371 3.611 20 10 CHCDRO CC[C@H]([NH2+]CC[C@@]1(C)CC1(F)F)c1ccccc1O ZINC000850536001 1123287025 /nfs/dbraw/zinc/28/70/25/1123287025.db2.gz GNKSCTXIHZZZAC-JSGCOSHPSA-N 1 0 269.335 3.868 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1cc(Cl)ccc1O)C1CC1 ZINC000850539153 1123288029 /nfs/dbraw/zinc/28/80/29/1123288029.db2.gz BEFXVKYZAOTNCQ-TVQRCGJNSA-N 1 0 253.773 3.885 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H](C)C2CCC(F)CC2)c1O ZINC000850553727 1123291122 /nfs/dbraw/zinc/29/11/22/1123291122.db2.gz BPXPUNWMRHNXKW-KBHBFKLGSA-N 1 0 295.398 3.968 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCC2SCCS2)c(O)c1C ZINC000850571102 1123295281 /nfs/dbraw/zinc/29/52/81/1123295281.db2.gz QIBMVDMDBPZHRS-GFCCVEGCSA-N 1 0 297.489 3.856 20 10 CHCDRO CC[C@H](c1ccccc1)[N@H+](C)Cc1ccccc1O ZINC000109770427 1123326472 /nfs/dbraw/zinc/32/64/72/1123326472.db2.gz CBBUJYCIIPVJLA-MRXNPFEDSA-N 1 0 255.361 3.975 20 10 CHCDRO CC[C@H]([NH2+]CC1(SC)CC1)c1ccc(N(C)C)cc1 ZINC000193817702 1129115420 /nfs/dbraw/zinc/11/54/20/1129115420.db2.gz MIFXXJANERCDTC-HNNXBMFYSA-N 1 0 278.465 3.689 20 10 CHCDRO CC[C@@H]1C[N@H+](C/C=C/c2ccc(N(C)C)cc2)CCS1 ZINC001204769370 1123425170 /nfs/dbraw/zinc/42/51/70/1123425170.db2.gz SZRHVJWAALEWMG-FUTAKVPZSA-N 1 0 290.476 3.593 20 10 CHCDRO CC[C@@H]1C[N@H+](Cc2c(O)ccc3ccccc32)C[C@H](C)O1 ZINC000111168328 1123428054 /nfs/dbraw/zinc/42/80/54/1123428054.db2.gz ACNKTYNDCMHGMV-DZGCQCFKSA-N 1 0 285.387 3.545 20 10 CHCDRO C[C@H]([NH2+]Cc1cccc(N)c1)c1cc2c(cc1O)CCCC2 ZINC000854217008 1123478242 /nfs/dbraw/zinc/47/82/42/1123478242.db2.gz GZLQAHPYUZVONE-ZDUSSCGKSA-N 1 0 296.414 3.704 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CCc3cc(N)ccc32)c(O)c1 ZINC000854225910 1123478252 /nfs/dbraw/zinc/47/82/52/1123478252.db2.gz HBFKKXVKAZYMFQ-SUMWQHHRSA-N 1 0 296.414 3.929 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH+]1CCC2(CCCCO2)CC1 ZINC000895659544 1123502623 /nfs/dbraw/zinc/50/26/23/1123502623.db2.gz ZSUNFEZTFQLYGH-UHFFFAOYSA-N 1 0 295.810 3.581 20 10 CHCDRO Oc1c(C[NH2+]C[C@@H]2CC3(CCC3)CO2)ccc2ccccc21 ZINC000895790775 1123514263 /nfs/dbraw/zinc/51/42/63/1123514263.db2.gz LPXLDCAIFIEBJP-INIZCTEOSA-N 1 0 297.398 3.594 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2csc(C(C)(C)C)n2)c1 ZINC000113332269 1123521870 /nfs/dbraw/zinc/52/18/70/1123521870.db2.gz USXASCPSMIBGJX-UHFFFAOYSA-N 1 0 290.432 3.744 20 10 CHCDRO Oc1ccccc1C[N@H+](Cc1ccccn1)C1CCCC1 ZINC000113506128 1123529852 /nfs/dbraw/zinc/52/98/52/1123529852.db2.gz PCKOCVVTBVDAPH-UHFFFAOYSA-N 1 0 282.387 3.732 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CC[C@@H]2CC2(Cl)Cl)cc1C ZINC000856807401 1123570152 /nfs/dbraw/zinc/57/01/52/1123570152.db2.gz OBLRVMSANSFJHJ-GFCCVEGCSA-N 1 0 288.218 3.683 20 10 CHCDRO Oc1c(C[NH2+]CC[C@@H]2CC2(F)F)ccc2ccccc21 ZINC000857059712 1123582998 /nfs/dbraw/zinc/58/29/98/1123582998.db2.gz XIEHQYDPVFMEIX-CYBMUJFWSA-N 1 0 277.314 3.680 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC[C@H]2CC2(F)F)c(O)c1C ZINC000857080584 1123585030 /nfs/dbraw/zinc/58/50/30/1123585030.db2.gz IWLLKJUIVFJUSM-NEPJUHHUSA-N 1 0 269.335 3.705 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CC[C@@H]2CC2(Cl)Cl)c1 ZINC000857081610 1123586186 /nfs/dbraw/zinc/58/61/86/1123586186.db2.gz HDYZMGXXDVSLLZ-WDEREUQCSA-N 1 0 288.218 3.935 20 10 CHCDRO CCc1cccc(C[NH2+][C@@H](c2ccccn2)C2CC2)c1O ZINC000896609263 1123605435 /nfs/dbraw/zinc/60/54/35/1123605435.db2.gz MOPMMASOZJKDSV-QGZVFWFLSA-N 1 0 282.387 3.591 20 10 CHCDRO COc1ccc(C)cc1C[NH2+]Cc1ccc(N(C)C)cc1C ZINC000115629511 1123620273 /nfs/dbraw/zinc/62/02/73/1123620273.db2.gz SEAJJWLLAWAHQL-UHFFFAOYSA-N 1 0 298.430 3.668 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CC[C@@H](C)C[C@@H]2C)c1O ZINC000228631324 1123634665 /nfs/dbraw/zinc/63/46/65/1123634665.db2.gz KPFGFBCITUUHPG-MNOVXSKESA-N 1 0 283.799 3.675 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2cccc(C3CC3)c2)c1 ZINC000858239970 1123639100 /nfs/dbraw/zinc/63/91/00/1123639100.db2.gz XSUXHMVBGHQZMA-UHFFFAOYSA-N 1 0 267.372 3.868 20 10 CHCDRO Cc1cc(C[N@@H+]2CCCC(F)(F)CC2)ccc1N(C)C ZINC000859540976 1123700993 /nfs/dbraw/zinc/70/09/93/1123700993.db2.gz NXGMHWKUVYXVIH-UHFFFAOYSA-N 1 0 282.378 3.682 20 10 CHCDRO CC1(C)[C@H](C(F)(F)F)CC[N@@H+]1Cc1ccccc1O ZINC000276200533 1129142868 /nfs/dbraw/zinc/14/28/68/1129142868.db2.gz NPVDXHXLWNNOLV-GFCCVEGCSA-N 1 0 273.298 3.555 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2C[C@H](C)O[C@H](C)[C@@H]2C)cc1C(C)C ZINC000783546684 1123744910 /nfs/dbraw/zinc/74/49/10/1123744910.db2.gz SLLSXRTVRJWXLG-SOUVJXGZSA-N 1 0 291.435 3.822 20 10 CHCDRO CC1(C)[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ccccc1O ZINC000276200536 1129143147 /nfs/dbraw/zinc/14/31/47/1129143147.db2.gz NPVDXHXLWNNOLV-LBPRGKRZSA-N 1 0 273.298 3.555 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C2Cc3ccccc3C2)c1 ZINC000184005857 1129145291 /nfs/dbraw/zinc/14/52/91/1129145291.db2.gz DFAYEHSCHMWBPW-CYBMUJFWSA-N 1 0 267.372 3.519 20 10 CHCDRO CCCN(C[C@@]1(C)CCCS1)c1ccc(C[NH3+])cc1 ZINC000862347655 1123801710 /nfs/dbraw/zinc/80/17/10/1123801710.db2.gz KAMCHQFLONWSCV-MRXNPFEDSA-N 1 0 278.465 3.647 20 10 CHCDRO COCC[N@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000195527393 1129146262 /nfs/dbraw/zinc/14/62/62/1129146262.db2.gz JDQLPKDMRZWDSN-HNNXBMFYSA-N 1 0 285.387 3.602 20 10 CHCDRO COCC[N@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000195527394 1129146355 /nfs/dbraw/zinc/14/63/55/1129146355.db2.gz JDQLPKDMRZWDSN-OAHLLOKOSA-N 1 0 285.387 3.602 20 10 CHCDRO CCOc1ccc(C[NH+]2C[C@@H](C)C(F)(F)[C@H](C)C2)c(O)c1 ZINC000862444678 1123811693 /nfs/dbraw/zinc/81/16/93/1123811693.db2.gz XPSBAEBLKKFOCV-VXGBXAGGSA-N 1 0 299.361 3.514 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCC[C@@H]2C[C@@H]21)c1ccc(N(C)C)cc1 ZINC000840820211 1123826830 /nfs/dbraw/zinc/82/68/30/1123826830.db2.gz QRQGZMNVSVEDHN-YVVXQTMVSA-N 1 0 258.409 3.592 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)c1ccc2ccccc2c1O)c1ccn(C)n1 ZINC000840818793 1123827793 /nfs/dbraw/zinc/82/77/93/1123827793.db2.gz ZQLLANPEGMAJGC-STQMWFEESA-N 1 0 295.386 3.691 20 10 CHCDRO Cc1cc(C[N@H+](C)CC2CC2)c(O)c(C(C)(C)C)c1 ZINC000195640095 1129147854 /nfs/dbraw/zinc/14/78/54/1129147854.db2.gz MCOSDWGJJNLGAT-UHFFFAOYSA-N 1 0 261.409 3.840 20 10 CHCDRO Cc1cc(C[NH2+]Cc2ccc3c(c2)CCCN3C)c(C)o1 ZINC000119414069 1123863130 /nfs/dbraw/zinc/86/31/30/1123863130.db2.gz LPPNDDLKBFIMFW-UHFFFAOYSA-N 1 0 284.403 3.569 20 10 CHCDRO COc1ccccc1C[NH2+]Cc1c(O)cc(C)cc1Cl ZINC000840873859 1123878144 /nfs/dbraw/zinc/87/81/44/1123878144.db2.gz VKPAJGPCLAESJQ-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO C[C@@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1cc2c(cc1O)CCC2 ZINC000794670532 1123924630 /nfs/dbraw/zinc/92/46/30/1123924630.db2.gz XRVJLMONKNLURK-QMTHXVAHSA-N 1 0 299.336 3.654 20 10 CHCDRO CO[C@]1(C)CCC[N@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000794653798 1123925487 /nfs/dbraw/zinc/92/54/87/1123925487.db2.gz FSIISGPUAJZOLR-GOSISDBHSA-N 1 0 291.435 3.825 20 10 CHCDRO CC[C@H]([NH2+]CCN(C(C)C)C(C)C)c1ccccc1O ZINC000084523727 1129153579 /nfs/dbraw/zinc/15/35/79/1129153579.db2.gz VJUKENBSOHYZPQ-INIZCTEOSA-N 1 0 278.440 3.552 20 10 CHCDRO CC[C@@H]([NH2+]CCOc1ccccc1)c1ccc(C)cc1O ZINC000794797514 1123949664 /nfs/dbraw/zinc/94/96/64/1123949664.db2.gz ZOLKIMMZRBFNGN-QGZVFWFLSA-N 1 0 285.387 3.820 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](O)c1ccc(C)cc1)c1ccc(C)cc1O ZINC000794802496 1123950372 /nfs/dbraw/zinc/95/03/72/1123950372.db2.gz NNWGJFXGCOJDBK-MJGOQNOKSA-N 1 0 299.414 3.783 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](C)c1ccncc1)c1ccc(C)cc1O ZINC000794800311 1123950827 /nfs/dbraw/zinc/95/08/27/1123950827.db2.gz CHMGFFZXTFUYEX-PBHICJAKSA-N 1 0 284.403 3.940 20 10 CHCDRO CC[C@@H]([NH2+]CCCCCOC)c1ccc(C)cc1O ZINC000794803519 1123952331 /nfs/dbraw/zinc/95/23/31/1123952331.db2.gz JMPUBPFTFORYLR-OAHLLOKOSA-N 1 0 265.397 3.558 20 10 CHCDRO CC[C@@H]([NH2+]CCOC1CCCC1)c1ccc(C)cc1O ZINC000794807290 1123954124 /nfs/dbraw/zinc/95/41/24/1123954124.db2.gz XMAVQVFHSFSCSK-MRXNPFEDSA-N 1 0 277.408 3.701 20 10 CHCDRO CC[C@@H]([NH2+]CCCC(C)(C)CO)c1ccc(C)cc1O ZINC000794805616 1123955301 /nfs/dbraw/zinc/95/53/01/1123955301.db2.gz XWQCTQLLEMEOLB-OAHLLOKOSA-N 1 0 279.424 3.540 20 10 CHCDRO CCC(CC)[C@H](O)C[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000794809110 1123957016 /nfs/dbraw/zinc/95/70/16/1123957016.db2.gz QJILAAXDZXXUAD-DOTOQJQBSA-N 1 0 279.424 3.538 20 10 CHCDRO CC[C@@H]1CCC[C@@H]([NH2+]Cc2ccc3c(c2)CCO3)C1 ZINC000085064333 1129155997 /nfs/dbraw/zinc/15/59/97/1129155997.db2.gz HFNYRIQITCQIHP-CZUORRHYSA-N 1 0 259.393 3.680 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](O)c1cccc(C)c1)c1ccc(C)cc1O ZINC000794817031 1123959713 /nfs/dbraw/zinc/95/97/13/1123959713.db2.gz OHRLIJIPGMQYFX-IEBWSBKVSA-N 1 0 299.414 3.783 20 10 CHCDRO C[C@H]([NH2+]CCC1(C)CC1)c1cc(Cl)ccc1O ZINC000794829704 1123962227 /nfs/dbraw/zinc/96/22/27/1123962227.db2.gz WFMVBWDJLUGUPW-JTQLQIEISA-N 1 0 253.773 3.886 20 10 CHCDRO CC[C@H]([NH2+]CCc1cccc(C)n1)c1ccc(N(C)C)cc1 ZINC000794829596 1123962614 /nfs/dbraw/zinc/96/26/14/1123962614.db2.gz UHTUEQJTNOBKJY-IBGZPJMESA-N 1 0 297.446 3.739 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](C)N(CC)CC)c1cc(Cl)ccc1O ZINC000794832454 1123963632 /nfs/dbraw/zinc/96/36/32/1123963632.db2.gz SIHNPWKIAPQRPS-IUODEOHRSA-N 1 0 298.858 3.817 20 10 CHCDRO COC1([C@H](C)[NH2+][C@@H](C)c2cc(Cl)ccc2O)CCC1 ZINC000840884906 1123996899 /nfs/dbraw/zinc/99/68/99/1123996899.db2.gz ROPBYZVIHFORGJ-QWRGUYRKSA-N 1 0 283.799 3.654 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CC2CCSCC2)c(Cl)c1 ZINC000840897839 1124011199 /nfs/dbraw/zinc/01/11/99/1124011199.db2.gz GRYIRPOKYCXARE-UHFFFAOYSA-N 1 0 285.840 3.587 20 10 CHCDRO Oc1ccccc1C[NH2+]C[C@@H]1CC=CC[C@H]1C(F)(F)F ZINC000865781953 1124014644 /nfs/dbraw/zinc/01/46/44/1124014644.db2.gz KICXSQOWOWQTQI-WCQYABFASA-N 1 0 285.309 3.627 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H]2CC=CC[C@H]2C(F)(F)F)c1 ZINC000865832600 1124019312 /nfs/dbraw/zinc/01/93/12/1124019312.db2.gz SGTDBMRQQOBKQB-CHWSQXEVSA-N 1 0 285.309 3.687 20 10 CHCDRO Cc1cccc(F)c1C[NH2+]Cc1ccc(N(C)C)cc1C ZINC000840935281 1124030700 /nfs/dbraw/zinc/03/07/00/1124030700.db2.gz KKLHNIKNOQUHGF-UHFFFAOYSA-N 1 0 286.394 3.798 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CC[C@H]2CCSC2)c(O)c1 ZINC000866404899 1124063713 /nfs/dbraw/zinc/06/37/13/1124063713.db2.gz XHAFYJREEBLEAF-KBPBESRZSA-N 1 0 279.449 3.803 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCO[C@H]2c2ccccc2)c(O)c1 ZINC000866403551 1124063958 /nfs/dbraw/zinc/06/39/58/1124063958.db2.gz BHUVLOJXLZIGLF-BJZITVGISA-N 1 0 297.398 3.881 20 10 CHCDRO COc1cccc(C[NH2+][C@@H]2CCC[C@H]2C(C)(C)C)c1O ZINC000840971622 1124067283 /nfs/dbraw/zinc/06/72/83/1124067283.db2.gz QBEZXLMANHGHRG-ZIAGYGMSSA-N 1 0 277.408 3.705 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2cccc(F)c2F)c(O)c1 ZINC000866476132 1124069799 /nfs/dbraw/zinc/06/97/99/1124069799.db2.gz IOESEAJDYINMNF-LLVKDONJSA-N 1 0 277.314 3.830 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(C)o1)c1ccc(N(C)C)cc1 ZINC000866479621 1124071092 /nfs/dbraw/zinc/07/10/92/1124071092.db2.gz XQWPYSYEIQOVCN-QGZVFWFLSA-N 1 0 272.392 3.895 20 10 CHCDRO Cc1ccc(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)o1 ZINC000866479096 1124071170 /nfs/dbraw/zinc/07/11/70/1124071170.db2.gz PSMYDFVTNXTZJQ-RNCFNFMXSA-N 1 0 275.323 3.771 20 10 CHCDRO C[C@H]([NH2+][C@H](C1CCC1)[C@@H]1CCCO1)c1cc(F)ccc1O ZINC000866491474 1124072540 /nfs/dbraw/zinc/07/25/40/1124072540.db2.gz RWQGTOCNMZXTJZ-MZPVMMEZSA-N 1 0 293.382 3.530 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCC23CCOCC3)c1 ZINC000866528917 1124077735 /nfs/dbraw/zinc/07/77/35/1124077735.db2.gz KEYWWMWURGQINE-LSDHHAIUSA-N 1 0 289.419 3.558 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCC23CCOCC3)c(O)c1 ZINC000866529660 1124078806 /nfs/dbraw/zinc/07/88/06/1124078806.db2.gz RJXDFCMBXDFFCP-GJZGRUSLSA-N 1 0 289.419 3.558 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ncc(Cl)s2)c(O)c1 ZINC000872113732 1124687399 /nfs/dbraw/zinc/68/73/99/1124687399.db2.gz RXOXXSJKKOTEGV-SNVBAGLBSA-N 1 0 296.823 3.970 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ncc(Cl)s2)c(O)c1C ZINC000872116117 1124687636 /nfs/dbraw/zinc/68/76/36/1124687636.db2.gz OJHMFRAWLGLZPG-SNVBAGLBSA-N 1 0 296.823 3.970 20 10 CHCDRO CCCOc1ccc(C[NH2+]CCc2nccs2)cc1C ZINC000873031583 1124734391 /nfs/dbraw/zinc/73/43/91/1124734391.db2.gz XFEMGYOZPFFTFM-UHFFFAOYSA-N 1 0 290.432 3.573 20 10 CHCDRO C[C@@H]([NH2+]CC[C@H]1CNc2ccccc21)c1ccccc1O ZINC000873236879 1124753337 /nfs/dbraw/zinc/75/33/37/1124753337.db2.gz JYFASCWDWIXKLR-KGLIPLIRSA-N 1 0 282.387 3.642 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(N)cc(F)c1)c1ccc(C)cc1O ZINC000873288861 1124762602 /nfs/dbraw/zinc/76/26/02/1124762602.db2.gz MZBWIBWATRYLMF-INIZCTEOSA-N 1 0 288.366 3.663 20 10 CHCDRO CCCC[NH2+][C@@H](CC)c1cc(Br)ccc1O ZINC000019907044 1124768865 /nfs/dbraw/zinc/76/88/65/1124768865.db2.gz FGVUWZURKDFRCI-LBPRGKRZSA-N 1 0 286.213 3.996 20 10 CHCDRO COc1ccc(CC[NH2+][C@@H](C)c2ccc(C)cc2O)cc1 ZINC000020088163 1124804489 /nfs/dbraw/zinc/80/44/89/1124804489.db2.gz PBCYGEVDMBCNOZ-AWEZNQCLSA-N 1 0 285.387 3.603 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]CCCc2ccccc2)c1 ZINC000020122739 1124807275 /nfs/dbraw/zinc/80/72/75/1124807275.db2.gz RNVVXZKVRKBMSW-AWEZNQCLSA-N 1 0 285.387 3.684 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccccn1)c1ccc2ccccc2c1O ZINC000020827929 1124879197 /nfs/dbraw/zinc/87/91/97/1124879197.db2.gz YUGNLKOJMLMXDB-CQSZACIVSA-N 1 0 292.382 3.834 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC000876636254 1124965484 /nfs/dbraw/zinc/96/54/84/1124965484.db2.gz DAEBJCJHBUGGNC-KRWDZBQOSA-N 1 0 283.371 3.743 20 10 CHCDRO Cc1ccc(C[N@@H+]2CCCO[C@H](c3ccccc3)C2)c(O)c1 ZINC000876683445 1124971217 /nfs/dbraw/zinc/97/12/17/1124971217.db2.gz BSQIVOXCULHBSH-IBGZPJMESA-N 1 0 297.398 3.664 20 10 CHCDRO Cc1ccc(C[NH2+][C@H]2CCCc3ccccc32)c(O)c1 ZINC000876886174 1124986443 /nfs/dbraw/zinc/98/64/43/1124986443.db2.gz RZZAWJRRQURHFI-KRWDZBQOSA-N 1 0 267.372 3.868 20 10 CHCDRO Cc1ccc2c(c1C)OC[C@H]2[NH2+]Cc1c(C)cccc1O ZINC000876876064 1124987260 /nfs/dbraw/zinc/98/72/60/1124987260.db2.gz JLAXPNVOIDBSDR-MRXNPFEDSA-N 1 0 283.371 3.541 20 10 CHCDRO Cc1ccc(C[NH2+][C@H]2COc3c2ccc(C)c3C)c(O)c1 ZINC000876876776 1124987357 /nfs/dbraw/zinc/98/73/57/1124987357.db2.gz UQCCKGXOSDHGBP-INIZCTEOSA-N 1 0 283.371 3.541 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]Cc1cccc(OC(C)C)c1 ZINC000876945005 1124991169 /nfs/dbraw/zinc/99/11/69/1124991169.db2.gz XGEPTVUQXIGFIR-UHFFFAOYSA-N 1 0 285.387 3.778 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2ccc([C@H]3C[C@H]3C)o2)c(O)c1 ZINC000876946427 1124991803 /nfs/dbraw/zinc/99/18/03/1124991803.db2.gz QYMUWTZBQIPMTM-DOMZBBRYSA-N 1 0 271.360 3.707 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]Cc1ccc([C@H]2C[C@H]2C)o1 ZINC000876945613 1124991813 /nfs/dbraw/zinc/99/18/13/1124991813.db2.gz GLKSEFPUONIZKE-OCCSQVGLSA-N 1 0 271.360 3.707 20 10 CHCDRO CC(C)O[C@H](C[NH2+]Cc1ccccc1O)c1ccccc1 ZINC000876996056 1124996107 /nfs/dbraw/zinc/99/61/07/1124996107.db2.gz MUDINKBUSYMRKL-GOSISDBHSA-N 1 0 285.387 3.648 20 10 CHCDRO CCOc1ccc(C[NH2+]Cc2ccc(C)cc2O)cc1F ZINC000877008409 1124996755 /nfs/dbraw/zinc/99/67/55/1124996755.db2.gz KFWZFOZDMFFHMS-UHFFFAOYSA-N 1 0 289.350 3.528 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@@H]2CCCSC2)cc1Cl ZINC000825940289 1125018699 /nfs/dbraw/zinc/01/86/99/1125018699.db2.gz RTYVIBKWWIZLEZ-NSHDSACASA-N 1 0 285.840 3.587 20 10 CHCDRO Cc1ccc(C[NH2+][C@H]2CCO[C@H](c3ccccc3)C2)c(O)c1 ZINC000877377137 1125023939 /nfs/dbraw/zinc/02/39/39/1125023939.db2.gz VZUREGKNLBRDQL-HKUYNNGSSA-N 1 0 297.398 3.711 20 10 CHCDRO Cc1ccc(C[NH2+][C@H]2CCCc3cn(C(C)C)nc32)c(O)c1 ZINC000877375947 1125024023 /nfs/dbraw/zinc/02/40/23/1125024023.db2.gz JOSBBHXHBAIMEU-INIZCTEOSA-N 1 0 299.418 3.645 20 10 CHCDRO Cc1ccc(C[N@@H+]2C[C@@H](C)C[C@H]2c2cccnc2)c(O)c1 ZINC000877343212 1125024707 /nfs/dbraw/zinc/02/47/07/1125024707.db2.gz VXDAANLUIBIBSB-YOEHRIQHSA-N 1 0 282.387 3.679 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(C)cc2F)c1 ZINC000877532401 1125040702 /nfs/dbraw/zinc/04/07/02/1125040702.db2.gz FVLPHUVYVWQPIH-LBPRGKRZSA-N 1 0 289.350 3.699 20 10 CHCDRO Cc1ccc(C[N@@H+]2CCSC3(CCC3)CC2)c(O)c1 ZINC000877587035 1125049900 /nfs/dbraw/zinc/04/99/00/1125049900.db2.gz BOXIVPPHKIRQSY-UHFFFAOYSA-N 1 0 277.433 3.562 20 10 CHCDRO CCO[P@](C)(=O)CC[C@H](C)[NH2+]Cc1cc(C)ccc1O ZINC000877652771 1125057127 /nfs/dbraw/zinc/05/71/27/1125057127.db2.gz NSZHHIUXAPXQMZ-RBZFPXEDSA-N 1 0 299.351 3.513 20 10 CHCDRO Cc1ccc(C[NH2+]CC(C)(C)CC(F)(F)F)c(O)c1 ZINC000877644516 1125058101 /nfs/dbraw/zinc/05/81/01/1125058101.db2.gz WVIVIPSTBBGACB-UHFFFAOYSA-N 1 0 275.314 3.769 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2ccc(C(C)(C)C)o2)c(O)c1 ZINC000877734668 1125069708 /nfs/dbraw/zinc/06/97/08/1125069708.db2.gz DNZBTKDHYKZHQS-UHFFFAOYSA-N 1 0 273.376 3.881 20 10 CHCDRO CCOc1cc(F)cc(C[NH2+][C@@H](C)c2ccccc2O)c1 ZINC000877757976 1125073778 /nfs/dbraw/zinc/07/37/78/1125073778.db2.gz BFQJRACPDINWSM-LBPRGKRZSA-N 1 0 289.350 3.781 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)c2ccccc2O)c(Cl)c1 ZINC000877757124 1125074317 /nfs/dbraw/zinc/07/43/17/1125074317.db2.gz ICXXQISUGXOLBT-NSHDSACASA-N 1 0 291.778 3.905 20 10 CHCDRO C[C@H]([NH2+]Cc1csc(C(C)(C)C)n1)c1ccccc1O ZINC000877757090 1125075437 /nfs/dbraw/zinc/07/54/37/1125075437.db2.gz FSSMOYLYFZBEFO-NSHDSACASA-N 1 0 290.432 3.997 20 10 CHCDRO CC(C)c1cc([C@H]2CCC[N@H+](Cc3ccccc3O)C2)[nH]n1 ZINC000877785376 1125081658 /nfs/dbraw/zinc/08/16/58/1125081658.db2.gz YRZAGCGMCNFDBD-AWEZNQCLSA-N 1 0 299.418 3.618 20 10 CHCDRO Oc1c(C[NH2+]C[C@@H]2C[C@H]3CCC[C@H]3O2)ccc2ccccc21 ZINC000877806533 1125083489 /nfs/dbraw/zinc/08/34/89/1125083489.db2.gz PDKHIBIFTDXDPF-UWWQBHOKSA-N 1 0 297.398 3.593 20 10 CHCDRO C[N@H+](Cc1cc(C(F)(F)F)co1)Cc1ccccc1O ZINC000878241898 1125134602 /nfs/dbraw/zinc/13/46/02/1125134602.db2.gz JPZRJNPLQJVGTN-UHFFFAOYSA-N 1 0 285.265 3.636 20 10 CHCDRO CC(=O)C[N@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000878325831 1125142225 /nfs/dbraw/zinc/14/22/25/1125142225.db2.gz MHFDOGSVRDREFA-HNNXBMFYSA-N 1 0 283.371 3.544 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cccc(C)n1)c1ccc(N(C)C)cc1 ZINC000127264441 1125170264 /nfs/dbraw/zinc/17/02/64/1125170264.db2.gz DQPIVKLXAVVCJV-GOSISDBHSA-N 1 0 283.419 3.697 20 10 CHCDRO COCC[C@@H]([NH2+][C@@H](C)c1ccccc1O)c1ccccc1 ZINC000879650550 1125224394 /nfs/dbraw/zinc/22/43/94/1125224394.db2.gz GYXBGOUWGRBJGA-WMLDXEAASA-N 1 0 285.387 3.821 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CCC[C@H](C)[C@@H]2C)cc1C ZINC000035052349 1125234182 /nfs/dbraw/zinc/23/41/82/1125234182.db2.gz VBMMRQLUASPYOH-DUVNUKRYSA-N 1 0 261.409 3.918 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+][C@H]2CCC[C@@H](C)C2)c1O ZINC000228670568 1125250945 /nfs/dbraw/zinc/25/09/45/1125250945.db2.gz LOAQSJXTHRIJCL-MFKMUULPSA-N 1 0 283.799 3.723 20 10 CHCDRO Cn1cccc1C[N@H+](C)Cc1c(O)ccc2ccccc21 ZINC000128371517 1125268523 /nfs/dbraw/zinc/26/85/23/1125268523.db2.gz VZLOJCSZAHXNOL-UHFFFAOYSA-N 1 0 280.371 3.516 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C2(C3CC3)CC2)cc1 ZINC000697341757 1125300372 /nfs/dbraw/zinc/30/03/72/1125300372.db2.gz FARDSNNNEXFELU-UHFFFAOYSA-N 1 0 258.409 3.565 20 10 CHCDRO CCC(CC)C[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC000129618631 1125344169 /nfs/dbraw/zinc/34/41/69/1125344169.db2.gz OVHBROMJRHJAOA-UHFFFAOYSA-N 1 0 290.451 3.690 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]CCCCC(F)(F)F)c1 ZINC000130498666 1125362850 /nfs/dbraw/zinc/36/28/50/1125362850.db2.gz LPCPSJGWWGMASY-JTQLQIEISA-N 1 0 291.313 3.784 20 10 CHCDRO Oc1cc(Br)ccc1C[NH+]1CCCCCC1 ZINC000258200713 1125367595 /nfs/dbraw/zinc/36/75/95/1125367595.db2.gz VETZBEOTHKUJJM-UHFFFAOYSA-N 1 0 284.197 3.531 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]CCc2ccns2)c1O ZINC000883247717 1125384326 /nfs/dbraw/zinc/38/43/26/1125384326.db2.gz TWCRHGCGDWOESG-SNVBAGLBSA-N 1 0 296.823 3.704 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCCC[C@H]2CC)c1O ZINC000131545573 1125397763 /nfs/dbraw/zinc/39/77/63/1125397763.db2.gz YBBMYPOKXGZUGR-CQSZACIVSA-N 1 0 263.381 3.555 20 10 CHCDRO CCOCCC[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000131582684 1125398414 /nfs/dbraw/zinc/39/84/14/1125398414.db2.gz ZHKWCHKNVSKVQT-MRXNPFEDSA-N 1 0 290.451 3.754 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1ccc(C)c(C)c1O)[C@H]1CCCOC1 ZINC000883351892 1125399246 /nfs/dbraw/zinc/39/92/46/1125399246.db2.gz NYPAGTPCSQMZEL-VYDXJSESSA-N 1 0 291.435 3.865 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCC2(CCC2)O1)c1cc(Cl)ccc1O ZINC000883357958 1125401150 /nfs/dbraw/zinc/40/11/50/1125401150.db2.gz YKHJOTCSVMHVIV-AAEUAGOBSA-N 1 0 295.810 3.798 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@H]1c3ccccc3CC[C@H]1F)CC2 ZINC000883378017 1125404688 /nfs/dbraw/zinc/40/46/88/1125404688.db2.gz XVHFLYFTZQYFHA-MDZRGWNJSA-N 1 0 297.373 3.995 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C2CCC3(COC3)CC2)c(O)c1C ZINC000883381113 1125405912 /nfs/dbraw/zinc/40/59/12/1125405912.db2.gz GUWJECXUSARODM-CQSZACIVSA-N 1 0 289.419 3.619 20 10 CHCDRO Oc1ccccc1C[NH2+][C@@H]1c2ccccc2CC[C@@H]1F ZINC000883382433 1125407005 /nfs/dbraw/zinc/40/70/05/1125407005.db2.gz GXMQXJHCVYUVTP-DOTOQJQBSA-N 1 0 271.335 3.507 20 10 CHCDRO CCn1ccnc1C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000296662351 1129223763 /nfs/dbraw/zinc/22/37/63/1129223763.db2.gz ZYKIPLZVNIHUMJ-ZDUSSCGKSA-N 1 0 295.386 3.613 20 10 CHCDRO CC[C@H](O)C[N@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000245892653 1129232433 /nfs/dbraw/zinc/23/24/33/1129232433.db2.gz MJSQBUXBCPQAHC-QAPCUYQASA-N 1 0 299.414 3.726 20 10 CHCDRO C[C@@H](c1ccco1)N(C)Cc1c(O)cccc1Cl ZINC000131097214 1129244030 /nfs/dbraw/zinc/24/40/30/1129244030.db2.gz NWNVIGNSNYHPHZ-JTQLQIEISA-N 1 0 265.740 3.832 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]CCC2CCCC2)c1 ZINC000037739392 1129257474 /nfs/dbraw/zinc/25/74/74/1129257474.db2.gz BABSJPJUIFSCKK-LBPRGKRZSA-N 1 0 263.381 3.632 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCCC12CCOCC2)c1cc(F)ccc1O ZINC000282671434 1129278538 /nfs/dbraw/zinc/27/85/38/1129278538.db2.gz JESPQTRCTFVDNI-WBMJQRKESA-N 1 0 293.382 3.531 20 10 CHCDRO CCOc1cccc(C[NH2+]Cc2coc3ccccc23)c1O ZINC000734004011 1129291092 /nfs/dbraw/zinc/29/10/92/1129291092.db2.gz HDLYARZSOBBSRM-UHFFFAOYSA-N 1 0 297.354 3.827 20 10 CHCDRO C[C@H](C[NH2+]Cc1ccc(N(C)C)c(F)c1)C(C)(C)C ZINC000734509821 1129310208 /nfs/dbraw/zinc/31/02/08/1129310208.db2.gz MGHJDSQWWMUPQN-GFCCVEGCSA-N 1 0 266.404 3.664 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCOC1)c1ccc(N2CCCCCC2)cc1 ZINC000090774534 1129328824 /nfs/dbraw/zinc/32/88/24/1129328824.db2.gz MOSHDOYEOGRCDG-NVXWUHKLSA-N 1 0 288.435 3.507 20 10 CHCDRO CC[C@H](C)[C@H](C)[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1 ZINC000247242181 1129362269 /nfs/dbraw/zinc/36/22/69/1129362269.db2.gz YZYVBURMFKCHCN-HRCADAONSA-N 1 0 290.451 3.608 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2C[C@@H](c3ccccc3)O[C@@H](C)C2)c1 ZINC000092486523 1129395346 /nfs/dbraw/zinc/39/53/46/1129395346.db2.gz HVCFHJHLHWILHV-KXBFYZLASA-N 1 0 297.398 3.663 20 10 CHCDRO Cc1cccc(OCC[N@@H+](C)Cc2cc(C)c(C)cc2O)c1 ZINC000248004608 1129396418 /nfs/dbraw/zinc/39/64/18/1129396418.db2.gz ADUOSBLJXDLFHE-UHFFFAOYSA-N 1 0 299.414 3.828 20 10 CHCDRO C[C@H](c1cccc(O)c1)[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC000093315175 1129420899 /nfs/dbraw/zinc/42/08/99/1129420899.db2.gz UAPRILXXCJYTEN-CQSZACIVSA-N 1 0 284.403 3.651 20 10 CHCDRO COc1cccc(C[N@@H+]2CC[C@H](c3ccccc3)[C@@H]2C)c1O ZINC000093689640 1129427007 /nfs/dbraw/zinc/42/70/07/1129427007.db2.gz SEURTYUTNDHCMB-YOEHRIQHSA-N 1 0 297.398 3.779 20 10 CHCDRO Cc1ccc(O)c(C[N@H+]2C[C@@H](C)OC[C@@H]2c2ccccc2)c1 ZINC000093660757 1129427044 /nfs/dbraw/zinc/42/70/44/1129427044.db2.gz SFCNRSSYPWFHJT-CRAIPNDOSA-N 1 0 297.398 3.663 20 10 CHCDRO Cc1csc([C@@H](C)[NH2+][C@H](C)c2cc(F)ccc2O)n1 ZINC000094618315 1129448400 /nfs/dbraw/zinc/44/84/00/1129448400.db2.gz DIBZUVJEYXYVOX-NXEZZACHSA-N 1 0 280.368 3.708 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCc2ccccc21)c1cc(F)ccc1O ZINC000094616883 1129448503 /nfs/dbraw/zinc/44/85/03/1129448503.db2.gz UPTQAGQNQKBYRI-MEDUHNTESA-N 1 0 271.335 3.869 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)CCCCF)cc1 ZINC000795853296 1129452561 /nfs/dbraw/zinc/45/25/61/1129452561.db2.gz PKKNBTHKRWEPJM-UHFFFAOYSA-N 1 0 266.404 3.714 20 10 CHCDRO C[C@H]([NH2+]C[C@]1(C)CCCO1)c1ccc2ccccc2c1O ZINC000094797009 1129452572 /nfs/dbraw/zinc/45/25/72/1129452572.db2.gz VAYKFYBWPBQYJI-UGSOOPFHSA-N 1 0 285.387 3.765 20 10 CHCDRO Cc1cscc1C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000094876951 1129455125 /nfs/dbraw/zinc/45/51/25/1129455125.db2.gz QOJBPBNIYLHPEN-ZDUSSCGKSA-N 1 0 274.433 3.973 20 10 CHCDRO COc1cccc(C[NH2+][C@H](C)c2ccc(C)c(F)c2)c1O ZINC000094952771 1129456334 /nfs/dbraw/zinc/45/63/34/1129456334.db2.gz KLUVLYJPVBXCQC-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO Cc1cc(F)ccc1CC[NH2+][C@@H](C)c1ccccc1O ZINC000094949938 1129456650 /nfs/dbraw/zinc/45/66/50/1129456650.db2.gz JOPLCTUFYJASCU-ZDUSSCGKSA-N 1 0 273.351 3.733 20 10 CHCDRO CCCN(CCC)c1ccc(C[NH2+]C(C)(C)CCO)cc1 ZINC000742379800 1129476057 /nfs/dbraw/zinc/47/60/57/1129476057.db2.gz AHINLMVTTOJAGD-UHFFFAOYSA-N 1 0 292.467 3.564 20 10 CHCDRO c1cc(C[NH2+][C@@H]2CC[C@@H]3CCC[C@H]3C2)cc2c1OCC2 ZINC000742379336 1129476213 /nfs/dbraw/zinc/47/62/13/1129476213.db2.gz VNAOUZLLABGIDP-YQQAZPJKSA-N 1 0 271.404 3.680 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2CC[C@H]3CCC[C@@H]3C2)cc1F ZINC000742378735 1129476311 /nfs/dbraw/zinc/47/63/11/1129476311.db2.gz LNZLVEWAPZEFNL-BZUAXINKSA-N 1 0 290.426 3.950 20 10 CHCDRO CC[N@H+](Cc1cc2c(cc1O)CCC2)[C@H](C)C(C)C ZINC000742557293 1129487283 /nfs/dbraw/zinc/48/72/83/1129487283.db2.gz UPCQQBLSKSRVCK-CYBMUJFWSA-N 1 0 261.409 3.747 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2C[C@H](C)C[C@H](C)C2)c1 ZINC000251776032 1129542196 /nfs/dbraw/zinc/54/21/96/1129542196.db2.gz FHQXVHWXLGQFDE-RFQIPJPRSA-N 1 0 277.408 3.876 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]CC2=CCCCC2)c1O ZINC000379579482 1129555525 /nfs/dbraw/zinc/55/55/25/1129555525.db2.gz HTZJQVIGJJGGHE-UHFFFAOYSA-N 1 0 281.783 3.644 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2C[C@H](OC(C)C)C2(C)C)c(O)c1 ZINC000766330129 1129603329 /nfs/dbraw/zinc/60/33/29/1129603329.db2.gz GXLLEPALNBYOGR-JQFCIGGWSA-N 1 0 291.435 3.943 20 10 CHCDRO CCC[N@@H+](Cc1ccc(N(C)C)cc1)C[C@H]1CCCCO1 ZINC000746136681 1129626935 /nfs/dbraw/zinc/62/69/35/1129626935.db2.gz DZCSUBZICAPEFE-GOSISDBHSA-N 1 0 290.451 3.534 20 10 CHCDRO Cc1nccn1Cc1ccc(N2CCCCC2)c(C)c1 ZINC000828491828 1131388704 /nfs/dbraw/zinc/38/87/04/1131388704.db2.gz BNOBCOTVYRXLHP-UHFFFAOYSA-N 1 0 269.392 3.539 20 10 CHCDRO CSC1CCC(C[NH2+][C@@H](C)c2ccccc2O)CC1 ZINC000720605405 1129670559 /nfs/dbraw/zinc/67/05/59/1129670559.db2.gz CEDQVNAHSKCVBI-HSBZDZAISA-N 1 0 279.449 3.965 20 10 CHCDRO CC[C@H]([NH2+][C@H]1C[C@H](OC)C1(C)C)c1ccc(N(C)C)cc1 ZINC000766529445 1129684223 /nfs/dbraw/zinc/68/42/23/1129684223.db2.gz PVWVQYDPWGEOKR-ULQDDVLXSA-N 1 0 290.451 3.607 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1c(C)noc1C ZINC000121337470 1129714486 /nfs/dbraw/zinc/71/44/86/1129714486.db2.gz MXOYYTVCZKHKTH-MRXNPFEDSA-N 1 0 287.407 3.598 20 10 CHCDRO C[C@H]([NH2+]CC1(C)CC(F)(F)C1)c1ccc(N(C)C)cc1 ZINC000720898512 1129718200 /nfs/dbraw/zinc/71/82/00/1129718200.db2.gz AFZBEWXQVSWLMB-LBPRGKRZSA-N 1 0 282.378 3.839 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC2(C)CC(F)(F)C2)c(O)c1 ZINC000720901835 1129718851 /nfs/dbraw/zinc/71/88/51/1129718851.db2.gz USUYKYFSFCEELI-NSHDSACASA-N 1 0 269.335 3.787 20 10 CHCDRO CCCC[N@@H+](Cc1ccccc1O)C[C@@H](OCC)C1CC1 ZINC001169754848 1129754098 /nfs/dbraw/zinc/75/40/98/1129754098.db2.gz QFFZOVFYBNKIQD-GOSISDBHSA-N 1 0 291.435 3.809 20 10 CHCDRO CN(C)c1ccc(C[NH+]2CCC3(CCC3)CC2)cc1 ZINC000796515384 1129767148 /nfs/dbraw/zinc/76/71/48/1129767148.db2.gz SPRKBTSQEBJXOO-UHFFFAOYSA-N 1 0 258.409 3.519 20 10 CHCDRO Cc1cccc(C[N@@H+](C)Cc2ccc(N(C)C)cc2)c1F ZINC001137678507 1131398149 /nfs/dbraw/zinc/39/81/49/1131398149.db2.gz MEXFZSBPRHIZRE-UHFFFAOYSA-N 1 0 286.394 3.832 20 10 CHCDRO CC(C)SCC[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000380630990 1129832730 /nfs/dbraw/zinc/83/27/30/1129832730.db2.gz UGLFOLLYNADXFP-UHFFFAOYSA-N 1 0 292.492 3.908 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CC[C@H]1C)c1ccc(Br)cc1O ZINC000381327071 1129837274 /nfs/dbraw/zinc/83/72/74/1129837274.db2.gz RLBYDOWJDMBQOD-VDDIYKPWSA-N 1 0 284.197 3.604 20 10 CHCDRO C[N@H+](Cc1cccc(F)c1)Cc1c(O)cccc1Cl ZINC000768160041 1129837727 /nfs/dbraw/zinc/83/77/27/1129837727.db2.gz LQBSXQIOOOFKCH-UHFFFAOYSA-N 1 0 279.742 3.817 20 10 CHCDRO CCC(CC)C[N@@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000768160858 1129837843 /nfs/dbraw/zinc/83/78/43/1129837843.db2.gz AYPNQUSSXBHFLQ-QGZVFWFLSA-N 1 0 291.435 3.809 20 10 CHCDRO CCOc1ccc(C[N@H+](C)Cc2cccc(F)c2)c(O)c1 ZINC000768161285 1129838140 /nfs/dbraw/zinc/83/81/40/1129838140.db2.gz UZXQCOOEMYFGMX-UHFFFAOYSA-N 1 0 289.350 3.562 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)Cc2ccc(F)cc2)cc1F ZINC000768175432 1129838599 /nfs/dbraw/zinc/83/85/99/1129838599.db2.gz OZWSZELRLIKLDE-UHFFFAOYSA-N 1 0 290.357 3.663 20 10 CHCDRO CCOc1ccc(C[N@H+](C)[C@H]2CCc3ccccc32)c(O)c1 ZINC000768232425 1129844970 /nfs/dbraw/zinc/84/49/70/1129844970.db2.gz AAKXEJMSIPHQHM-SFHVURJKSA-N 1 0 297.398 3.910 20 10 CHCDRO COc1cccc(O)c1C[N@H+](C)[C@@H]1CCc2ccccc21 ZINC000768233699 1129845740 /nfs/dbraw/zinc/84/57/40/1129845740.db2.gz PJUCLLHWZBIIKE-MRXNPFEDSA-N 1 0 283.371 3.520 20 10 CHCDRO CCN(CC)c1ccc(C[NH+]2C3CCC2CC3)cc1F ZINC000768227802 1129845950 /nfs/dbraw/zinc/84/59/50/1129845950.db2.gz JWDHDJLXPRDJSA-UHFFFAOYSA-N 1 0 276.399 3.799 20 10 CHCDRO CC[C@H]1C[N@H+](Cc2cc(-c3ccccc3)ccc2O)CCO1 ZINC000768237974 1129847470 /nfs/dbraw/zinc/84/74/70/1129847470.db2.gz OISLHZZYVJQGPL-SFHVURJKSA-N 1 0 297.398 3.670 20 10 CHCDRO COc1cc(C)cc(C[N@H+](C)Cc2ccccc2C)c1O ZINC000119498617 1129847967 /nfs/dbraw/zinc/84/79/67/1129847967.db2.gz OLLPDIDZJCTFTQ-UHFFFAOYSA-N 1 0 285.387 3.650 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1cc(C)ccc1O)[C@@H]1CCCOC1 ZINC000723991083 1129851489 /nfs/dbraw/zinc/85/14/89/1129851489.db2.gz ZANHWFQCEXIXJZ-FMKPAKJESA-N 1 0 277.408 3.556 20 10 CHCDRO CCC[C@H](C)[N@H+](C)Cc1ccc(N(C)C)c(F)c1 ZINC000768338703 1129852111 /nfs/dbraw/zinc/85/21/11/1129852111.db2.gz OROXAWDMACBKBT-LBPRGKRZSA-N 1 0 252.377 3.512 20 10 CHCDRO COc1cccc(C[N@H+](C2CC2)C2CCCCC2)c1O ZINC000768336915 1129852337 /nfs/dbraw/zinc/85/23/37/1129852337.db2.gz ADHFHWIQFZBEFC-UHFFFAOYSA-N 1 0 275.392 3.698 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCC(F)(F)C1)c1ccc(N(C)C)cc1 ZINC000381949988 1129853548 /nfs/dbraw/zinc/85/35/48/1129853548.db2.gz AWFFXFHDFFCUFC-WCQYABFASA-N 1 0 268.351 3.591 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H]2c2ccccn2)cc1F ZINC000768354953 1129853771 /nfs/dbraw/zinc/85/37/71/1129853771.db2.gz LCPDNNNVFYKJCJ-GOSISDBHSA-N 1 0 299.393 3.624 20 10 CHCDRO CCc1cccc(C[NH2+][C@@H]2CCC[C@@H](SC)C2)c1O ZINC000691449748 1129854562 /nfs/dbraw/zinc/85/45/62/1129854562.db2.gz FLPNJZOBNASXFB-HUUCEWRRSA-N 1 0 279.449 3.718 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)[C@@H]2CC3CCC2CC3)c(O)c1 ZINC000382067735 1129855052 /nfs/dbraw/zinc/85/50/52/1129855052.db2.gz GVUSFELGDQJPSM-VWLISTAJSA-N 1 0 289.419 3.705 20 10 CHCDRO Oc1ccccc1C[NH2+][C@H]1CCC[C@@H](c2cccnc2)C1 ZINC000800231358 1129857001 /nfs/dbraw/zinc/85/70/01/1129857001.db2.gz DFXPCRHYBXITCK-PBHICJAKSA-N 1 0 282.387 3.603 20 10 CHCDRO COc1cc(C[N@H+](C)[C@@H]2CCc3ccccc32)c(O)cc1C ZINC000768442699 1129857792 /nfs/dbraw/zinc/85/77/92/1129857792.db2.gz ZCQUJKSHGZXAMN-QGZVFWFLSA-N 1 0 297.398 3.829 20 10 CHCDRO CCOc1ccc(C[NH2+]C[C@H]2CCCC(F)(F)C2)c(O)c1 ZINC000800276008 1129862291 /nfs/dbraw/zinc/86/22/91/1129862291.db2.gz HBFXVSYDNBCCRV-LBPRGKRZSA-N 1 0 299.361 3.706 20 10 CHCDRO Cc1cc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCO3)oc1C ZINC000800476952 1129876497 /nfs/dbraw/zinc/87/64/97/1129876497.db2.gz SAKAUAYRZVKIHE-GFCCVEGCSA-N 1 0 271.360 3.682 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCC[C@@H]2C[C@@]21C ZINC000800478211 1129876568 /nfs/dbraw/zinc/87/65/68/1129876568.db2.gz ADPNITVUIPIHFO-NXHRZFHOSA-N 1 0 272.436 3.729 20 10 CHCDRO Cc1cc([C@H](C)[NH2+]Cc2ccc3c(c2)CCO3)oc1C ZINC000800476953 1129876755 /nfs/dbraw/zinc/87/67/55/1129876755.db2.gz SAKAUAYRZVKIHE-LBPRGKRZSA-N 1 0 271.360 3.682 20 10 CHCDRO C[N@H+](Cc1cnc2ccccc2c1)Cc1ccccc1O ZINC000768872343 1129877760 /nfs/dbraw/zinc/87/77/60/1129877760.db2.gz HIIKYUMYEFGAQT-UHFFFAOYSA-N 1 0 278.355 3.572 20 10 CHCDRO C[N@@H+](Cc1cc(-c2ccccc2)ccc1O)CC1CC1 ZINC000768917108 1129881463 /nfs/dbraw/zinc/88/14/63/1129881463.db2.gz YWTCQDPZECWJER-UHFFFAOYSA-N 1 0 267.372 3.901 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCOc3ccccc3[C@H]2C)cc1C ZINC000768931935 1129882015 /nfs/dbraw/zinc/88/20/15/1129882015.db2.gz WRJIQKGHFSQCIY-OAHLLOKOSA-N 1 0 297.398 3.965 20 10 CHCDRO C[C@H]1c2ccccc2OCC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000768930781 1129882662 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ZINC000769246328 1129898558 /nfs/dbraw/zinc/89/85/58/1129898558.db2.gz ZOYFRHGEQVWYSS-MRXNPFEDSA-N 1 0 275.392 3.555 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2CC[C@@H]2C2CCC2)cc1F ZINC000800969643 1129900773 /nfs/dbraw/zinc/90/07/73/1129900773.db2.gz SSBIJHMTWIKVPA-GDBMZVCRSA-N 1 0 276.399 3.560 20 10 CHCDRO c1csc(SCCC[NH2+][C@H]2CC[C@@H]2C2CCC2)n1 ZINC000800971998 1129900876 /nfs/dbraw/zinc/90/08/76/1129900876.db2.gz ZRNWYBRKRNZQIA-OLZOCXBDSA-N 1 0 282.478 3.794 20 10 CHCDRO CC[C@H](C)[C@H](C)[N@H+](Cc1cc2c(cc1O)OCO2)C1CC1 ZINC000769339605 1129903492 /nfs/dbraw/zinc/90/34/92/1129903492.db2.gz TVOCMBYRTWNOOB-RYUDHWBXSA-N 1 0 291.391 3.520 20 10 CHCDRO CC[C@@H](C)[C@H](C)[N@H+](Cc1cc2c(cc1O)OCO2)C1CC1 ZINC000769339603 1129903728 /nfs/dbraw/zinc/90/37/28/1129903728.db2.gz TVOCMBYRTWNOOB-NEPJUHHUSA-N 1 0 291.391 3.520 20 10 CHCDRO CC[C@@H]1[C@H](C)CC[N@@H+]1Cc1cc(Cl)cc(OC)c1O ZINC000384283165 1129905359 /nfs/dbraw/zinc/90/53/59/1129905359.db2.gz OTRASADWMMJYME-ZWNOBZJWSA-N 1 0 283.799 3.675 20 10 CHCDRO CCS[C@H]1CCCC[N@H+](Cc2c(O)cccc2OC)C1 ZINC000769403205 1129906252 /nfs/dbraw/zinc/90/62/52/1129906252.db2.gz GLVDMUUSJUVJIJ-ZDUSSCGKSA-N 1 0 295.448 3.508 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2[C@H](C)C[C@H]3CCCC[C@H]32)c1 ZINC000769404164 1129906698 /nfs/dbraw/zinc/90/66/98/1129906698.db2.gz KCPOFQSWTJOMMY-CKEIUWERSA-N 1 0 289.419 3.944 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCC[C@@](C)(CC)C2)c1O ZINC000769445633 1129910104 /nfs/dbraw/zinc/91/01/04/1129910104.db2.gz GXRRZRHBRDQOSV-QGZVFWFLSA-N 1 0 277.408 3.803 20 10 CHCDRO CCOc1cccc(C[N@@H+]2C[C@@H](C)CCC[C@H]2C)c1O ZINC000769452317 1129911075 /nfs/dbraw/zinc/91/10/75/1129911075.db2.gz WFTWRKAGZIDEEO-UONOGXRCSA-N 1 0 277.408 3.801 20 10 CHCDRO CCC[C@@]1(C)CCC[N@H+](Cc2cccc(OC)c2O)C1 ZINC000769452570 1129911285 /nfs/dbraw/zinc/91/12/85/1129911285.db2.gz YAZWPVUSZPWBQE-KRWDZBQOSA-N 1 0 277.408 3.803 20 10 CHCDRO CC[C@@H](C)[C@H]1CCCC[N@@H+]1Cc1cccc(OC)c1O ZINC000769466981 1129911903 /nfs/dbraw/zinc/91/19/03/1129911903.db2.gz RRQWXLZEPHOYEJ-UKRRQHHQSA-N 1 0 277.408 3.801 20 10 CHCDRO COc1cccc(O)c1C[N@@H+]1C[C@H](C)[C@H]1c1ccccc1 ZINC000769542068 1129916169 /nfs/dbraw/zinc/91/61/69/1129916169.db2.gz ZBHKIUAKEUHDQL-UGSOOPFHSA-N 1 0 283.371 3.594 20 10 CHCDRO C[C@H]1C[N@H+](Cc2ccc(N(C)C)cc2)[C@H]1c1ccccc1 ZINC000769538895 1129916551 /nfs/dbraw/zinc/91/65/51/1129916551.db2.gz GCPRIDMFJDAVNK-HNAYVOBHSA-N 1 0 280.415 3.946 20 10 CHCDRO CCCC[N@H+](CCOC(C)(C)C)Cc1ccccc1O ZINC000801595692 1129931258 /nfs/dbraw/zinc/93/12/58/1129931258.db2.gz IIFKZJMKZMVPAA-UHFFFAOYSA-N 1 0 279.424 3.809 20 10 CHCDRO CCCC[N@H+](CCC(C)(C)OC)Cc1ccccc1O ZINC000801599390 1129932019 /nfs/dbraw/zinc/93/20/19/1129932019.db2.gz MJYQKPUJXPDYFG-UHFFFAOYSA-N 1 0 279.424 3.809 20 10 CHCDRO CCCC[N@H+](C/C=C/Cl)Cc1ccccc1O ZINC000801597718 1129932045 /nfs/dbraw/zinc/93/20/45/1129932045.db2.gz NGFJTTVEMQAFTA-RMKNXTFCSA-N 1 0 253.773 3.747 20 10 CHCDRO CC[C@@H]1CCC[C@@H]1C[NH2+]Cc1ccc(OC)c(C)c1 ZINC001461514432 1129934827 /nfs/dbraw/zinc/93/48/27/1129934827.db2.gz JQWSWDVWWBKLSJ-HZPDHXFCSA-N 1 0 261.409 3.920 20 10 CHCDRO C[C@H]([N@H+](C)Cc1c(O)cccc1Cl)C1(C)CC1 ZINC000770288332 1129943489 /nfs/dbraw/zinc/94/34/89/1129943489.db2.gz IHMSFNQCBHQKBS-JTQLQIEISA-N 1 0 253.773 3.666 20 10 CHCDRO CC[C@@H]1CC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000770303446 1129944209 /nfs/dbraw/zinc/94/42/09/1129944209.db2.gz HBMDPVZPQXUKNV-MRXNPFEDSA-N 1 0 272.436 3.909 20 10 CHCDRO CS[C@H]1CCCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC000770345996 1129944882 /nfs/dbraw/zinc/94/48/82/1129944882.db2.gz BMUASZCNEOKRMJ-ZDUSSCGKSA-N 1 0 285.840 3.763 20 10 CHCDRO CS[C@@H]1CCCC[N@H+](Cc2c(O)cccc2Cl)C1 ZINC000770352666 1129945708 /nfs/dbraw/zinc/94/57/08/1129945708.db2.gz YHVQFGSBHWVAIP-LLVKDONJSA-N 1 0 285.840 3.763 20 10 CHCDRO C[N@@H+](Cc1cc2c(cc1O)CCC2)CC1CCCC1 ZINC000746504679 1129946317 /nfs/dbraw/zinc/94/63/17/1129946317.db2.gz NFOBERJUZHQDIM-UHFFFAOYSA-N 1 0 259.393 3.503 20 10 CHCDRO CC[C@H]1c2ccccc2CC[N@H+]1Cc1ccccc1O ZINC000770509492 1129948836 /nfs/dbraw/zinc/94/88/36/1129948836.db2.gz BATFDNHAFSBPNU-KRWDZBQOSA-N 1 0 267.372 3.902 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CC[C@@H](c2cccc(F)c2)C1 ZINC000770511017 1129948924 /nfs/dbraw/zinc/94/89/24/1129948924.db2.gz VMEKAZCYLOAJGU-CQSZACIVSA-N 1 0 271.335 3.521 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)[C@H](C)Cc1ccc(OC)cc1 ZINC000770509455 1129949083 /nfs/dbraw/zinc/94/90/83/1129949083.db2.gz MWBMVBSKXXMDMP-OAHLLOKOSA-N 1 0 299.414 3.854 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)[C@@H](C)Cc1ccc(OC)cc1 ZINC000770509454 1129949193 /nfs/dbraw/zinc/94/91/93/1129949193.db2.gz MWBMVBSKXXMDMP-HNNXBMFYSA-N 1 0 299.414 3.854 20 10 CHCDRO COc1ccc(C[NH2+][C@H]2CC[C@@H](c3ccccc3)C2)c(O)c1 ZINC000770739393 1129957596 /nfs/dbraw/zinc/95/75/96/1129957596.db2.gz AHKFFORCXGPSFT-WBVHZDCISA-N 1 0 297.398 3.827 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCO[C@@H](C)C1)c1ccc(N(C)C)cc1 ZINC000771388837 1129979314 /nfs/dbraw/zinc/97/93/14/1129979314.db2.gz PPNQZJDQLHAEAK-MPGHIAIKSA-N 1 0 290.451 3.608 20 10 CHCDRO CNc1ccccc1C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000902487808 1130016275 /nfs/dbraw/zinc/01/62/75/1130016275.db2.gz FAILJMIONDEWLB-CQSZACIVSA-N 1 0 283.419 3.645 20 10 CHCDRO CCCC[N@H+](Cc1c(C)n[nH]c1C)Cc1ccccc1O ZINC000802657439 1130027777 /nfs/dbraw/zinc/02/77/77/1130027777.db2.gz DODSZSWDWZCONR-UHFFFAOYSA-N 1 0 287.407 3.534 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]CCc1ccc(F)c(F)c1 ZINC000786819284 1130119213 /nfs/dbraw/zinc/11/92/13/1130119213.db2.gz QBRGMDTZFRBXPK-UHFFFAOYSA-N 1 0 297.732 3.656 20 10 CHCDRO Cc1c([C@H](C)[NH2+]Cc2ccc3c(c2)CCO3)cnn1C(C)C ZINC000786903338 1130119887 /nfs/dbraw/zinc/11/98/87/1130119887.db2.gz KOGQCHSLXOBNIY-ZDUSSCGKSA-N 1 0 299.418 3.558 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CC(C)(C)C2CCOCC2)c1 ZINC000903244338 1130135100 /nfs/dbraw/zinc/13/51/00/1130135100.db2.gz RMBQSSJHWMUBLM-AWEZNQCLSA-N 1 0 291.435 3.804 20 10 CHCDRO CC[C@@H]([NH2+]C1CC2(C1)CO[C@@H](C)C2)c1ccc(C)cc1O ZINC000903281486 1130145314 /nfs/dbraw/zinc/14/53/14/1130145314.db2.gz HDUOXBVIZDKHGH-DFFOAJLQSA-N 1 0 289.419 3.699 20 10 CHCDRO COC(C)(C)[C@@H](C)[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000903329670 1130157271 /nfs/dbraw/zinc/15/72/71/1130157271.db2.gz CPTUIMZLLHAOGY-NXEZZACHSA-N 1 0 271.788 3.510 20 10 CHCDRO CC[C@@H]([NH2+][C@H](c1ccccn1)C1CC1)c1ccccc1O ZINC000903335473 1130160484 /nfs/dbraw/zinc/16/04/84/1130160484.db2.gz QEPGTBCKIVXGFG-QAPCUYQASA-N 1 0 282.387 3.979 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](c2ccccn2)C2CC2)c1 ZINC000903334767 1130160648 /nfs/dbraw/zinc/16/06/48/1130160648.db2.gz FZZYHFHVSCBEIK-UGSOOPFHSA-N 1 0 282.387 3.898 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CC[C@H]2CCC(F)(F)C2)c1O ZINC000903340772 1130162344 /nfs/dbraw/zinc/16/23/44/1130162344.db2.gz JLAWSNONNMUOAK-VXGBXAGGSA-N 1 0 299.361 3.877 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCOC12CCCC2)c1ccc(N(C)C)cc1 ZINC000903382431 1130169017 /nfs/dbraw/zinc/16/90/17/1130169017.db2.gz GYIFUYFQKWKVBJ-PBHICJAKSA-N 1 0 288.435 3.505 20 10 CHCDRO Cc1nc2ccccn2c1C[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000903421324 1130174026 /nfs/dbraw/zinc/17/40/26/1130174026.db2.gz GYDUSHWVVXLXEL-ZDUSSCGKSA-N 1 0 295.386 3.508 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@@H](c2ccncc2)C2CC2)c1O ZINC000903428860 1130175423 /nfs/dbraw/zinc/17/54/23/1130175423.db2.gz LVIJKPCKWCOLNY-SJKOYZFVSA-N 1 0 298.386 3.598 20 10 CHCDRO Cc1ccc([C@H](O)C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)cc1 ZINC000788562948 1130194964 /nfs/dbraw/zinc/19/49/64/1130194964.db2.gz MJPILEKUWZENAW-MAUKXSAKSA-N 1 0 299.414 3.702 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CCCNc2ccccn2)c(O)c1 ZINC000788623392 1130198253 /nfs/dbraw/zinc/19/82/53/1130198253.db2.gz FGJZPZLDIGGDBL-HNNXBMFYSA-N 1 0 299.418 3.557 20 10 CHCDRO CC(C)C[C@H]1CCC[N@@H+]1Cc1c(O)ccc2ccncc21 ZINC000748791992 1130246453 /nfs/dbraw/zinc/24/64/53/1130246453.db2.gz KHSYCYSRCNKUTG-OAHLLOKOSA-N 1 0 284.403 3.951 20 10 CHCDRO CSCC1(CC[NH2+]Cc2cc(Cl)c(C)cc2O)CC1 ZINC000826936734 1130315136 /nfs/dbraw/zinc/31/51/36/1130315136.db2.gz DMEWBGWTISLQKR-UHFFFAOYSA-N 1 0 299.867 3.977 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1N(C)CCCC1(C)C)c1ccccc1O ZINC000790499415 1130315426 /nfs/dbraw/zinc/31/54/26/1130315426.db2.gz WVOWPGKHRUNDJJ-NVXWUHKLSA-N 1 0 290.451 3.553 20 10 CHCDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]C[C@@H]1CCSC1 ZINC000790484560 1130315505 /nfs/dbraw/zinc/31/55/05/1130315505.db2.gz FONLXTUDXMOHPH-AWEZNQCLSA-N 1 0 299.439 3.902 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1N(C)CCCC1(C)C)c1ccccc1O ZINC000790499409 1130315628 /nfs/dbraw/zinc/31/56/28/1130315628.db2.gz WVOWPGKHRUNDJJ-DOTOQJQBSA-N 1 0 290.451 3.553 20 10 CHCDRO C[C@H]1c2ccccc2C[C@H]1[NH2+]Cc1cccc(Cl)c1[O-] ZINC000827030054 1130346404 /nfs/dbraw/zinc/34/64/04/1130346404.db2.gz INAIGGOJDXVAPB-MEDUHNTESA-N 1 0 287.790 3.864 20 10 CHCDRO C[C@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1ccc(N(C)C)cc1 ZINC000791580347 1130383554 /nfs/dbraw/zinc/38/35/54/1130383554.db2.gz ZZZDAFJNEJVSHX-SMDDNHRTSA-N 1 0 286.341 3.525 20 10 CHCDRO CC1(C)C[N@H+](Cc2c([O-])ccc(Cl)c2F)CCS1 ZINC000792166528 1130433703 /nfs/dbraw/zinc/43/37/03/1130433703.db2.gz SKUCFMCTFMILRS-UHFFFAOYSA-N 1 0 289.803 3.512 20 10 CHCDRO [O-]c1ccc(Cl)c(F)c1C[N@@H+]1CCC[C@H]1C1CC1 ZINC000792167732 1130434211 /nfs/dbraw/zinc/43/42/11/1130434211.db2.gz OREYXCFQZVZHCX-LBPRGKRZSA-N 1 0 269.747 3.559 20 10 CHCDRO CCc1cccc(F)c1C[NH2+]Cc1ccc(N(C)C)cc1 ZINC000792894392 1130503957 /nfs/dbraw/zinc/50/39/57/1130503957.db2.gz VKIWILCBHJZWPT-UHFFFAOYSA-N 1 0 286.394 3.744 20 10 CHCDRO CC[C@H](C)C[C@H](CC)[NH2+]Cc1ccc(OC)cc1O ZINC000793386276 1130552319 /nfs/dbraw/zinc/55/23/19/1130552319.db2.gz KESAAWDLAORWHN-JSGCOSHPSA-N 1 0 265.397 3.705 20 10 CHCDRO CC(C)OCC[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000757977044 1130590852 /nfs/dbraw/zinc/59/08/52/1130590852.db2.gz DYVUXYMOTVOERA-UHFFFAOYSA-N 1 0 285.387 3.574 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CC3(CCC3)[C@H]2C2CC2)cc1C ZINC000811513627 1130619588 /nfs/dbraw/zinc/61/95/88/1130619588.db2.gz LMDQJAASABFEAR-QGZVFWFLSA-N 1 0 271.404 3.774 20 10 CHCDRO C[C@H]1CC[N@H+](Cc2c(O)ccc3ccncc32)CC1(C)C ZINC000758998410 1130632899 /nfs/dbraw/zinc/63/28/99/1130632899.db2.gz CAGSGWQUJCEHJB-ZDUSSCGKSA-N 1 0 284.403 3.808 20 10 CHCDRO C[C@H]1C[N@H+](Cc2cc3c(cc2O)CCCC3)CCC1(F)F ZINC000811778429 1130643488 /nfs/dbraw/zinc/64/34/88/1130643488.db2.gz KFOGTLURXVVDDV-LBPRGKRZSA-N 1 0 295.373 3.748 20 10 CHCDRO COc1cc(C[NH+]2CCC(C)(C3CC3)CC2)c(O)cc1C ZINC000811785315 1130647317 /nfs/dbraw/zinc/64/73/17/1130647317.db2.gz ZQFLMXICCZBLST-UHFFFAOYSA-N 1 0 289.419 3.721 20 10 CHCDRO COc1ccc2ccc(O)c(C[NH+]3CCC4(CC4)CC3)c2c1 ZINC001234526828 1130653967 /nfs/dbraw/zinc/65/39/67/1130653967.db2.gz ZXDPIVDEHDNTLF-UHFFFAOYSA-N 1 0 297.398 3.930 20 10 CHCDRO CCOC(C)(C)C[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000780582683 1130685024 /nfs/dbraw/zinc/68/50/24/1130685024.db2.gz GBLQDTNREAJQCW-UHFFFAOYSA-N 1 0 299.414 3.964 20 10 CHCDRO Cc1ccc(O)c(CNc2cc3c(c[nH+]2)CCCC3)c1 ZINC000812345525 1130686429 /nfs/dbraw/zinc/68/64/29/1130686429.db2.gz CNEHZULWCNTCLI-UHFFFAOYSA-N 1 0 268.360 3.587 20 10 CHCDRO COC[C@@H]1CC[N@H+](Cc2cccc(-c3ccccc3)c2O)C1 ZINC001234999966 1130700407 /nfs/dbraw/zinc/70/04/07/1130700407.db2.gz GZFOBRRJUPYQDY-OAHLLOKOSA-N 1 0 297.398 3.528 20 10 CHCDRO C[C@@H]1C[N@@H+](Cc2cccc(-c3ccccc3)c2O)C[C@H](C)O1 ZINC001234992184 1130700665 /nfs/dbraw/zinc/70/06/65/1130700665.db2.gz NTXMNLPYFHIOHD-GASCZTMLSA-N 1 0 297.398 3.668 20 10 CHCDRO Oc1c(C[N@@H+]2C[C@@H]3C[C@@H]3[C@@H](F)C2)cccc1-c1ccccc1 ZINC001235001279 1130701205 /nfs/dbraw/zinc/70/12/05/1130701205.db2.gz LYUWKVSQRNZWFW-SZMVWBNQSA-N 1 0 297.373 3.849 20 10 CHCDRO CC(C)OC1C[NH+](Cc2cccc(-c3ccccc3)c2O)C1 ZINC001234996299 1130701684 /nfs/dbraw/zinc/70/16/84/1130701684.db2.gz AAXYUOWSGNJOPY-UHFFFAOYSA-N 1 0 297.398 3.668 20 10 CHCDRO CC[C@H]([NH2+]C[C@@](C)(OC)C1CC1)c1ccc(N(C)C)cc1 ZINC000812734869 1130710251 /nfs/dbraw/zinc/71/02/51/1130710251.db2.gz TZSVHUSARMTRTE-ZWKOTPCHSA-N 1 0 290.451 3.608 20 10 CHCDRO CO[C@@](C)(C[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O)C1CC1 ZINC000812734888 1130710689 /nfs/dbraw/zinc/71/06/89/1130710689.db2.gz UIXVXDAJTBWKFK-ZBEGNZNMSA-N 1 0 297.826 3.820 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C(C)C)[C@H]2CCOC2)cc1 ZINC000812775300 1130712779 /nfs/dbraw/zinc/71/27/79/1130712779.db2.gz BFZZKCPNODJOFI-SFHVURJKSA-N 1 0 290.451 3.532 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CC[C@]3(CC[C@@H](C)C3)C2)c(O)c1 ZINC000781926889 1130748623 /nfs/dbraw/zinc/74/86/23/1130748623.db2.gz BIURNNFQIMLGLL-KDOFPFPSSA-N 1 0 289.419 3.803 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CC[C@]3(CC[C@H](C)C3)C2)c1O ZINC000781929324 1130750133 /nfs/dbraw/zinc/75/01/33/1130750133.db2.gz PXLYQZLUYPCNCL-KSSFIOAISA-N 1 0 289.419 3.803 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]C[C@H](C)Cc2ccccc2)c1 ZINC000813330612 1130759824 /nfs/dbraw/zinc/75/98/24/1130759824.db2.gz BAXZZHBDXORZKR-CABCVRRESA-N 1 0 299.414 3.930 20 10 CHCDRO CC(C)[C@H]1COCC[N@@H+]1Cc1ccc(C(C)(C)C)cc1O ZINC001235679459 1130768395 /nfs/dbraw/zinc/76/83/95/1130768395.db2.gz OQWOPGMUTLMWRG-MRXNPFEDSA-N 1 0 291.435 3.547 20 10 CHCDRO CCOC1CC[NH+](Cc2ccc(C(C)(C)C)cc2O)CC1 ZINC001235685250 1130768615 /nfs/dbraw/zinc/76/86/15/1130768615.db2.gz NWJFKIURMYVMSE-UHFFFAOYSA-N 1 0 291.435 3.691 20 10 CHCDRO CO[C@@H]1CC[N@H+](Cc2ccc(C(C)(C)C)cc2O)[C@H](C)C1 ZINC001235682422 1130768768 /nfs/dbraw/zinc/76/87/68/1130768768.db2.gz WTYZOFLAIUAOEV-CZUORRHYSA-N 1 0 291.435 3.689 20 10 CHCDRO C[C@@H]1CC[C@@H]1[NH2+]Cc1ccc(N2CCC(C)CC2)cc1 ZINC000783241735 1130805130 /nfs/dbraw/zinc/80/51/30/1130805130.db2.gz XCCDPYNMPYXGRP-QAPCUYQASA-N 1 0 272.436 3.811 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CC[C@@H](C)C1)c1cc(Br)ccc1O ZINC000783311241 1130815506 /nfs/dbraw/zinc/81/55/06/1130815506.db2.gz UDPFBRNQHMNWRM-CKYFFXLPSA-N 1 0 298.224 3.994 20 10 CHCDRO CCN(CC[NH2+][C@H](C)c1ccccc1O)c1cccc(C)c1 ZINC000783491229 1130830005 /nfs/dbraw/zinc/83/00/05/1130830005.db2.gz RBZQNMBFJVLRGN-MRXNPFEDSA-N 1 0 298.430 3.878 20 10 CHCDRO C[C@H]([NH2+]CCc1c[nH]c2cc(F)ccc12)c1ccccc1O ZINC000783509942 1130832924 /nfs/dbraw/zinc/83/29/24/1130832924.db2.gz UZGGNPOIXVLFNX-LBPRGKRZSA-N 1 0 298.361 3.906 20 10 CHCDRO Cc1ccc(CC[C@@H](C)[NH2+][C@@H](C)c2ccccc2O)o1 ZINC000783516060 1130833327 /nfs/dbraw/zinc/83/33/27/1130833327.db2.gz DHMWUFMIEKZNIB-OCCSQVGLSA-N 1 0 273.376 3.966 20 10 CHCDRO COc1cccc(O)c1C[N@H+](C)Cc1cccc(C)c1C ZINC000814170076 1130837413 /nfs/dbraw/zinc/83/74/13/1130837413.db2.gz RIQWUPGBAPKYCW-UHFFFAOYSA-N 1 0 285.387 3.650 20 10 CHCDRO C[C@@H](C[NH2+]Cc1ccccc1O)c1cccc(Cl)c1 ZINC000783611076 1130842050 /nfs/dbraw/zinc/84/20/50/1130842050.db2.gz QIOUYHFROWBODD-LBPRGKRZSA-N 1 0 275.779 3.939 20 10 CHCDRO COc1cccc(O)c1C[NH2+]CC(C)(C)C(C)(C)C ZINC000814297019 1130856993 /nfs/dbraw/zinc/85/69/93/1130856993.db2.gz APXXQLHBKGWUFN-UHFFFAOYSA-N 1 0 265.397 3.563 20 10 CHCDRO COc1cccc(C[N@H+](C)Cc2ccc(N(C)C)c(C)c2)c1 ZINC000815012525 1130951363 /nfs/dbraw/zinc/95/13/63/1130951363.db2.gz LWDDYLGPCKNFSK-UHFFFAOYSA-N 1 0 298.430 3.702 20 10 CHCDRO Cc1cc(C[N@@H+]2CCC[C@H]2c2cccnc2)ccc1N(C)C ZINC000815076317 1130956413 /nfs/dbraw/zinc/95/64/13/1130956413.db2.gz BVDOHXBXEUJWNT-IBGZPJMESA-N 1 0 295.430 3.793 20 10 CHCDRO Cc1cc(C[N@@H+](C)[C@@H](C)c2cccc(O)c2)ccc1N(C)C ZINC000815069843 1130956419 /nfs/dbraw/zinc/95/64/19/1130956419.db2.gz HERVXQCEIUEDFZ-HNNXBMFYSA-N 1 0 298.430 3.960 20 10 CHCDRO Cc1cc(C[N@@H+]2CCCC[C@H]2c2cc[nH]n2)ccc1N(C)C ZINC000815116440 1130958295 /nfs/dbraw/zinc/95/82/95/1130958295.db2.gz NHZXZAJHOHMOQC-SFHVURJKSA-N 1 0 298.434 3.511 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCOC[C@H]1C)c1cc(Cl)ccc1O ZINC000797085289 1130960252 /nfs/dbraw/zinc/96/02/52/1130960252.db2.gz LNJXRIKFQAFPFF-JMSVASOKSA-N 1 0 297.826 3.759 20 10 CHCDRO Cc1cc(C[N@@H+]2CCSC(C)(C)CC2)ccc1N(C)C ZINC000815103406 1130961488 /nfs/dbraw/zinc/96/14/88/1130961488.db2.gz PTONBPXZEKGMHT-UHFFFAOYSA-N 1 0 292.492 3.779 20 10 CHCDRO Cc1sccc1C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000815136397 1130965472 /nfs/dbraw/zinc/96/54/72/1130965472.db2.gz ZCTIWMYHSYHXNL-GFCCVEGCSA-N 1 0 274.433 3.973 20 10 CHCDRO Cc1sccc1C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000815136398 1130966183 /nfs/dbraw/zinc/96/61/83/1130966183.db2.gz ZCTIWMYHSYHXNL-LBPRGKRZSA-N 1 0 274.433 3.973 20 10 CHCDRO C[C@@H](F)CC[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000815149722 1130967451 /nfs/dbraw/zinc/96/74/51/1130967451.db2.gz XKJAOLYPTRMONH-SNVBAGLBSA-N 1 0 292.320 3.609 20 10 CHCDRO CCCN(CC)C[C@@H](C)[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000810259669 1130996507 /nfs/dbraw/zinc/99/65/07/1130996507.db2.gz OOECLZUOODJUAG-OLZOCXBDSA-N 1 0 298.858 3.817 20 10 CHCDRO Oc1ccccc1[C@@H](CCc1ccccc1)[NH2+]C1CC1 ZINC000815553361 1130998692 /nfs/dbraw/zinc/99/86/92/1130998692.db2.gz YGMBRVBYIGKUOH-QGZVFWFLSA-N 1 0 267.372 3.818 20 10 CHCDRO CS[C@@H]1CC[C@H]([NH2+][C@@H](C)c2c(C)cc(C)cc2O)C1 ZINC000815583257 1131004045 /nfs/dbraw/zinc/00/40/45/1131004045.db2.gz AIXSBISQVGGDIP-MELADBBJSA-N 1 0 279.449 3.944 20 10 CHCDRO CCc1ccc(C[N@@H+]2CCC[C@H]2c2cccnc2)c(O)c1 ZINC001236784392 1131006204 /nfs/dbraw/zinc/00/62/04/1131006204.db2.gz WEESQGMKGIYJPP-KRWDZBQOSA-N 1 0 282.387 3.687 20 10 CHCDRO 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CN(C)c1ccc(C[NH2+]Cc2cccc3cc[nH]c32)cc1 ZINC000218078341 1131121962 /nfs/dbraw/zinc/12/19/62/1131121962.db2.gz RZGKDCCTYMDVTB-UHFFFAOYSA-N 1 0 279.387 3.524 20 10 CHCDRO CCOc1ccc(C[N@H+](C)Cc2ccccc2O)c(F)c1 ZINC001237633224 1131122112 /nfs/dbraw/zinc/12/21/12/1131122112.db2.gz RHQIDGNLVSEPLO-UHFFFAOYSA-N 1 0 289.350 3.562 20 10 CHCDRO C[C@H]1CC[N@@H+]1Cc1cc(-c2ccc(F)cc2)ccc1O ZINC001237641531 1131123883 /nfs/dbraw/zinc/12/38/83/1131123883.db2.gz SXSLBYITZNHRTB-LBPRGKRZSA-N 1 0 271.335 3.793 20 10 CHCDRO CCOCC1CC[NH+](Cc2cc(Cl)cc(C)c2O)CC1 ZINC001237684920 1131126582 /nfs/dbraw/zinc/12/65/82/1131126582.db2.gz CMZUOJOIQKFALC-UHFFFAOYSA-N 1 0 297.826 3.603 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)CCC2CC2)cc1Br ZINC001237681187 1131126988 /nfs/dbraw/zinc/12/69/88/1131126988.db2.gz IIRKBGXAALVNPJ-UHFFFAOYSA-N 1 0 298.224 3.695 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@H](CF)C2)c1O ZINC001237687529 1131128098 /nfs/dbraw/zinc/12/80/98/1131128098.db2.gz KUHQTJPIAZYQIB-NSHDSACASA-N 1 0 271.763 3.536 20 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CKRVDGMQMFCJJD-GOSISDBHSA-N 1 0 268.404 3.798 20 10 CHCDRO CCCOc1ccc([C@@H](C)[NH2+]CCc2ccc(N)cc2)cc1 ZINC000817955910 1131190495 /nfs/dbraw/zinc/19/04/95/1131190495.db2.gz KWIDXIGUVIVLDD-OAHLLOKOSA-N 1 0 298.430 3.951 20 10 CHCDRO CCC[C@@H]([NH2+]CCc1ccc(N)cc1)c1ccc(OC)cc1 ZINC000817955773 1131190499 /nfs/dbraw/zinc/19/04/99/1131190499.db2.gz HKWJFPIPSRVSDS-LJQANCHMSA-N 1 0 298.430 3.951 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccc(N)cc1)c1ccc(Cl)cc1 ZINC000817955899 1131190616 /nfs/dbraw/zinc/19/06/16/1131190616.db2.gz KMVKCZOFHAXHOU-GFCCVEGCSA-N 1 0 274.795 3.816 20 10 CHCDRO CCC[C@H]([NH2+]CCc1ccc(N)cc1)c1ccc(OC)cc1 ZINC000817955772 1131190636 /nfs/dbraw/zinc/19/06/36/1131190636.db2.gz HKWJFPIPSRVSDS-IBGZPJMESA-N 1 0 298.430 3.951 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccc(N)cc1)c1ccccc1Cl ZINC000817955974 1131190667 /nfs/dbraw/zinc/19/06/67/1131190667.db2.gz MRAJMFZKOMNOLE-GFCCVEGCSA-N 1 0 274.795 3.816 20 10 CHCDRO Cc1ccc2c(c1)[C@@H]([NH2+]CCc1ccc(N)cc1)CCC2 ZINC000817956326 1131191041 /nfs/dbraw/zinc/19/10/41/1131191041.db2.gz WMDUMLKUIFSMKT-IBGZPJMESA-N 1 0 280.415 3.787 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccc(N)cc1)C1CCC(F)(F)CC1 ZINC000817958415 1131191297 /nfs/dbraw/zinc/19/12/97/1131191297.db2.gz VNBQONAALVARON-GFCCVEGCSA-N 1 0 282.378 3.615 20 10 CHCDRO CC(C)C[C@@H](CN)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000817957540 1131191313 /nfs/dbraw/zinc/19/13/13/1131191313.db2.gz CRVAWRICIIVTHS-HIFRSBDPSA-N 1 0 286.419 3.569 20 10 CHCDRO CC(C)C[C@@H](CN)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000817957542 1131191453 /nfs/dbraw/zinc/19/14/53/1131191453.db2.gz CRVAWRICIIVTHS-ZFWWWQNUSA-N 1 0 286.419 3.569 20 10 CHCDRO COc1ccc([C@@H](C)[C@@H](C)[NH2+]CCc2ccc(N)cc2)cc1 ZINC000817956150 1131191640 /nfs/dbraw/zinc/19/16/40/1131191640.db2.gz RUZPQMHIJNZGMU-LSDHHAIUSA-N 1 0 298.430 3.602 20 10 CHCDRO CS[C@H]1CC[C@H]([N@H+](C)Cc2ccc(N(C)C)c(C)c2)C1 ZINC001117704615 1131192217 /nfs/dbraw/zinc/19/22/17/1131192217.db2.gz ICNAVIMRTDDWOK-HOTGVXAUSA-N 1 0 292.492 3.777 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)CCCC[NH3+])c1cccc(Cl)c1[O-] ZINC000817975785 1131193730 /nfs/dbraw/zinc/19/37/30/1131193730.db2.gz BNSRCXRDPLCGTO-BXUZGUMPSA-N 1 0 284.831 3.604 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]Cc1cccc3c1CCCN3)CC2 ZINC000817976057 1131194351 /nfs/dbraw/zinc/19/43/51/1131194351.db2.gz UOQIYTOCLSTAQB-QGZVFWFLSA-N 1 0 294.398 3.527 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc2c(c1)CCCN2)c1ccccc1O ZINC000817977403 1131195129 /nfs/dbraw/zinc/19/51/29/1131195129.db2.gz JOWCZXDLNXFJMW-KRWDZBQOSA-N 1 0 296.414 3.991 20 10 CHCDRO C[C@H]([NH2+][C@@H](CN)C1CCCC1)c1ccc2ccccc2c1O ZINC000817981191 1131195482 /nfs/dbraw/zinc/19/54/82/1131195482.db2.gz HAIMYTFRIHNNFY-UGSOOPFHSA-N 1 0 298.430 3.714 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ncc(C)cc1C ZINC001238434449 1131199923 /nfs/dbraw/zinc/19/99/23/1131199923.db2.gz DFGKJINQXMGXPO-UHFFFAOYSA-N 1 0 297.446 3.787 20 10 CHCDRO COc1ccc(N2CC[C@@H](C[NH2+][C@H](C)CC(C)C)C2)cc1 ZINC000818220084 1131205832 /nfs/dbraw/zinc/20/58/32/1131205832.db2.gz IXACIJBNHPOLSU-CVEARBPZSA-N 1 0 290.451 3.546 20 10 CHCDRO CC[C@H](C)[C@@H](C)[NH2+]C[C@@H]1CCN(c2ccc(OC)cc2)C1 ZINC000818344618 1131209798 /nfs/dbraw/zinc/20/97/98/1131209798.db2.gz OYNAXAZSLUXKRO-XHSDSOJGSA-N 1 0 290.451 3.546 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2C[C@H]3C[C@H]3C2)cc1 ZINC000818361347 1131211139 /nfs/dbraw/zinc/21/11/39/1131211139.db2.gz WVHKZTZRGKEHST-HNKHHVNMSA-N 1 0 258.409 3.592 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCC[C@H](F)C2)c1 ZINC001118176394 1131213775 /nfs/dbraw/zinc/21/37/75/1131213775.db2.gz AZFIZULQJBEJDF-AVGNSLFASA-N 1 0 251.345 3.632 20 10 CHCDRO CO[C@H]1CCC[N@H+](Cc2cc(C)n(-c3ccccc3)c2C)C1 ZINC001137854014 1131423880 /nfs/dbraw/zinc/42/38/80/1131423880.db2.gz DZHWAWLRBDAIAV-IBGZPJMESA-N 1 0 298.430 3.705 20 10 CHCDRO Cc1cc(C[NH+]2CC(C)C2)c(C)n1-c1ccccc1 ZINC001137854377 1131424384 /nfs/dbraw/zinc/42/43/84/1131424384.db2.gz UDNKHDWZUQBKKF-UHFFFAOYSA-N 1 0 254.377 3.546 20 10 CHCDRO Cc1cnccc1C[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000823404421 1131426161 /nfs/dbraw/zinc/42/61/61/1131426161.db2.gz PVQJOUVOYOQMGI-UHFFFAOYSA-N 1 0 297.446 3.867 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000823671983 1131436886 /nfs/dbraw/zinc/43/68/86/1131436886.db2.gz ZKZCMEIJCGVXTA-SCAQPMJSSA-N 1 0 290.451 3.578 20 10 CHCDRO Oc1ccccc1C[NH2+][C@@H]1CCCc2c(F)cccc21 ZINC000824468055 1131471407 /nfs/dbraw/zinc/47/14/07/1131471407.db2.gz BENPETWMHNXAGU-MRXNPFEDSA-N 1 0 271.335 3.699 20 10 CHCDRO Cc1c(C[N@@H+]2CC[C@@](C)(CF)C2)c2ccccc2n1C ZINC001138252463 1131482222 /nfs/dbraw/zinc/48/22/22/1131482222.db2.gz IAECJOPQANSHIM-KRWDZBQOSA-N 1 0 274.383 3.668 20 10 CHCDRO Cc1c(C[NH+]2CCC(CF)CC2)c2ccccc2n1C ZINC001138256763 1131482948 /nfs/dbraw/zinc/48/29/48/1131482948.db2.gz JNVYEGZUGISIIS-UHFFFAOYSA-N 1 0 274.383 3.668 20 10 CHCDRO Cc1c(C[N@H+]2C[C@@H]3[C@H](C2)C3(C)C)c2ccccc2n1C ZINC001138258302 1131483036 /nfs/dbraw/zinc/48/30/36/1131483036.db2.gz PDIXTPJDEDYPQK-IYBDPMFKSA-N 1 0 268.404 3.575 20 10 CHCDRO CC[N@H+](Cc1ccccn1)Cc1cc(Cl)c(C)cc1O ZINC000824783556 1131485447 /nfs/dbraw/zinc/48/54/47/1131485447.db2.gz VZJYJIXNFWUNSB-UHFFFAOYSA-N 1 0 290.794 3.771 20 10 CHCDRO CN1CCCc2cc(C[N@@H+]3CC[C@@H]4CCC[C@@H]4C3)ccc21 ZINC001138355357 1131493678 /nfs/dbraw/zinc/49/36/78/1131493678.db2.gz OVESZQKVIPWFQF-FUHWJXTLSA-N 1 0 284.447 3.691 20 10 CHCDRO CCC[N@@H+](Cc1ccc2c(c1)CCCN2C)CC1CC1 ZINC001138353959 1131494052 /nfs/dbraw/zinc/49/40/52/1131494052.db2.gz OCGBRZOXGACHMX-UHFFFAOYSA-N 1 0 272.436 3.691 20 10 CHCDRO CN1CCCc2cc(C[N@@H+]3CC[C@H]4CCC[C@H]4C3)ccc21 ZINC001138355356 1131494114 /nfs/dbraw/zinc/49/41/14/1131494114.db2.gz OVESZQKVIPWFQF-AEFFLSMTSA-N 1 0 284.447 3.691 20 10 CHCDRO CN1CCCc2cc(C[NH+]3CC(c4ccccc4)C3)ccc21 ZINC001138356604 1131494294 /nfs/dbraw/zinc/49/42/94/1131494294.db2.gz ROOUTZPPMAAPHL-UHFFFAOYSA-N 1 0 292.426 3.668 20 10 CHCDRO CCN(CC)c1ccc(C[NH+]2CCCCCC2)c(OC)c1 ZINC001138386156 1131497367 /nfs/dbraw/zinc/49/73/67/1131497367.db2.gz HZNWNYOQFFLDOG-UHFFFAOYSA-N 1 0 290.451 3.917 20 10 CHCDRO CCCc1ncc(C[NH2+]Cc2ccc3ccccc3c2O)o1 ZINC000825085821 1131498573 /nfs/dbraw/zinc/49/85/73/1131498573.db2.gz NHVQPEYEXWMART-UHFFFAOYSA-N 1 0 296.370 3.776 20 10 CHCDRO Cc1c2ccccc2[nH]c1C[N@@H+](C)Cc1ccccc1O ZINC001138400586 1131499467 /nfs/dbraw/zinc/49/94/67/1131499467.db2.gz UCGGAKJSIHFGPS-UHFFFAOYSA-N 1 0 280.371 3.814 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C2CCC(OC(F)F)CC2)cc1C ZINC000825143607 1131500270 /nfs/dbraw/zinc/50/02/70/1131500270.db2.gz GZQJQYHMERPVOH-UHFFFAOYSA-N 1 0 299.361 3.649 20 10 CHCDRO CCO[C@@H]1CCCC[C@H]1[NH2+][C@H](CC)c1ccccc1O ZINC000825299827 1131505782 /nfs/dbraw/zinc/50/57/82/1131505782.db2.gz PKZMSZQEYQCCBI-BFYDXBDKSA-N 1 0 277.408 3.781 20 10 CHCDRO CS[C@H]1CC[C@H]([NH2+]Cc2cc(Cl)c(C)cc2O)C1 ZINC000825320947 1131506297 /nfs/dbraw/zinc/50/62/97/1131506297.db2.gz QPISMYVCNIKGHP-RYUDHWBXSA-N 1 0 285.840 3.728 20 10 CHCDRO Oc1cc(Br)ccc1C[NH2+]C12CCC(CC1)C2 ZINC000825498162 1131513075 /nfs/dbraw/zinc/51/30/75/1131513075.db2.gz WZQIMYGLFIQJCA-UHFFFAOYSA-N 1 0 296.208 3.577 20 10 CHCDRO CC[N@H+](Cc1ccc2c(c1)CCCO2)Cc1ccccc1O ZINC001138718770 1131541345 /nfs/dbraw/zinc/54/13/45/1131541345.db2.gz LDDMIMMDJMDHMT-UHFFFAOYSA-N 1 0 297.398 3.739 20 10 CHCDRO CCn1ccc2ccc(C[N@H+](C)Cc3ccccc3O)cc21 ZINC001139124832 1131584363 /nfs/dbraw/zinc/58/43/63/1131584363.db2.gz UNKAVOHILJBZNS-UHFFFAOYSA-N 1 0 294.398 3.999 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@H]2CNc3ccccc3C2)c(O)c1 ZINC000844919341 1131607389 /nfs/dbraw/zinc/60/73/89/1131607389.db2.gz FLFVBLVZUWGMNQ-GOEBONIOSA-N 1 0 296.414 3.696 20 10 CHCDRO CCOc1ccc(C[N@H+](C)Cc2ccccc2O)cc1CC ZINC001139626672 1131624971 /nfs/dbraw/zinc/62/49/71/1131624971.db2.gz WGWLMDDLQVCMSZ-UHFFFAOYSA-N 1 0 299.414 3.985 20 10 CHCDRO CC[C@@H]1CCCC[N@@H+]1Cc1ccc(N(C)C)c(C)c1 ZINC001139673582 1131627722 /nfs/dbraw/zinc/62/77/22/1131627722.db2.gz UPIIIKYJPNJYIP-MRXNPFEDSA-N 1 0 260.425 3.826 20 10 CHCDRO Cc1cc(C[NH+]2C[C@@H](C)C[C@H](C)C2)ccc1N(C)C ZINC001139673457 1131627825 /nfs/dbraw/zinc/62/78/25/1131627825.db2.gz RTHAWWWQNACBEJ-KBPBESRZSA-N 1 0 260.425 3.539 20 10 CHCDRO CCCOc1ccc(C[NH2+][C@@H](C)Cc2ccccn2)cc1C ZINC001202970427 1131636435 /nfs/dbraw/zinc/63/64/35/1131636435.db2.gz JTNGRSNUTNMHMR-INIZCTEOSA-N 1 0 298.430 3.900 20 10 CHCDRO COc1cc(Cl)cc(C[N@H+](C)Cc2ccccc2O)c1 ZINC001144489970 1131646291 /nfs/dbraw/zinc/64/62/91/1131646291.db2.gz RGUXRPCSYSSQNT-UHFFFAOYSA-N 1 0 291.778 3.686 20 10 CHCDRO CC[N@H+](Cc1cc2ccccc2cn1)Cc1ccccc1O ZINC001140001378 1131655992 /nfs/dbraw/zinc/65/59/92/1131655992.db2.gz MAQRCNUMUKYPBU-UHFFFAOYSA-N 1 0 292.382 3.963 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2CS[C@H](C(C)C)C2)c1 ZINC000845972282 1131673689 /nfs/dbraw/zinc/67/36/89/1131673689.db2.gz QQWHYLLVCZGNPT-OZVIIMIRSA-N 1 0 295.448 3.582 20 10 CHCDRO Cc1ccc(C)c(C[N@H+](C)CCc2cccc(F)c2)c1O ZINC001140184592 1131674337 /nfs/dbraw/zinc/67/43/37/1131674337.db2.gz AUZLZRQCBFLWLM-UHFFFAOYSA-N 1 0 287.378 3.823 20 10 CHCDRO Cc1ccc(C)c(C[NH+]2CCC(c3cccnc3)CC2)c1O ZINC001140184037 1131674553 /nfs/dbraw/zinc/67/45/53/1131674553.db2.gz KUAFRDHEATVGFW-UHFFFAOYSA-N 1 0 296.414 3.784 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]CC[C@@]1(C)C[C@]1(F)Cl ZINC000846030129 1131680099 /nfs/dbraw/zinc/68/00/99/1131680099.db2.gz QDXDEXVPUNKHFG-JKSUJKDBSA-N 1 0 298.833 3.855 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@@H]1CSCc3ccccc31)CC2 ZINC000834545329 1131682660 /nfs/dbraw/zinc/68/26/60/1131682660.db2.gz YETYRCYXXDWMES-HZPDHXFCSA-N 1 0 297.423 3.957 20 10 CHCDRO COc1ccc(C[NH2+]CC[C@]2(C)C[C@@]2(F)Cl)cc1C ZINC000846039680 1131682914 /nfs/dbraw/zinc/68/29/14/1131682914.db2.gz VLBDPHCAMAAWGB-CABCVRRESA-N 1 0 285.790 3.798 20 10 CHCDRO C[C@]1(CC[NH2+]Cc2c(O)cccc2Cl)C[C@]1(F)Cl ZINC000846040649 1131683209 /nfs/dbraw/zinc/68/32/09/1131683209.db2.gz XPPWBKNUBHGGIK-QWHCGFSZSA-N 1 0 292.181 3.840 20 10 CHCDRO Oc1cccc(Cl)c1C[NH+]1CCC2(CC2(F)F)CC1 ZINC000846055754 1131685714 /nfs/dbraw/zinc/68/57/14/1131685714.db2.gz WZAHUXQVFWAWCM-UHFFFAOYSA-N 1 0 287.737 3.667 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@H]1CSc3ccccc31)CC2 ZINC000834594644 1131686505 /nfs/dbraw/zinc/68/65/05/1131686505.db2.gz SACNCIQUGBFEEP-KBPBESRZSA-N 1 0 283.396 3.816 20 10 CHCDRO COc1cccc2c1CC[C@H]2[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000834625159 1131688217 /nfs/dbraw/zinc/68/82/17/1131688217.db2.gz UUPOPYUCSXIRLM-HZPDHXFCSA-N 1 0 295.382 3.665 20 10 CHCDRO C[C@@H]1Cc2ccccc2[C@@H]1[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000834645507 1131689968 /nfs/dbraw/zinc/68/99/68/1131689968.db2.gz FTRHKNCZKVAFKU-SMNXXWJPSA-N 1 0 279.383 3.903 20 10 CHCDRO COc1cccc(C[C@@H](C)[NH2+][C@H]2CCc3cccc(O)c32)c1 ZINC000834646014 1131689989 /nfs/dbraw/zinc/68/99/89/1131689989.db2.gz UEMHDZJZBNLVBQ-DYVFJYSZSA-N 1 0 297.398 3.609 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]C2CC(c3ccccc3)C2)c1O ZINC000846149025 1131690931 /nfs/dbraw/zinc/69/09/31/1131690931.db2.gz FWSYLQATJHKWDS-JEYLPNPQSA-N 1 0 297.398 3.998 20 10 CHCDRO CCC[C@H](CC)[NH2+][C@H](C)c1cccc(OC)c1O ZINC000846149438 1131691308 /nfs/dbraw/zinc/69/13/08/1131691308.db2.gz NEEIZIUINBCMBE-NEPJUHHUSA-N 1 0 251.370 3.630 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]C2CC(c3ccccc3)C2)c1O ZINC000846149024 1131691377 /nfs/dbraw/zinc/69/13/77/1131691377.db2.gz FWSYLQATJHKWDS-IUDNXUCKSA-N 1 0 297.398 3.998 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CCCC(C)(C)C)c1O ZINC000846153807 1131692072 /nfs/dbraw/zinc/69/20/72/1131692072.db2.gz IKNQSKACAJOEIB-LBPRGKRZSA-N 1 0 265.397 3.878 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CCC(C)(C)C2CC2)c1O ZINC000846168915 1131692819 /nfs/dbraw/zinc/69/28/19/1131692819.db2.gz DIDNJJXJLCDIIQ-LBPRGKRZSA-N 1 0 277.408 3.878 20 10 CHCDRO CC[C@H](CC(F)(F)F)[NH2+][C@H](C)c1cccc(OC)c1O ZINC000846161697 1131693059 /nfs/dbraw/zinc/69/30/59/1131693059.db2.gz BBGINCUXKLHNCM-NXEZZACHSA-N 1 0 291.313 3.782 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]C[C@@H](SC)C(C)(C)C)c1O ZINC000846166553 1131693220 /nfs/dbraw/zinc/69/32/20/1131693220.db2.gz ZEFLOADQTGBTOV-BXUZGUMPSA-N 1 0 297.464 3.829 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]C[C@@H]2C[C@H]2c2ccccc2)c1O ZINC000846169405 1131693902 /nfs/dbraw/zinc/69/39/02/1131693902.db2.gz HLQLCSBZRYHPFF-KMFMINBZSA-N 1 0 297.398 3.855 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]Cc2cccc(Cl)c2)c1O ZINC000846138481 1131694069 /nfs/dbraw/zinc/69/40/69/1131694069.db2.gz SILDNRMIIHWZEQ-NSHDSACASA-N 1 0 291.778 3.905 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@H](C2CC2)C2CCC2)c1O ZINC000846168182 1131694085 /nfs/dbraw/zinc/69/40/85/1131694085.db2.gz HWWCIJKQVUIRII-BZNIZROVSA-N 1 0 275.392 3.630 20 10 CHCDRO CC[C@@H]1CCC[C@@H]1[NH2+][C@H](C)c1cccc(OC)c1O ZINC000846143865 1131695020 /nfs/dbraw/zinc/69/50/20/1131695020.db2.gz AGGOVKXCOJZXTC-BZPMIXESSA-N 1 0 263.381 3.630 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)COCC1CC1)c1cc(Cl)ccc1O ZINC000846205532 1131695649 /nfs/dbraw/zinc/69/56/49/1131695649.db2.gz QFGJIBWYSSIKHO-NHYWBVRUSA-N 1 0 297.826 3.901 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]Cc2ccc(F)c(F)c2)c1O ZINC000846147647 1131696140 /nfs/dbraw/zinc/69/61/40/1131696140.db2.gz WTYNVFJPWTYARW-JTQLQIEISA-N 1 0 293.313 3.530 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)COCC1CC1)c1ccc(N(C)C)cc1 ZINC000846202399 1131699361 /nfs/dbraw/zinc/69/93/61/1131699361.db2.gz CHLVUHNYCYCSCA-RDTXWAMCSA-N 1 0 290.451 3.608 20 10 CHCDRO Oc1cccc(Cl)c1C[NH+]1CC2(C1)CCCCC2 ZINC001140342103 1131703497 /nfs/dbraw/zinc/70/34/97/1131703497.db2.gz VCNOZEGSASAOCQ-UHFFFAOYSA-N 1 0 265.784 3.812 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)CC2 ZINC000834811905 1131707065 /nfs/dbraw/zinc/70/70/65/1131707065.db2.gz YUXLIZPAFGFEDC-YESZJQIVSA-N 1 0 279.383 3.773 20 10 CHCDRO CO[C@@H](C[NH2+][C@@H](C)c1cc(C)ccc1O)Cc1ccccc1 ZINC000834856067 1131713094 /nfs/dbraw/zinc/71/30/94/1131713094.db2.gz KJEWEDGCUVTYBQ-DOTOQJQBSA-N 1 0 299.414 3.609 20 10 CHCDRO Cc1cc(C[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)ccn1 ZINC000834859561 1131713184 /nfs/dbraw/zinc/71/31/84/1131713184.db2.gz DECNKPONUKJJDX-CQSZACIVSA-N 1 0 296.414 3.825 20 10 CHCDRO CCC1([NH2+][C@@H](C)c2cc(Br)ccc2O)CC1 ZINC000834874634 1131715319 /nfs/dbraw/zinc/71/53/19/1131715319.db2.gz GBWHOTZXNJVNHD-VIFPVBQESA-N 1 0 284.197 3.748 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H]2CCOC2(C)C)c1O ZINC000834875442 1131715739 /nfs/dbraw/zinc/71/57/39/1131715739.db2.gz OYPVZSMOKNGFGZ-ZWNOBZJWSA-N 1 0 283.799 3.572 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2C[C@H](C)n3ccnc32)c(O)c1C ZINC000834896491 1131721937 /nfs/dbraw/zinc/72/19/37/1131721937.db2.gz WRWXYOVYEQFNDR-CORIIIEPSA-N 1 0 285.391 3.562 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@@H]2CCCC[C@H]2O)c1O ZINC000834900500 1131725437 /nfs/dbraw/zinc/72/54/37/1131725437.db2.gz PTGJSJUWLPBKHP-TYNCELHUSA-N 1 0 297.826 3.556 20 10 CHCDRO C[C@H]([NH2+]C1CCC(OC(F)F)CC1)c1ccccc1O ZINC000834901783 1131725879 /nfs/dbraw/zinc/72/58/79/1131725879.db2.gz CLWQBNFIYVGGHZ-UNXYVOJBSA-N 1 0 285.334 3.593 20 10 CHCDRO CC[C@H]([NH2+]CC(C)(C)C(C)(C)O)c1ccc(C)cc1O ZINC000834905480 1131728481 /nfs/dbraw/zinc/72/84/81/1131728481.db2.gz WRZWKVYYXIEREG-AWEZNQCLSA-N 1 0 279.424 3.538 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCOC(C)(C)C2)c(O)c1 ZINC000834909106 1131729927 /nfs/dbraw/zinc/72/99/27/1131729927.db2.gz JBPSHAPAQXDNIO-KGLIPLIRSA-N 1 0 277.408 3.556 20 10 CHCDRO Cc1ccc(CC[NH2+][C@@H](C)c2c(C)cc(C)cc2O)nc1 ZINC000834908113 1131730399 /nfs/dbraw/zinc/73/03/99/1131730399.db2.gz BSIKNKBJIOQDDG-HNNXBMFYSA-N 1 0 284.403 3.606 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1C[C@H]1C1CC1)c1ccc(C)cc1O ZINC000834907257 1131730511 /nfs/dbraw/zinc/73/05/11/1131730511.db2.gz ZRBKKEQJFLYCRS-BPUTZDHNSA-N 1 0 259.393 3.787 20 10 CHCDRO C[N@H+](CCc1ccccc1)Cc1ccc(Cl)cc1O ZINC001140461739 1131749663 /nfs/dbraw/zinc/74/96/63/1131749663.db2.gz SPSSVYLRBDXBPC-UHFFFAOYSA-N 1 0 275.779 3.720 20 10 CHCDRO CC[N@H+](C/C=C/c1ccc(N(C)C)cc1)C1CCC1 ZINC000835024798 1131759925 /nfs/dbraw/zinc/75/99/25/1131759925.db2.gz BTGPFUJFZBGVEJ-VOTSOKGWSA-N 1 0 258.409 3.640 20 10 CHCDRO C[C@@H](Cc1ccco1)[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC000835036643 1131760237 /nfs/dbraw/zinc/76/02/37/1131760237.db2.gz PSMNLMIZQNZCMZ-VOKGJARPSA-N 1 0 284.403 3.580 20 10 CHCDRO C[C@@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)c1cccnc1 ZINC000835036706 1131761466 /nfs/dbraw/zinc/76/14/66/1131761466.db2.gz QMLDXOOEVKCNNM-CSPWOOARSA-N 1 0 281.403 3.512 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+][C@H]2CCCC(F)(F)C2)cc1 ZINC000835043854 1131762198 /nfs/dbraw/zinc/76/21/98/1131762198.db2.gz UIDREHKXJJULQD-XVWMLYKFSA-N 1 0 294.389 3.933 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+][C@@H]2CCCC(F)(F)C2)cc1 ZINC000835043851 1131762651 /nfs/dbraw/zinc/76/26/51/1131762651.db2.gz UIDREHKXJJULQD-FOSCPCJNSA-N 1 0 294.389 3.933 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]C2CCC(F)(F)CC2)cc1 ZINC000835042251 1131762658 /nfs/dbraw/zinc/76/26/58/1131762658.db2.gz SHQUTJYMZLZJKA-ARJAWSKDSA-N 1 0 294.389 3.933 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]C[C@@H]2CCCCS2)cc1 ZINC000835048289 1131764753 /nfs/dbraw/zinc/76/47/53/1131764753.db2.gz PRJSCGTUBCTHTN-OSJSJHBBSA-N 1 0 290.476 3.641 20 10 CHCDRO CC[N@H+](Cc1cc(C)c(O)c(C)c1)Cc1ccccc1O ZINC001140659222 1131854410 /nfs/dbraw/zinc/85/44/10/1131854410.db2.gz URNSCHJYUSHSKI-UHFFFAOYSA-N 1 0 285.387 3.737 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2cc(C)cc(Cl)n2)c(O)c1 ZINC000282761552 1131888826 /nfs/dbraw/zinc/88/88/26/1131888826.db2.gz OHANJJLWGVASOH-LBPRGKRZSA-N 1 0 290.794 3.908 20 10 CHCDRO Cc1c(O)ccc(C[N@@H+]2CCC[C@@H]3CCCC[C@@H]32)c1O ZINC001140749191 1131906445 /nfs/dbraw/zinc/90/64/45/1131906445.db2.gz QUCDOJHEZKCANS-ZFWWWQNUSA-N 1 0 275.392 3.561 20 10 CHCDRO Cc1cc(C[NH2+][C@@H](C)c2cccs2)ccc1N(C)C ZINC000773002588 1131914923 /nfs/dbraw/zinc/91/49/23/1131914923.db2.gz WKSHXYMNHXROMB-ZDUSSCGKSA-N 1 0 274.433 3.973 20 10 CHCDRO Cc1n[nH]cc1C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000773014701 1131920473 /nfs/dbraw/zinc/92/04/73/1131920473.db2.gz KKMVFTWMLRMOCJ-AWEZNQCLSA-N 1 0 298.434 3.559 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](CO)CC(C)(C)C)cc1 ZINC000773077547 1131937241 /nfs/dbraw/zinc/93/72/41/1131937241.db2.gz RXHNEDBUFBLJJU-GDBMZVCRSA-N 1 0 292.467 3.590 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@H](C)CC2)c(O)c1 ZINC001140850784 1131947881 /nfs/dbraw/zinc/94/78/81/1131947881.db2.gz UKJRAAZEYZEYEF-HNNXBMFYSA-N 1 0 290.451 3.860 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1ccc[nH]1)c1ccc(N(C)C)cc1 ZINC000773113998 1131947853 /nfs/dbraw/zinc/94/78/53/1131947853.db2.gz CCQPHVWTTCDWCR-CZUORRHYSA-N 1 0 271.408 3.883 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CC[C@H](C)C[C@@H]2C)c(O)c1 ZINC001140856344 1131949458 /nfs/dbraw/zinc/94/94/58/1131949458.db2.gz YNPDZGGLYAEWFX-GJZGRUSLSA-N 1 0 290.451 3.859 20 10 CHCDRO CC[C@@H](C)[N@H+](C)Cc1ccc(N(C)C)cc1Cl ZINC001140922073 1131962676 /nfs/dbraw/zinc/96/26/76/1131962676.db2.gz GPUUDJUYSCDHFN-LLVKDONJSA-N 1 0 254.805 3.636 20 10 CHCDRO CN(C)c1ccc(C[NH+]2CCCCCC2)c(Cl)c1 ZINC001140921966 1131963606 /nfs/dbraw/zinc/96/36/06/1131963606.db2.gz YLNWLESIFIBDLI-UHFFFAOYSA-N 1 0 266.816 3.782 20 10 CHCDRO CN(C)c1ccc(C[NH+]2CCC(C)(F)CC2)c(Cl)c1 ZINC001140921588 1131963688 /nfs/dbraw/zinc/96/36/88/1131963688.db2.gz IWHBWAYDGNGCTK-UHFFFAOYSA-N 1 0 284.806 3.730 20 10 CHCDRO CC1CC([N@H+](C)Cc2ccc(N(C)C)cc2Cl)C1 ZINC001140922698 1131964847 /nfs/dbraw/zinc/96/48/47/1131964847.db2.gz ZRTLSDPATNQULQ-UHFFFAOYSA-N 1 0 266.816 3.636 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)C2CCCC2)c(Cl)c1 ZINC001140924897 1131966294 /nfs/dbraw/zinc/96/62/94/1131966294.db2.gz VWDQHSDELLPDRO-UHFFFAOYSA-N 1 0 266.816 3.780 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCc2c(F)cccc2C1)c1ccccc1O ZINC001171404107 1131970945 /nfs/dbraw/zinc/97/09/45/1131970945.db2.gz FPHQRZAMGKXTJS-OCCSQVGLSA-N 1 0 285.362 3.739 20 10 CHCDRO COc1cccc(C[NH2+]C(C)(C)CC(C)(C)C)c1O ZINC000037100838 1131993872 /nfs/dbraw/zinc/99/38/72/1131993872.db2.gz ORHPFVGYORJOCF-UHFFFAOYSA-N 1 0 265.397 3.705 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccns2)c(O)c1 ZINC000715966738 1132000346 /nfs/dbraw/zinc/00/03/46/1132000346.db2.gz OTINCXQRUSSSBO-MNOVXSKESA-N 1 0 262.378 3.569 20 10 CHCDRO C[N@@H+](Cc1cc2c3c(c1)CCCN3CCC2)CC1CCC1 ZINC001141076210 1132005278 /nfs/dbraw/zinc/00/52/78/1132005278.db2.gz MRXSCZAOMIIGIS-UHFFFAOYSA-N 1 0 284.447 3.617 20 10 CHCDRO CC1CC([N@H+](C)Cc2cc3c4c(c2)CCCN4CCC3)C1 ZINC001141074196 1132005959 /nfs/dbraw/zinc/00/59/59/1132005959.db2.gz APCMOUXSPFUXAA-UHFFFAOYSA-N 1 0 284.447 3.616 20 10 CHCDRO CCCCCC[C@@H](C)[NH2+]Cc1cccc(OC)c1O ZINC000037139040 1132006767 /nfs/dbraw/zinc/00/67/67/1132006767.db2.gz RAMLFTVKMRLUNA-CYBMUJFWSA-N 1 0 265.397 3.849 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccc(F)cc1)c1ccc(N(C)C)cc1 ZINC000037195970 1132008038 /nfs/dbraw/zinc/00/80/38/1132008038.db2.gz IWJYMXZCKTUDGU-CQSZACIVSA-N 1 0 286.394 3.785 20 10 CHCDRO C[N@H+](Cc1ccccc1O)[C@H]1CCc2c(F)cccc2C1 ZINC001171436871 1132015116 /nfs/dbraw/zinc/01/51/16/1132015116.db2.gz GZGZXQQHJUVWJJ-HNNXBMFYSA-N 1 0 285.362 3.521 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1ccncc1 ZINC000037217755 1132023560 /nfs/dbraw/zinc/02/35/60/1132023560.db2.gz KNWMIJWVRKVFFE-KBPBESRZSA-N 1 0 269.392 3.559 20 10 CHCDRO C[C@H]([NH2+]CCc1cccc(F)c1)c1ccc(N(C)C)cc1 ZINC000037262353 1132024844 /nfs/dbraw/zinc/02/48/44/1132024844.db2.gz IMGNHVNSPSFHPV-AWEZNQCLSA-N 1 0 286.394 3.785 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]CC2CCCCC2)c1 ZINC000037259490 1132025486 /nfs/dbraw/zinc/02/54/86/1132025486.db2.gz BSLJJXLNCMIKKV-GFCCVEGCSA-N 1 0 263.381 3.632 20 10 CHCDRO CCC[C@H]1CCCC[N@@H+]1Cc1ccc2c(c1)OCCN2C ZINC001141143419 1132028167 /nfs/dbraw/zinc/02/81/67/1132028167.db2.gz YJMFQVHNKKRTNL-INIZCTEOSA-N 1 0 288.435 3.670 20 10 CHCDRO CCC(CC)[N@H+](CC)Cc1ccc2c(c1)OCCN2C ZINC001141144272 1132028374 /nfs/dbraw/zinc/02/83/74/1132028374.db2.gz YBNYAZRSDYKQGF-UHFFFAOYSA-N 1 0 276.424 3.526 20 10 CHCDRO Oc1ccc(O)c(C[N@@H+]2CCCC[C@@H]2c2ccccc2)c1 ZINC001141156308 1132030353 /nfs/dbraw/zinc/03/03/53/1132030353.db2.gz JENCVKRRTPAYLB-QGZVFWFLSA-N 1 0 283.371 3.825 20 10 CHCDRO C[C@H](c1ccccc1Cl)[N@H+](C)Cc1cc(O)ccc1O ZINC001141161174 1132030679 /nfs/dbraw/zinc/03/06/79/1132030679.db2.gz BBPFMNOHINGUIM-LLVKDONJSA-N 1 0 291.778 3.944 20 10 CHCDRO C[C@@H](CCc1ccccc1)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000037362834 1132030985 /nfs/dbraw/zinc/03/09/85/1132030985.db2.gz WZRPALGTAZEDSQ-HNNXBMFYSA-N 1 0 281.399 3.732 20 10 CHCDRO Oc1ccc(O)c(C[N@@H+]2CCC[C@H](Cc3ccccc3)C2)c1 ZINC001141158483 1132031808 /nfs/dbraw/zinc/03/18/08/1132031808.db2.gz AVSWKUJXLXZNGS-MRXNPFEDSA-N 1 0 297.398 3.553 20 10 CHCDRO Cc1cccc2c1CC[C@H]([NH2+]Cc1ccc3c(c1)CCO3)C2 ZINC001171553951 1132052667 /nfs/dbraw/zinc/05/26/67/1132052667.db2.gz XHKQTVGZAMAHIP-SFHVURJKSA-N 1 0 293.410 3.577 20 10 CHCDRO Cc1cccc2c1CC[C@@H]([NH2+]Cc1ccc3c(c1)CCO3)C2 ZINC001171553950 1132053252 /nfs/dbraw/zinc/05/32/52/1132053252.db2.gz XHKQTVGZAMAHIP-GOSISDBHSA-N 1 0 293.410 3.577 20 10 CHCDRO CC[C@H](C)OCC[C@H](C)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC001172343662 1132178476 /nfs/dbraw/zinc/17/84/76/1132178476.db2.gz RAEXGAUOFMLIRH-JYJNAYRXSA-N 1 0 292.467 3.997 20 10 CHCDRO Cc1ccc(C[NH2+]C/C=C\c2ccc(N(C)C)cc2)nc1C ZINC000839164967 1132187385 /nfs/dbraw/zinc/18/73/85/1132187385.db2.gz IGZGVDVLBINJSS-WAYWQWQTSA-N 1 0 295.430 3.567 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[NH2+][C@H]1CCC[C@@H]2C[C@@H]21 ZINC000839186758 1132188409 /nfs/dbraw/zinc/18/84/09/1132188409.db2.gz QTHDXNXEHCGGTE-NJAFHUGGSA-N 1 0 270.420 3.565 20 10 CHCDRO CC(C)COCC[C@H](C)[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001172483188 1132229162 /nfs/dbraw/zinc/22/91/62/1132229162.db2.gz JGHRBOBUSASWOC-INIZCTEOSA-N 1 0 292.467 3.636 20 10 CHCDRO CC(C)COCC[C@H](C)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC001172462926 1132243404 /nfs/dbraw/zinc/24/34/04/1132243404.db2.gz HCLQTYFIEYCREC-HOTGVXAUSA-N 1 0 292.467 3.854 20 10 CHCDRO C[C@H]1CC(C)(C)C[N@@H+]1Cc1c(O)ccc2ccncc21 ZINC000840182636 1132248656 /nfs/dbraw/zinc/24/86/56/1132248656.db2.gz HVMNPYBEFWJPGV-LBPRGKRZSA-N 1 0 270.376 3.561 20 10 CHCDRO Oc1ccc(C[NH2+][C@H]2CCC[C@@H](c3ccccc3)C2)c(O)c1 ZINC001172544428 1132279560 /nfs/dbraw/zinc/27/95/60/1132279560.db2.gz YSXKREUYIIRKHO-WBVHZDCISA-N 1 0 297.398 3.914 20 10 CHCDRO CO[C@@H]1C[C@@H]([NH2+][C@@H](C)c2c(C)cc(C)cc2O)C12CCC2 ZINC000840805861 1132289067 /nfs/dbraw/zinc/28/90/67/1132289067.db2.gz CCFXKQRYTGMCGY-NUEKZKHPSA-N 1 0 289.419 3.617 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1C[C@H](OC)C12CCC2)c1ccc(C)cc1O ZINC000840807187 1132289295 /nfs/dbraw/zinc/28/92/95/1132289295.db2.gz RANLTACDSWUVBU-UAGQMJEPSA-N 1 0 289.419 3.699 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CS[C@H](C)C1)c1cc2c(cc1O)CCCC2 ZINC000840858958 1132295491 /nfs/dbraw/zinc/29/54/91/1132295491.db2.gz FASPFGFTMBFYGK-XUJVJEKNSA-N 1 0 291.460 3.816 20 10 CHCDRO C[C@H]([NH2+]Cc1cnccc1C(C)(C)C)c1ccccc1O ZINC000840855860 1132296716 /nfs/dbraw/zinc/29/67/16/1132296716.db2.gz OQXHPZQAIJRHDV-ZDUSSCGKSA-N 1 0 284.403 3.936 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1C[C@@H](C)O[C@H]1C)c1cc(Cl)ccc1O ZINC000840871917 1132298792 /nfs/dbraw/zinc/29/87/92/1132298792.db2.gz ICDBPFDSTWLQQD-WISYIIOYSA-N 1 0 283.799 3.510 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCCC[C@H]2F)c(O)c1C ZINC000840875711 1132299313 /nfs/dbraw/zinc/29/93/13/1132299313.db2.gz JDNBCFVXGWXYAK-BPLDGKMQSA-N 1 0 265.372 3.940 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCCC[C@H]2F)c1 ZINC000840877237 1132300119 /nfs/dbraw/zinc/30/01/19/1132300119.db2.gz ZQXXANGIOHETMJ-IACUBPJLSA-N 1 0 251.345 3.632 20 10 CHCDRO CC[C@H]([NH2+][C@@H](CC)[C@@H](O)C(C)C)c1cccc(Cl)c1[O-] ZINC000840880772 1132300221 /nfs/dbraw/zinc/30/02/21/1132300221.db2.gz FACQXOBVIDULLS-KKUMJFAQSA-N 1 0 299.842 3.882 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H]2CCO[C@H](C(C)C)C2)c(Cl)c1 ZINC000840908858 1132307491 /nfs/dbraw/zinc/30/74/91/1132307491.db2.gz YLZDAPYLVGZNDS-LRDDRELGSA-N 1 0 297.826 3.647 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+](Cc1ccccn1)C(C)C ZINC000840911658 1132308571 /nfs/dbraw/zinc/30/85/71/1132308571.db2.gz LTNIJTWFIGENEI-UHFFFAOYSA-N 1 0 297.446 3.867 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](c1cccnc1)C1CC1 ZINC000840936956 1132309559 /nfs/dbraw/zinc/30/95/59/1132309559.db2.gz OUDREDJBGJIDOU-IBGZPJMESA-N 1 0 295.430 3.697 20 10 CHCDRO CO[C@H](C[NH2+]Cc1ccc(N(C)C)cc1C)c1ccccc1 ZINC000840929492 1132310061 /nfs/dbraw/zinc/31/00/61/1132310061.db2.gz MKCJQHYLCFMTPT-LJQANCHMSA-N 1 0 298.430 3.538 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CCC[C@H]2CCCCO2)c(Cl)c1 ZINC000840938721 1132310412 /nfs/dbraw/zinc/31/04/12/1132310412.db2.gz FYANWLFNRPBFJI-CYBMUJFWSA-N 1 0 297.826 3.793 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)cc1C)c1nccs1 ZINC000840934399 1132310468 /nfs/dbraw/zinc/31/04/68/1132310468.db2.gz POOQIWCUUQJIBR-HNNXBMFYSA-N 1 0 289.448 3.758 20 10 CHCDRO CCc1noc(C)c1C[NH2+]Cc1c(O)cc(C)cc1Cl ZINC000840948850 1132311100 /nfs/dbraw/zinc/31/11/00/1132311100.db2.gz JASNUMFBPZJFMM-UHFFFAOYSA-N 1 0 294.782 3.503 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CC2(C(F)(F)F)CC2)c(Cl)c1 ZINC000840947471 1132312470 /nfs/dbraw/zinc/31/24/70/1132312470.db2.gz UTRRNJDSLIHEIM-UHFFFAOYSA-N 1 0 293.716 3.786 20 10 CHCDRO COC(C)(C)[C@@H]1CCC[N@@H+]1Cc1c(O)ccc2ccccc21 ZINC001231589326 1132318275 /nfs/dbraw/zinc/31/82/75/1132318275.db2.gz BXCALENGCWRAMG-SFHVURJKSA-N 1 0 299.414 3.935 20 10 CHCDRO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2cccc(C)c2O)cn1 ZINC001231592087 1132320655 /nfs/dbraw/zinc/32/06/55/1132320655.db2.gz BEQYISHMEWKBJR-KRWDZBQOSA-N 1 0 282.387 3.741 20 10 CHCDRO C[C@@H](CCc1ccccc1)C[NH2+]CCc1ccc(N)cc1 ZINC000841036548 1132321521 /nfs/dbraw/zinc/32/15/21/1132321521.db2.gz VABJIRJDQIUTOI-INIZCTEOSA-N 1 0 282.431 3.670 20 10 CHCDRO CCC[C@@H](Cc1ccccc1)[NH2+]CCc1ccc(N)cc1 ZINC000841035328 1132321973 /nfs/dbraw/zinc/32/19/73/1132321973.db2.gz MSJVTRKKFUWONJ-IBGZPJMESA-N 1 0 282.431 3.812 20 10 CHCDRO Cc1cc(O)c(CNc2ccc([C@@H](C)[NH3+])cc2)cc1C ZINC000841027441 1132322109 /nfs/dbraw/zinc/32/21/09/1132322109.db2.gz BCCMISUAAGENID-CYBMUJFWSA-N 1 0 270.376 3.641 20 10 CHCDRO Nc1ccc(CC[NH2+]Cc2ccc(C(F)F)cc2)cc1 ZINC000841038275 1132322784 /nfs/dbraw/zinc/32/27/84/1132322784.db2.gz IMHXSNNRYSQOHM-UHFFFAOYSA-N 1 0 276.330 3.539 20 10 CHCDRO CC[NH2+]Cc1cccc(NCc2cc(C)c(C)cc2O)c1 ZINC000841043798 1132324436 /nfs/dbraw/zinc/32/44/36/1132324436.db2.gz VDIWRPKFYQRFFK-UHFFFAOYSA-N 1 0 284.403 3.731 20 10 CHCDRO C[NH2+]Cc1cccc(NC/C=C/c2ccc(N(C)C)cc2)c1 ZINC000841043806 1132324770 /nfs/dbraw/zinc/32/47/70/1132324770.db2.gz WPIQINYMLNAMIV-FNORWQNLSA-N 1 0 295.430 3.597 20 10 CHCDRO CCN(CC)c1ccc(CNc2ccc(C[NH3+])cc2)cc1 ZINC000841059739 1132324827 /nfs/dbraw/zinc/32/48/27/1132324827.db2.gz WNEOWONRBYYRIO-UHFFFAOYSA-N 1 0 283.419 3.604 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCC[C@H]2c2nccs2)c(O)c1 ZINC001231846871 1132378428 /nfs/dbraw/zinc/37/84/28/1132378428.db2.gz RQRWRTCVZPQDHJ-AWEZNQCLSA-N 1 0 288.416 3.803 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCc3sccc3C2)c(O)c1 ZINC001231844980 1132379177 /nfs/dbraw/zinc/37/91/77/1132379177.db2.gz UWZQABBCRXEMME-UHFFFAOYSA-N 1 0 273.401 3.629 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CC[C@](C)(CF)C2)cc1Cl ZINC001231867143 1132382145 /nfs/dbraw/zinc/38/21/45/1132382145.db2.gz HVYDFIQSERKOSS-CQSZACIVSA-N 1 0 271.763 3.536 20 10 CHCDRO Cc1cc(O)c(C[NH+]2CCC(C)(C)CC2)cc1Cl ZINC001231870933 1132385171 /nfs/dbraw/zinc/38/51/71/1132385171.db2.gz WNSCJQRKNANTFX-UHFFFAOYSA-N 1 0 267.800 3.976 20 10 CHCDRO Cc1nc(CC[NH2+][C@@H](C)c2ccc(Cl)cc2O)cs1 ZINC000841745275 1132387933 /nfs/dbraw/zinc/38/79/33/1132387933.db2.gz PFWGFKGWHYSIDM-VIFPVBQESA-N 1 0 296.823 3.704 20 10 CHCDRO Cc1noc(C)c1C[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841744121 1132388394 /nfs/dbraw/zinc/38/83/94/1132388394.db2.gz FEQZGMCDRKQQSY-QMMMGPOBSA-N 1 0 280.755 3.501 20 10 CHCDRO CC1CC([N@H+](C)Cc2ccc3ccccc3c2O)C1 ZINC001231879589 1132389211 /nfs/dbraw/zinc/38/92/11/1132389211.db2.gz JGRBMQCXNYBYDD-UHFFFAOYSA-N 1 0 255.361 3.776 20 10 CHCDRO Oc1c(C[N@@H+]2CCc3occc3C2)ccc2ccccc21 ZINC001231881630 1132389262 /nfs/dbraw/zinc/38/92/62/1132389262.db2.gz ZNBQDZHEEMCTCV-UHFFFAOYSA-N 1 0 279.339 3.697 20 10 CHCDRO C[C@@H]([NH2+]CCOC(C)(C)C)c1ccc(Cl)cc1O ZINC000841749926 1132389610 /nfs/dbraw/zinc/38/96/10/1132389610.db2.gz JYUGGZUWRCVEKG-SNVBAGLBSA-N 1 0 271.788 3.511 20 10 CHCDRO C[C@@H]1CCCC[N@@H+]1Cc1ccc2ccccc2c1O ZINC001231878778 1132389667 /nfs/dbraw/zinc/38/96/67/1132389667.db2.gz SXFBSPQGZWLCIS-CYBMUJFWSA-N 1 0 255.361 3.920 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCC(C)(C)O1)c1ccc(Cl)cc1O ZINC000841751765 1132391815 /nfs/dbraw/zinc/39/18/15/1132391815.db2.gz IZISXESKBINDPY-ZYHUDNBSSA-N 1 0 283.799 3.654 20 10 CHCDRO CO[C@@H]([C@H](C)[NH2+][C@H](C)c1ccc(Cl)cc1O)C1CC1 ZINC000841758869 1132394973 /nfs/dbraw/zinc/39/49/73/1132394973.db2.gz VRKUSLJRNXEDKY-FTGAXOIBSA-N 1 0 283.799 3.510 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H]2COCc3ccccc32)c(O)c1C ZINC000841761630 1132396924 /nfs/dbraw/zinc/39/69/24/1132396924.db2.gz QAFQHHWYRIUSIK-KDOFPFPSSA-N 1 0 297.398 3.931 20 10 CHCDRO Cc1noc(C)c1CC[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841764883 1132397197 /nfs/dbraw/zinc/39/71/97/1132397197.db2.gz SOHTZMRSEDXLSY-VIFPVBQESA-N 1 0 294.782 3.544 20 10 CHCDRO [O-]c1cc(F)c(F)cc1C[N@@H+]1CC[C@H]2CCCC[C@@H]2C1 ZINC001142531002 1132404173 /nfs/dbraw/zinc/40/41/73/1132404173.db2.gz NPJZAVPJZRIZCY-VXGBXAGGSA-N 1 0 281.346 3.683 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc(C)nc1C ZINC001232085005 1132420337 /nfs/dbraw/zinc/42/03/37/1132420337.db2.gz YFAFCBCVLJISCM-UHFFFAOYSA-N 1 0 297.446 3.787 20 10 CHCDRO CC[C@H]1CC[C@@H]([NH2+]Cc2cc(Br)ccc2O)C1 ZINC001173269552 1132433857 /nfs/dbraw/zinc/43/38/57/1132433857.db2.gz XHPKJESXGIZMAX-GXFFZTMASA-N 1 0 298.224 3.823 20 10 CHCDRO Oc1cc(O)c(C[N@@H+]2CC[C@H]2c2ccccc2)cc1Cl ZINC001232262856 1132443679 /nfs/dbraw/zinc/44/36/79/1132443679.db2.gz TXVQUHAOYJASKY-AWEZNQCLSA-N 1 0 289.762 3.698 20 10 CHCDRO CC[N@H+](Cc1cccs1)Cc1cc(Cl)c(O)cc1O ZINC001232262831 1132445331 /nfs/dbraw/zinc/44/53/31/1132445331.db2.gz SAFAKTBGYYRHTQ-UHFFFAOYSA-N 1 0 297.807 3.835 20 10 CHCDRO COc1cc(O)c(C[NH+]2CC3(C2)CCCCC3)cc1Cl ZINC001232268523 1132447602 /nfs/dbraw/zinc/44/76/02/1132447602.db2.gz ONEZNPYBWKQIND-UHFFFAOYSA-N 1 0 295.810 3.820 20 10 CHCDRO CCOc1cccc(C[NH2+]C2(c3ccccc3C)CC2)c1O ZINC000842731904 1132455538 /nfs/dbraw/zinc/45/55/38/1132455538.db2.gz CHNCNGLOEHKKRH-UHFFFAOYSA-N 1 0 297.398 3.878 20 10 CHCDRO C[N@H+](Cc1ccc(C(F)(F)F)o1)Cc1ccccc1O ZINC001232446421 1132471078 /nfs/dbraw/zinc/47/10/78/1132471078.db2.gz MEXCOQNRYXFLME-UHFFFAOYSA-N 1 0 285.265 3.636 20 10 CHCDRO C[C@@H]([NH2+][C@H]1C[C@@H](OC(C)(C)C)C1)c1cc(F)ccc1O ZINC000842922957 1132475861 /nfs/dbraw/zinc/47/58/61/1132475861.db2.gz ZVAIIECWPCSIQI-RTXFEEFZSA-N 1 0 281.371 3.528 20 10 CHCDRO COc1cccc(C)c1C[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001232623420 1132496535 /nfs/dbraw/zinc/49/65/35/1132496535.db2.gz OZQAUFFGURMLSZ-UHFFFAOYSA-N 1 0 298.430 3.702 20 10 CHCDRO CN(Cc1cscn1)Cc1cccc(C(C)(C)C)c1O ZINC001143111913 1132504199 /nfs/dbraw/zinc/50/41/99/1132504199.db2.gz IFOVQZYCDPIVBI-UHFFFAOYSA-N 1 0 290.432 3.778 20 10 CHCDRO CC(C)(C)c1cccc(C[N@@H+]2CC[C@@]3(CC3(F)F)C2)c1O ZINC001143111134 1132504497 /nfs/dbraw/zinc/50/44/97/1132504497.db2.gz YUVNJEDCUPDIMT-MRXNPFEDSA-N 1 0 295.373 3.921 20 10 CHCDRO COc1cccc(C[N@@H+]2CCCC[C@@H]2C2CCC2)c1O ZINC000843437599 1132535142 /nfs/dbraw/zinc/53/51/42/1132535142.db2.gz OSJBHCAUYGVRQD-OAHLLOKOSA-N 1 0 275.392 3.555 20 10 CHCDRO C[C@@H]1SCC[C@H]1[NH2+]Cc1ccc2ccccc2c1O ZINC000843435489 1132535254 /nfs/dbraw/zinc/53/52/54/1132535254.db2.gz UXBBJGZVDCYRQV-XHDPSFHLSA-N 1 0 273.401 3.529 20 10 CHCDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CC[C@]3(CC3(F)F)C2)c1 ZINC001233286225 1132594267 /nfs/dbraw/zinc/59/42/67/1132594267.db2.gz KTHQTNUOQZIUQA-INIZCTEOSA-N 1 0 295.373 3.921 20 10 CHCDRO C[N@@H+](Cc1cc(C(C)(C)C)ccc1O)CC1CCOCC1 ZINC001233284440 1132594939 /nfs/dbraw/zinc/59/49/39/1132594939.db2.gz VAZOSIXLJHCTCE-UHFFFAOYSA-N 1 0 291.435 3.548 20 10 CHCDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2C[C@@H]3CCC[C@@H]3C2)c1 ZINC001233284411 1132595371 /nfs/dbraw/zinc/59/53/71/1132595371.db2.gz TYLMJGVJGSYEDO-OKILXGFUSA-N 1 0 273.420 3.922 20 10 CHCDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CC[C@](C)(CF)C2)c1 ZINC001233284218 1132595561 /nfs/dbraw/zinc/59/55/61/1132595561.db2.gz MKDNEHDSHRPVSL-QGZVFWFLSA-N 1 0 279.399 3.871 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2cc(C(C)(C)C)ccc2O)C[C@H]1F ZINC001233284477 1132595747 /nfs/dbraw/zinc/59/57/47/1132595747.db2.gz WJPCPQCEXNJTIR-IUODEOHRSA-N 1 0 279.399 3.870 20 10 CHCDRO Nc1ccc(CCc2ccc(Nc3cc[nH+]cc3)cc2)cc1 ZINC001173883479 1132623712 /nfs/dbraw/zinc/62/37/12/1132623712.db2.gz KRHHGOJSJUFXCC-UHFFFAOYSA-N 1 0 289.382 3.615 20 10 CHCDRO CCOc1cc[nH+]c(NCc2cc3ccccc3cc2O)c1 ZINC001160206795 1132946256 /nfs/dbraw/zinc/94/62/56/1132946256.db2.gz KYUCWPLMYPWYLC-UHFFFAOYSA-N 1 0 294.354 3.951 20 10 CHCDRO Cc1cc(Nc2cc(C(C)(C)C)ccc2O)cc[nH+]1 ZINC001174656448 1132951589 /nfs/dbraw/zinc/95/15/89/1132951589.db2.gz MRSAOPBAJVVAJX-UHFFFAOYSA-N 1 0 256.349 3.559 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)C[C@@H]2C[C@H]2c2ccccc2)cc1 ZINC001204146071 1132952430 /nfs/dbraw/zinc/95/24/30/1132952430.db2.gz RRUOZWZVGDKTRE-ICSRJNTNSA-N 1 0 294.442 3.988 20 10 CHCDRO Cc1cc(C)c(O)c2c1CC(C)(C)[C@@H]2Nc1cccc(N)[nH+]1 ZINC001163486952 1133152642 /nfs/dbraw/zinc/15/26/42/1133152642.db2.gz PAQUXJSRNLGWBO-QGZVFWFLSA-N 1 0 297.402 3.722 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCC[C@H](OCc2ccccc2)C1 ZINC001203558723 1133340580 /nfs/dbraw/zinc/34/05/80/1133340580.db2.gz YKPMCUUIKAJGED-SFHVURJKSA-N 1 0 297.398 3.573 20 10 CHCDRO CC[N@H+](Cc1ccc(C)cc1)Cc1ccc(OC)cc1O ZINC001203634392 1133346834 /nfs/dbraw/zinc/34/68/34/1133346834.db2.gz CPUGQIORVKEABH-UHFFFAOYSA-N 1 0 285.387 3.731 20 10 CHCDRO C[C@]1(F)CCC[N@H+](Cc2cc(Cl)ccc2O)CC1 ZINC001203650835 1133347527 /nfs/dbraw/zinc/34/75/27/1133347527.db2.gz FFPBAHUGLOUCQY-AWEZNQCLSA-N 1 0 271.763 3.760 20 10 CHCDRO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1ccc(N(C)C)cc1 ZINC001203937618 1133386613 /nfs/dbraw/zinc/38/66/13/1133386613.db2.gz HJXYPXFAQDDZIW-OAHLLOKOSA-N 1 0 280.415 3.699 20 10 CHCDRO CCN(CC)c1ccc(C[NH+]2CC3(CCC3)C2)cc1 ZINC001203939386 1133386650 /nfs/dbraw/zinc/38/66/50/1133386650.db2.gz APZADSHLYKKTJI-UHFFFAOYSA-N 1 0 258.409 3.519 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](CC2CC2)C2CC2)cc1 ZINC001203943484 1133387827 /nfs/dbraw/zinc/38/78/27/1133387827.db2.gz DMJKRPZTHVWQOQ-UHFFFAOYSA-N 1 0 272.436 3.907 20 10 CHCDRO Oc1cccc(Nc2cccc(C[NH+]3CCCCC3)c2)c1O ZINC001204109357 1133408176 /nfs/dbraw/zinc/40/81/76/1133408176.db2.gz IKUKFZDCRNZSNH-UHFFFAOYSA-N 1 0 298.386 3.827 20 10 CHCDRO C[C@@H]1CC[C@H](C)C[N@H+]1Cc1ccc(Cl)cc1O ZINC001204164133 1133412107 /nfs/dbraw/zinc/41/21/07/1133412107.db2.gz YNCPEHMOBPNXPL-WDEREUQCSA-N 1 0 253.773 3.666 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC[C@H](F)C2)c2ccccc21 ZINC001204240696 1133423804 /nfs/dbraw/zinc/42/38/04/1133423804.db2.gz BLIKQGIKILTOHC-HNNXBMFYSA-N 1 0 286.394 3.840 20 10 CHCDRO CN(C)c1ccc(C[NH+]2CC(C(F)F)C2)c2ccccc21 ZINC001204240921 1133424331 /nfs/dbraw/zinc/42/43/31/1133424331.db2.gz LFSPHIRNLYHWCV-UHFFFAOYSA-N 1 0 290.357 3.603 20 10 CHCDRO CC[N@H+](Cc1ccc(Cl)cc1)Cc1ccc(O)cc1O ZINC001204279946 1133427526 /nfs/dbraw/zinc/42/75/26/1133427526.db2.gz FXDACDYCFPLPDP-UHFFFAOYSA-N 1 0 291.778 3.773 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[N@@H+]1CC[C@H]2CCC[C@H]2C1 ZINC001204323771 1133436623 /nfs/dbraw/zinc/43/66/23/1133436623.db2.gz JAJPKDRZANNJNH-MSOLQXFVSA-N 1 0 284.447 3.909 20 10 CHCDRO F[C@H]1CCC[N@H+](Cc2ccc(N3CCCC3)cc2)CC1 ZINC001204323757 1133436699 /nfs/dbraw/zinc/43/66/99/1133436699.db2.gz IXBJDTNJCCJGGN-INIZCTEOSA-N 1 0 276.399 3.611 20 10 CHCDRO CCC(CC)[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001204321774 1133436780 /nfs/dbraw/zinc/43/67/80/1133436780.db2.gz KMPJQIMFXAOAKS-UHFFFAOYSA-N 1 0 260.425 3.907 20 10 CHCDRO C[N@H+](Cc1ccc(N2CCCC2)cc1)C1CC(F)(F)C1 ZINC001204318984 1133436879 /nfs/dbraw/zinc/43/68/79/1133436879.db2.gz BYBJLFZQJZFJGT-UHFFFAOYSA-N 1 0 280.362 3.516 20 10 CHCDRO Cc1ncccc1C[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001204328536 1133437703 /nfs/dbraw/zinc/43/77/03/1133437703.db2.gz INOSZPKBJDIFHU-UHFFFAOYSA-N 1 0 295.430 3.622 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCc2cccc(F)c2C1 ZINC001204346580 1133438105 /nfs/dbraw/zinc/43/81/05/1133438105.db2.gz AQZJZEAQELAQTO-UHFFFAOYSA-N 1 0 298.405 3.758 20 10 CHCDRO C[C@@H]1CCC[N@H+](Cc2ccc(N3CCCC3)cc2)CC1 ZINC001204324926 1133438153 /nfs/dbraw/zinc/43/81/53/1133438153.db2.gz PKKHSRXRPSDYES-MRXNPFEDSA-N 1 0 272.436 3.909 20 10 CHCDRO C[C@H]1C[N@H+](Cc2ccc(N3CCCC3)cc2)CCC1(F)F ZINC001204326291 1133438647 /nfs/dbraw/zinc/43/86/47/1133438647.db2.gz WUJZKXPXBVVLKO-AWEZNQCLSA-N 1 0 294.389 3.764 20 10 CHCDRO CCOc1ccc2c(c1)C[N@@H+](Cc1ccc(C)cc1O)CC2 ZINC001204422894 1133446301 /nfs/dbraw/zinc/44/63/01/1133446301.db2.gz UKIMXXVOCNIAAW-UHFFFAOYSA-N 1 0 297.398 3.658 20 10 CHCDRO Cc1occc1CN(C)Cc1cc(F)c(N(C)C)cc1F ZINC001204735867 1133479702 /nfs/dbraw/zinc/47/97/02/1133479702.db2.gz FMFUMDLFXHXZQD-UHFFFAOYSA-N 1 0 294.345 3.564 20 10 CHCDRO CC[N@H+](Cc1ccc(N)cc1)[C@H](C)Cc1ccc(OC)cc1 ZINC001204869677 1133493641 /nfs/dbraw/zinc/49/36/41/1133493641.db2.gz GGBQNIOUCVJYQE-OAHLLOKOSA-N 1 0 298.430 3.731 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCc2sccc2C1 ZINC001205169187 1133540489 /nfs/dbraw/zinc/54/04/89/1133540489.db2.gz CZTFUCHYRMCGIT-UHFFFAOYSA-N 1 0 286.444 3.681 20 10 CHCDRO CCC[C@H]([NH2+]Cc1ccc(OC)cc1O)[C@@H]1CC1(C)C ZINC001205517483 1133584526 /nfs/dbraw/zinc/58/45/26/1133584526.db2.gz QYWAUFVBWGGTCP-GJZGRUSLSA-N 1 0 277.408 3.705 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H]1CC[C@@H](C)C1 ZINC001206321141 1133688940 /nfs/dbraw/zinc/68/89/40/1133688940.db2.gz PROKIQJTGGHKDX-KMFMINBZSA-N 1 0 274.452 3.770 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H]2[C@@H]3Cc4cc(Cl)ccc4[C@@H]32)c(O)c1 ZINC001206743477 1133740345 /nfs/dbraw/zinc/74/03/45/1133740345.db2.gz TZCWOHCBGJTLEE-BPQIPLTHSA-N 1 0 299.801 3.782 20 10 CHCDRO Cc1cccc(C[C@@H](C)[NH2+][C@@H](C)c2ccccc2O)c1 ZINC001207161620 1133774211 /nfs/dbraw/zinc/77/42/11/1133774211.db2.gz ZRVAJJZOKMKWLF-CABCVRRESA-N 1 0 269.388 3.982 20 10 CHCDRO CC(C)c1ccc(O)c(C[NH2+]C[C@@H]2CC3(CCC3)CO2)c1 ZINC001207576581 1133820714 /nfs/dbraw/zinc/82/07/14/1133820714.db2.gz JMDPHPDXMRVATE-INIZCTEOSA-N 1 0 289.419 3.564 20 10 CHCDRO CCc1cccc(C[NH2+]C(C)(C)/C=C/Cl)c1O ZINC001207595359 1133826811 /nfs/dbraw/zinc/82/68/11/1133826811.db2.gz YQDAIDUBVOVQJW-CMDGGOBGSA-N 1 0 253.773 3.575 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+]1C[C@H]2[C@H]3CC[C@H](C3)[C@@]2(C)C1 ZINC001207692487 1133839719 /nfs/dbraw/zinc/83/97/19/1133839719.db2.gz ZROCNSLWROYPIF-MFHCWRBVSA-N 1 0 298.474 3.929 20 10 CHCDRO CC/C=C\CCC[NH+]1CCN(c2ccc(OC)cc2)CC1 ZINC001208132789 1133883018 /nfs/dbraw/zinc/88/30/18/1133883018.db2.gz VPBYOBIBGRQTKD-PLNGDYQASA-N 1 0 288.435 3.564 20 10 CHCDRO CC/C=C\CC[N@@H+]1CCc2c(c3cc(OC)ccc3n2C)C1 ZINC001208728582 1133935937 /nfs/dbraw/zinc/93/59/37/1133935937.db2.gz GFIMYHIQWANEGS-WAYWQWQTSA-N 1 0 298.430 3.901 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(C[N@@H+]2CC[C@H](F)C2)cc1 ZINC001209516353 1134031431 /nfs/dbraw/zinc/03/14/31/1134031431.db2.gz DROUWQLNONASBP-INIZCTEOSA-N 1 0 272.367 3.638 20 10 CHCDRO CC[N@H+](CCOC)Cc1ccc(-n2c(C)ccc2C)cc1 ZINC001209519449 1134035271 /nfs/dbraw/zinc/03/52/71/1134035271.db2.gz UXVZSEDVVSSAIZ-UHFFFAOYSA-N 1 0 286.419 3.562 20 10 CHCDRO COc1c[nH+]ccc1Nc1cc(Cl)c(C)c(Cl)c1O ZINC001211263976 1134400378 /nfs/dbraw/zinc/40/03/78/1134400378.db2.gz QCRFJUSOGSROEW-UHFFFAOYSA-N 1 0 299.157 3.577 20 10 CHCDRO COc1ccc(C[NH+]2CCC(c3ccccc3)CC2)c(O)c1 ZINC000179924957 1134561226 /nfs/dbraw/zinc/56/12/26/1134561226.db2.gz PQEPJSLJWZPXNL-UHFFFAOYSA-N 1 0 297.398 3.780 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CC[C@@H](CC(C)C)C2)c1O ZINC000307778488 1134946919 /nfs/dbraw/zinc/94/69/19/1134946919.db2.gz RDQGNVFRJIZQDY-LBPRGKRZSA-N 1 0 297.826 3.922 20 10 CHCDRO C[C@H](Oc1ccccc1NN=C1C=CC=CC1=O)C1C[NH2+]C1 ZINC001218193063 1135067190 /nfs/dbraw/zinc/06/71/90/1135067190.db2.gz GVOKFMPOIYDITH-IVGVGDLQSA-N 1 0 297.358 3.794 20 10 CHCDRO CCC[C@H](Oc1ccc(N2CC[NH2+]CC2)cc1)[C@H](C)CC ZINC001218290763 1135078633 /nfs/dbraw/zinc/07/86/33/1135078633.db2.gz CKXWFERNXVNGFM-QAPCUYQASA-N 1 0 290.451 3.690 20 10 CHCDRO C[C@@H]1[NH2+]C[C@@H]1OC1=CC(=O)C=CC1=NNc1ccccc1 ZINC001218394506 1135098782 /nfs/dbraw/zinc/09/87/82/1135098782.db2.gz YGNUQSIOTLQSOH-LJWNEUSZSA-N 1 0 283.331 3.547 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)c1ccccn1 ZINC000314201724 1135143281 /nfs/dbraw/zinc/14/32/81/1135143281.db2.gz QELSTISMLNZLTH-MRXNPFEDSA-N 1 0 295.430 3.923 20 10 CHCDRO CCOc1cccc(C[NH+]2CCCCCCCC2)c1O ZINC000322045469 1135595049 /nfs/dbraw/zinc/59/50/49/1135595049.db2.gz HLWRYXSBSRDSRZ-UHFFFAOYSA-N 1 0 277.408 3.947 20 10 CHCDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+][C@@H](C)c1ccccn1 ZINC000020123639 171004766 /nfs/dbraw/zinc/00/47/66/171004766.db2.gz VJCKLPAXBOICMR-YDHLFZDLSA-N 1 0 282.387 3.995 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2cccnc2)c(O)c1 ZINC000020127991 171013726 /nfs/dbraw/zinc/01/37/26/171013726.db2.gz YNWWYPKVRNJELE-OLZOCXBDSA-N 1 0 256.349 3.507 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cc(F)ccc1F ZINC000020146103 171032058 /nfs/dbraw/zinc/03/20/58/171032058.db2.gz YJAKZBKUOIKLFU-GFCCVEGCSA-N 1 0 290.357 3.882 20 10 CHCDRO Cc1cc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2)c(C)o1 ZINC000020439200 171203120 /nfs/dbraw/zinc/20/31/20/171203120.db2.gz FIVLISAVWLKNCV-ZDUSSCGKSA-N 1 0 272.392 3.813 20 10 CHCDRO Cc1cc(C)c(C[NH2+]Cc2ccc(N(C)C)cc2)c(C)c1 ZINC000021007711 171285258 /nfs/dbraw/zinc/28/52/58/171285258.db2.gz SARTYIKXPXCHBW-UHFFFAOYSA-N 1 0 282.431 3.968 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2ccccn2)c1 ZINC000035628779 172307815 /nfs/dbraw/zinc/30/78/15/172307815.db2.gz JIVMJJFNBNQFQW-OLZOCXBDSA-N 1 0 256.349 3.507 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2)c1 ZINC000035628889 172308346 /nfs/dbraw/zinc/30/83/46/172308346.db2.gz NGJLTZACUNVMTK-CQSZACIVSA-N 1 0 284.403 3.617 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCc2ccsc2)c(O)c1 ZINC000042599815 174815723 /nfs/dbraw/zinc/81/57/23/174815723.db2.gz WQQWGMZXHYLPCY-LBPRGKRZSA-N 1 0 261.390 3.655 20 10 CHCDRO Oc1cc2ccccc2cc1C[NH2+]C1CCCCC1 ZINC000045188904 175326318 /nfs/dbraw/zinc/32/63/18/175326318.db2.gz XCJOORJRIYSZMU-UHFFFAOYSA-N 1 0 255.361 3.968 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C[C@H](C)c2ccccc2)c1 ZINC000071406553 176155871 /nfs/dbraw/zinc/15/58/71/176155871.db2.gz DKZASJDPAVRMFL-AWEZNQCLSA-N 1 0 255.361 3.594 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@@H](C)c2ccc(F)cc2F)c1 ZINC000036952683 260056258 /nfs/dbraw/zinc/05/62/58/260056258.db2.gz AJKCRCUWRLIEGR-JTQLQIEISA-N 1 0 293.313 3.530 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@H](O)c2ccccc2)cc1 ZINC000153788474 261082686 /nfs/dbraw/zinc/08/26/86/261082686.db2.gz FBMGRYPMHICJNA-BEFAXECRSA-N 1 0 298.430 3.527 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CCc2c1cccc2O)c1ccccc1O ZINC000155696514 261106010 /nfs/dbraw/zinc/10/60/10/261106010.db2.gz SMQOYOFOKPKQDN-HZPDHXFCSA-N 1 0 283.371 3.826 20 10 CHCDRO CC[C@H]([NH2+]CCC[C@H]1CCCCO1)c1ccccc1O ZINC000158115202 261158611 /nfs/dbraw/zinc/15/86/11/261158611.db2.gz AWYNCXORBDEHBF-ZBFHGGJFSA-N 1 0 277.408 3.782 20 10 CHCDRO CC(C)OCCCC[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000180458494 261424520 /nfs/dbraw/zinc/42/45/20/261424520.db2.gz NEGQQFAPJLAVFZ-HNNXBMFYSA-N 1 0 278.440 3.608 20 10 CHCDRO C[C@H]([NH2+]CCC[C@H]1CCCCO1)c1cc(F)ccc1O ZINC000184000322 262004479 /nfs/dbraw/zinc/00/44/79/262004479.db2.gz XFCHLLYBMCCEKR-GXTWGEPZSA-N 1 0 281.371 3.531 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)ccc1O)c1ccccn1 ZINC000184845530 262030504 /nfs/dbraw/zinc/03/05/04/262030504.db2.gz JSOIYQYCKJDTOH-WDEREUQCSA-N 1 0 276.767 3.852 20 10 CHCDRO COc1cc(C[NH2+][C@@H](C)c2ccc(C)cc2O)ccc1C ZINC000185193498 262045069 /nfs/dbraw/zinc/04/50/69/262045069.db2.gz CBANVZDPLCLUNK-AWEZNQCLSA-N 1 0 285.387 3.868 20 10 CHCDRO Cc1noc(C)c1C[C@H](C)[NH2+][C@H](C)c1cc(C)ccc1O ZINC000185501250 262057259 /nfs/dbraw/zinc/05/72/59/262057259.db2.gz YVHMUEKIMIWALI-NWDGAFQWSA-N 1 0 288.391 3.587 20 10 CHCDRO CCC(CC)(CCO)C[NH2+][C@H](C)c1ccc(C)cc1O ZINC000185621149 262062933 /nfs/dbraw/zinc/06/29/33/262062933.db2.gz TXNKJUQOGVEQND-CQSZACIVSA-N 1 0 279.424 3.540 20 10 CHCDRO C[C@@H]([NH2+]C1CCSCC1)c1cc2c(cc1O)CCCC2 ZINC000185979060 262074191 /nfs/dbraw/zinc/07/41/91/262074191.db2.gz WRTPJBRJSGSNPR-GFCCVEGCSA-N 1 0 291.460 3.817 20 10 CHCDRO Cc1cnc([C@@H](C)C[NH2+][C@H](C)c2cc(C)ccc2O)s1 ZINC000186766194 262109252 /nfs/dbraw/zinc/10/92/52/262109252.db2.gz ZYIXKVVLSNVZNA-WCQYABFASA-N 1 0 290.432 3.920 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]CCCCCCSC)c1 ZINC000186533783 262316197 /nfs/dbraw/zinc/31/61/97/262316197.db2.gz JXMISSGWHFMGBV-ZDUSSCGKSA-N 1 0 297.464 3.975 20 10 CHCDRO Cc1ccc2c(c1)[C@H]([NH2+][C@H](C)c1cc(F)ccc1O)CO2 ZINC000373266537 267658377 /nfs/dbraw/zinc/65/83/77/267658377.db2.gz NENCDEBYYPDPKP-IAQYHMDHSA-N 1 0 287.334 3.624 20 10 CHCDRO CCOc1cccc(C[NH2+][C@H](C)c2ccc(C)cc2)c1O ZINC000037770017 326861147 /nfs/dbraw/zinc/86/11/47/326861147.db2.gz FWZIWEHXEKJRGI-CQSZACIVSA-N 1 0 285.387 3.950 20 10 CHCDRO C[C@@H]([NH2+]CC1CC=CC1)c1cc(Cl)ccc1O ZINC000527952413 330294526 /nfs/dbraw/zinc/29/45/26/330294526.db2.gz VFFXCTSDNZWGLB-SNVBAGLBSA-N 1 0 251.757 3.662 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+]Cc2cccnc2C)c1O ZINC000527984700 330298553 /nfs/dbraw/zinc/29/85/53/330298553.db2.gz DCVAXLYDQRGQSM-LBPRGKRZSA-N 1 0 290.794 3.908 20 10 CHCDRO CCOc1cccc(C[NH2+]CCCCCCSC)c1O ZINC000230149409 333314902 /nfs/dbraw/zinc/31/49/02/333314902.db2.gz IMZURHOUDIGJPZ-UHFFFAOYSA-N 1 0 297.464 3.804 20 10 CHCDRO C[C@H]([NH2+]CCOCC1CC1)c1ccc2ccccc2c1O ZINC000230661316 333320058 /nfs/dbraw/zinc/32/00/58/333320058.db2.gz OACFTQNBFVYEPV-ZDUSSCGKSA-N 1 0 285.387 3.623 20 10 CHCDRO C[C@@H]([NH2+]CCC[C@H](C)CO)c1ccc2ccccc2c1O ZINC000230669765 333320402 /nfs/dbraw/zinc/32/04/02/333320402.db2.gz PIUWDLMAGWQSDW-UONOGXRCSA-N 1 0 287.403 3.605 20 10 CHCDRO Cc1cc(O)c(C[NH+]2CC(Cc3ccco3)C2)c(Cl)c1 ZINC000529649294 333503765 /nfs/dbraw/zinc/50/37/65/333503765.db2.gz QLBHMOFJXNWMBB-UHFFFAOYSA-N 1 0 291.778 3.622 20 10 CHCDRO C[C@@H]([NH2+]CCSC(C)(C)C)c1ccccc1O ZINC000272887909 334757620 /nfs/dbraw/zinc/75/76/20/334757620.db2.gz RYZPVBRQCHVJFK-LLVKDONJSA-N 1 0 253.411 3.575 20 10 CHCDRO CCCOc1ccc(C[NH2+]CCCC(C)(F)F)c(O)c1 ZINC000296079729 520367443 /nfs/dbraw/zinc/36/74/43/520367443.db2.gz QLMFHDLXKYDFLX-UHFFFAOYSA-N 1 0 287.350 3.706 20 10 CHCDRO CCOc1cccc(C[NH2+][C@H](C)Cc2cccs2)c1O ZINC000036992957 521374299 /nfs/dbraw/zinc/37/42/99/521374299.db2.gz LJLJLNGFWDISSI-GFCCVEGCSA-N 1 0 291.416 3.573 20 10 CHCDRO CCOC1CC(CC[NH2+][C@H](C)c2ccc(C)c(C)c2O)C1 ZINC000276707486 521646504 /nfs/dbraw/zinc/64/65/04/521646504.db2.gz WKLBJIKQHPGWBJ-QQFBHYJXSA-N 1 0 291.435 3.865 20 10 CHCDRO CCC[N@H+](Cc1csc(CC)n1)Cc1ccccc1O ZINC000068973678 521692919 /nfs/dbraw/zinc/69/29/19/521692919.db2.gz NGJORUASIJORBU-UHFFFAOYSA-N 1 0 290.432 3.823 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C2(c3ccccc3F)CC2)cc1 ZINC000076766872 522206169 /nfs/dbraw/zinc/20/61/69/522206169.db2.gz UMLYUSWGPLMOHU-UHFFFAOYSA-N 1 0 284.378 3.671 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H](c2cccnc2)C2CCC2)cc1 ZINC000280427401 522212312 /nfs/dbraw/zinc/21/23/12/522212312.db2.gz ZXYVWTLUHURSKF-LJQANCHMSA-N 1 0 295.430 3.779 20 10 CHCDRO CC[C@H]([NH2+]Cc1c(C)noc1C)c1ccc(C)cc1O ZINC000280295816 522637793 /nfs/dbraw/zinc/63/77/93/522637793.db2.gz ZNEREOJHHFLTSE-HNNXBMFYSA-N 1 0 274.364 3.546 20 10 CHCDRO CC[C@H]([NH2+]C[C@]1(C)CCO[C@@H]1C1CC1)c1ccccc1O ZINC000365077515 522639317 /nfs/dbraw/zinc/63/93/17/522639317.db2.gz KRIMDFAGQXSYCM-JQHSSLGASA-N 1 0 289.419 3.638 20 10 CHCDRO CC[C@@H]([NH2+]CCCOCC1CC1)c1ccc(C)cc1O ZINC000280130212 522827947 /nfs/dbraw/zinc/82/79/47/522827947.db2.gz OWGWGUFRXKUOQC-MRXNPFEDSA-N 1 0 277.408 3.558 20 10 CHCDRO CC[C@@H]([NH2+]CC[C@@H]1CCCCO1)c1ccc(C)cc1O ZINC000280270778 522840681 /nfs/dbraw/zinc/84/06/81/522840681.db2.gz XUXJESBEFNCECX-GOEBONIOSA-N 1 0 277.408 3.701 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](O)c1ccsc1)c1ccc(C)cc1O ZINC000279970147 522851709 /nfs/dbraw/zinc/85/17/09/522851709.db2.gz CYPHWHCLYKRUAZ-GDBMZVCRSA-N 1 0 291.416 3.536 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(F)c(F)c1)c1ccccc1O ZINC000049577263 522874972 /nfs/dbraw/zinc/87/49/72/522874972.db2.gz DRISSRUFIMCVFL-OAHLLOKOSA-N 1 0 277.314 3.911 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1cccnc1)c1ccc(C)cc1O ZINC000280099211 522939009 /nfs/dbraw/zinc/93/90/09/522939009.db2.gz MYRYKLNYKRNJKF-CZUORRHYSA-N 1 0 270.376 3.898 20 10 CHCDRO CCc1ccc(C[NH2+]Cc2ccc3c(c2)CCO3)s1 ZINC000077328408 523943371 /nfs/dbraw/zinc/94/33/71/523943371.db2.gz AMQPIOBLYSLHID-UHFFFAOYSA-N 1 0 273.401 3.535 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)c2cc(C)ccc2O)s1 ZINC000050225241 524602607 /nfs/dbraw/zinc/60/26/07/524602607.db2.gz NQJDDIMULQYRJA-GFCCVEGCSA-N 1 0 261.390 3.921 20 10 CHCDRO COc1ccccc1[C@@H](C)[NH2+]Cc1cc(C)ccc1O ZINC000071406336 524721857 /nfs/dbraw/zinc/72/18/57/524721857.db2.gz VYBPOEBXLTVIML-CYBMUJFWSA-N 1 0 271.360 3.560 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)CCc2ccco2)c1 ZINC000020144905 524765963 /nfs/dbraw/zinc/76/59/63/524765963.db2.gz PCHZJVJHVAHTCG-QWHCGFSZSA-N 1 0 289.375 3.666 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2sccc2C)c1 ZINC000094874953 524771271 /nfs/dbraw/zinc/77/12/71/524771271.db2.gz XQNBTALVGXCQCL-NSHDSACASA-N 1 0 277.389 3.622 20 10 CHCDRO Cc1cc(O)c(C[N@H+](Cc2ccccn2)C2CC2)cc1C ZINC000290516714 525316572 /nfs/dbraw/zinc/31/65/72/525316572.db2.gz PVPPLBOSNQELHB-UHFFFAOYSA-N 1 0 282.387 3.569 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1cccs1 ZINC000050286239 525450135 /nfs/dbraw/zinc/45/01/35/525450135.db2.gz WRSIONHEWJFIME-ZDUSSCGKSA-N 1 0 286.444 3.981 20 10 CHCDRO C[C@H]([NH2+]Cc1cccs1)c1ccc(N(C)C)cc1 ZINC000037231949 525469249 /nfs/dbraw/zinc/46/92/49/525469249.db2.gz ZGIMTIKLMLXULO-LBPRGKRZSA-N 1 0 260.406 3.665 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccsc1 ZINC000050339197 525525957 /nfs/dbraw/zinc/52/59/57/525525957.db2.gz BFVXUVJZRJMCST-GFCCVEGCSA-N 1 0 260.406 3.665 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1)c1cc(F)ccc1O ZINC000094616547 525614407 /nfs/dbraw/zinc/61/44/07/525614407.db2.gz CYAKLAOOEDQXMZ-NWDGAFQWSA-N 1 0 259.324 3.943 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H](O)c2ccccc2)c(O)c1C ZINC000290176777 525934216 /nfs/dbraw/zinc/93/42/16/525934216.db2.gz FCTKBWJZTWBLCW-YZVOILCLSA-N 1 0 299.414 3.782 20 10 CHCDRO Cc1c[nH]nc1C[N@H+](Cc1ccccc1O)C1CCCCC1 ZINC000290320252 526020904 /nfs/dbraw/zinc/02/09/04/526020904.db2.gz BMXDJGDYQGFRNL-UHFFFAOYSA-N 1 0 299.418 3.759 20 10 CHCDRO COc1cccc(C[NH2+][C@@H](C)c2ccc(C)cc2O)c1 ZINC000037680270 526031209 /nfs/dbraw/zinc/03/12/09/526031209.db2.gz JTFXOWFCSVMHRE-ZDUSSCGKSA-N 1 0 271.360 3.560 20 10 CHCDRO COc1cccc(C[NH2+][C@H]2CCCc3sccc32)c1O ZINC000061359828 526039733 /nfs/dbraw/zinc/03/97/33/526039733.db2.gz XKCITGOZJVHSKN-ZDUSSCGKSA-N 1 0 289.400 3.630 20 10 CHCDRO C[C@@H](c1ccco1)[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC000131021438 526134380 /nfs/dbraw/zinc/13/43/80/526134380.db2.gz HMKBFDVYAXKGPK-ZDUSSCGKSA-N 1 0 258.365 3.539 20 10 CHCDRO Oc1ccccc1C[NH2+][C@@H]1CCCc2sccc21 ZINC000061331039 526374459 /nfs/dbraw/zinc/37/44/59/526374459.db2.gz SQOMMJLJGYFHAD-CYBMUJFWSA-N 1 0 259.374 3.621 20 10 CHCDRO Cc1noc(C)c1[C@@H](C)C[NH2+]Cc1c(O)cccc1Cl ZINC000128450870 526565683 /nfs/dbraw/zinc/56/56/83/526565683.db2.gz RZYHQWCRCOMJFL-VIFPVBQESA-N 1 0 294.782 3.544 20 10 CHCDRO C[C@@H]1CC[C@H]([NH2+]Cc2ccc(N(C)C)cc2)C[C@H]1C ZINC000251611021 1125472440 /nfs/dbraw/zinc/47/24/40/1125472440.db2.gz CZWPGJGUZXFQSP-FMKPAKJESA-N 1 0 260.425 3.667 20 10 CHCDRO CCSCC[C@@H](C)[N@H+](C)Cc1c(C)cc(OC)cc1O ZINC001179962692 1121936918 /nfs/dbraw/zinc/93/69/18/1121936918.db2.gz QSOGNUCPDSYRON-CYBMUJFWSA-N 1 0 297.464 3.673 20 10 CHCDRO Oc1cc(Cl)ccc1C[N@@H+]1CC[C@@H]2CCCC[C@@H]21 ZINC001182574260 1122175867 /nfs/dbraw/zinc/17/58/67/1122175867.db2.gz LYXHEKBGNUTVCN-FZMZJTMJSA-N 1 0 265.784 3.810 20 10 CHCDRO CC[C@H]1CC[N@H+](Cc2cc(Cl)cc(C)c2O)C1 ZINC000775736971 1122928769 /nfs/dbraw/zinc/92/87/69/1122928769.db2.gz ILUUJUATUVMVHB-NSHDSACASA-N 1 0 253.773 3.586 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)C(C)(C)C(F)F ZINC000850435135 1123266167 /nfs/dbraw/zinc/26/61/67/1123266167.db2.gz IOESXIYVNFMXBH-GFCCVEGCSA-N 1 0 284.394 3.830 20 10 CHCDRO C[C@@H]([NH2+]CC[C@@H]1CC1(F)F)c1cc(Cl)ccc1O ZINC000857081693 1123586045 /nfs/dbraw/zinc/58/60/45/1123586045.db2.gz QDOWEUBOKXSDPA-RKDXNWHRSA-N 1 0 275.726 3.742 20 10 CHCDRO COc1ccc(C[NH2+]C[C@H]2CCC(F)(F)C2)cc1C ZINC000281777940 1123744205 /nfs/dbraw/zinc/74/42/05/1123744205.db2.gz UDOYOAFQOHQRAG-ZDUSSCGKSA-N 1 0 269.335 3.529 20 10 CHCDRO COCC(C)(C)CC[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000872105002 1124683635 /nfs/dbraw/zinc/68/36/35/1124683635.db2.gz XONAVMZLEMQINY-LLVKDONJSA-N 1 0 285.815 3.759 20 10 CHCDRO Oc1cc(Cl)ccc1C[N@@H+]1CCC[C@H]2CCC[C@H]21 ZINC001140465427 1131751490 /nfs/dbraw/zinc/75/14/90/1131751490.db2.gz NAGBPWHMYKRBBB-BXUZGUMPSA-N 1 0 265.784 3.810 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)CC(C)(C)C)c(O)c1 ZINC001140854932 1131947923 /nfs/dbraw/zinc/94/79/23/1131947923.db2.gz GZNOWCRITPHCDZ-UHFFFAOYSA-N 1 0 278.440 3.716 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]C[C@@H](C)CC(F)(F)F ZINC000840963579 1132313098 /nfs/dbraw/zinc/31/30/98/1132313098.db2.gz MLAGTDQYEZRZAF-NSHDSACASA-N 1 0 288.357 3.739 20 10 CHCDRO C[C@H]1CCCC[N@@H+]1Cc1ccc(C(F)(F)F)cc1O ZINC001233451278 1132625024 /nfs/dbraw/zinc/62/50/24/1132625024.db2.gz DXUHNSWBYDVYPG-JTQLQIEISA-N 1 0 273.298 3.785 20 10 CHCDRO CC[C@@H]1CC[N@H+](Cc2ccc(C(F)(F)F)cc2O)C1 ZINC001233455195 1132625046 /nfs/dbraw/zinc/62/50/46/1132625046.db2.gz AIUFQSYHEHDKON-SNVBAGLBSA-N 1 0 273.298 3.643 20 10 CHCDRO CC1(C)CC[NH+](Cc2c(O)cccc2Cl)CC1 ZINC000133934472 1125509833 /nfs/dbraw/zinc/50/98/33/1125509833.db2.gz WIWJMOCUAHZTRO-UHFFFAOYSA-N 1 0 253.773 3.668 20 10 CHCDRO C[C@@H]([NH2+]C[C@@]1(C)CCCS1)c1ccc(N(C)C)cc1 ZINC000133949253 1125512117 /nfs/dbraw/zinc/51/21/17/1125512117.db2.gz RPQZUHPGOVIEOR-CZUORRHYSA-N 1 0 278.465 3.689 20 10 CHCDRO COc1c(Cl)cccc1C[NH2+]Cc1cccc(C)c1O ZINC000897481913 1125527768 /nfs/dbraw/zinc/52/77/68/1125527768.db2.gz JWKXJQOXPJMTHC-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO CC[C@H]([NH2+]Cc1cccc(N(C)C)c1)c1ccccc1O ZINC000121083199 1125556640 /nfs/dbraw/zinc/55/66/40/1125556640.db2.gz XMYPACUPEHOIKW-KRWDZBQOSA-N 1 0 284.403 3.699 20 10 CHCDRO CC[C@@H](C)[NH2+][C@H](C)c1ccc(Br)cc1O ZINC000134907005 1125569035 /nfs/dbraw/zinc/56/90/35/1125569035.db2.gz LNKNZSJWWUEJPU-RKDXNWHRSA-N 1 0 272.186 3.604 20 10 CHCDRO CCCC[NH2+][C@@H](C)c1ccc(Br)cc1O ZINC000134902820 1125570150 /nfs/dbraw/zinc/57/01/50/1125570150.db2.gz ZBOMJKMKDKEUDH-VIFPVBQESA-N 1 0 272.186 3.605 20 10 CHCDRO C[C@H]([NH2+]CCN(C)C1CCCC1)c1ccc(Cl)cc1O ZINC000841747768 1125579659 /nfs/dbraw/zinc/57/96/59/1125579659.db2.gz SKIPVKNTXWLHCD-LBPRGKRZSA-N 1 0 296.842 3.571 20 10 CHCDRO CCOC(C)(C)C[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841752229 1125583478 /nfs/dbraw/zinc/58/34/78/1125583478.db2.gz NJLRGPOFPCPBRI-SNVBAGLBSA-N 1 0 271.788 3.511 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@H+](C[C@@H]1CCOC1)C1CC1 ZINC000054495163 1125600392 /nfs/dbraw/zinc/60/03/92/1125600392.db2.gz LNGMLOMANYTXHO-AWEZNQCLSA-N 1 0 297.398 3.546 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CC[C@H]2OCCC[C@H]2C1 ZINC000246942430 1125652016 /nfs/dbraw/zinc/65/20/16/1125652016.db2.gz LORYEGKHNWUYEZ-HNAYVOBHSA-N 1 0 297.398 3.546 20 10 CHCDRO CS[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(N(C)C)cc1 ZINC000219179027 1125671110 /nfs/dbraw/zinc/67/11/10/1125671110.db2.gz ARWDFLPWNJMVRP-HZPDHXFCSA-N 1 0 278.465 3.516 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2cc(C3CC3)no2)c(O)c1C ZINC000886684506 1125706632 /nfs/dbraw/zinc/70/66/32/1125706632.db2.gz MTKKMSLGDYIPHF-GFCCVEGCSA-N 1 0 286.375 3.725 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2cc(C3CC3)no2)cc1 ZINC000886684529 1125707132 /nfs/dbraw/zinc/70/71/32/1125707132.db2.gz NEKNNPAQAIIFGS-ZDUSSCGKSA-N 1 0 299.418 3.859 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H](C)[C@H](C)c2ccccc2)c1 ZINC000237452290 1125718002 /nfs/dbraw/zinc/71/80/02/1125718002.db2.gz KKLSEZLUNWZYJD-LSDHHAIUSA-N 1 0 269.388 3.982 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H](C)[C@@H](C)c2ccccc2)c1 ZINC000237452257 1125718020 /nfs/dbraw/zinc/71/80/20/1125718020.db2.gz KKLSEZLUNWZYJD-HUUCEWRRSA-N 1 0 269.388 3.982 20 10 CHCDRO CCOc1cccc(C[NH2+]Cc2ccc(OC)c(C)c2)c1 ZINC000037505722 1125720905 /nfs/dbraw/zinc/72/09/05/1125720905.db2.gz GTFWVGHVMZNZTD-UHFFFAOYSA-N 1 0 285.387 3.692 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCCSC1)c1ccc(N(C)C)cc1 ZINC000286859851 1125754019 /nfs/dbraw/zinc/75/40/19/1125754019.db2.gz BAWZXIUNXGOYKK-KBPBESRZSA-N 1 0 278.465 3.546 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCCSC1)c1ccc(N(C)C)cc1 ZINC000286859855 1125754165 /nfs/dbraw/zinc/75/41/65/1125754165.db2.gz BAWZXIUNXGOYKK-KGLIPLIRSA-N 1 0 278.465 3.546 20 10 CHCDRO COc1ccccc1[C@@H]1CC[N@H+](Cc2cc(C)ccc2O)C1 ZINC000093593588 1125769981 /nfs/dbraw/zinc/76/99/81/1125769981.db2.gz FCPSDBRQDRZNHQ-OAHLLOKOSA-N 1 0 297.398 3.699 20 10 CHCDRO CC(C)C1(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)CC1 ZINC000222223382 1125776922 /nfs/dbraw/zinc/77/69/22/1125776922.db2.gz RANQXSDSFISJEY-CQSZACIVSA-N 1 0 260.425 3.839 20 10 CHCDRO COc1cc(C[N@H+](CCC(C)C)C2CC2)c(O)cc1C ZINC000768441840 1129855709 /nfs/dbraw/zinc/85/57/09/1129855709.db2.gz OTDZETXEWKKESP-UHFFFAOYSA-N 1 0 277.408 3.720 20 10 CHCDRO CCOc1ccc(C[N@H+](CC)CCC(F)(F)F)c(O)c1 ZINC000769224871 1129895737 /nfs/dbraw/zinc/89/57/37/1129895737.db2.gz DIUYKLUUZPPORZ-UHFFFAOYSA-N 1 0 291.313 3.565 20 10 CHCDRO CCOc1cccc(C[NH2+][C@H](C)C[C@@H](C)CC)c1O ZINC000088293752 1129202631 /nfs/dbraw/zinc/20/26/31/1129202631.db2.gz KSWVVJXKNGNPHJ-QWHCGFSZSA-N 1 0 265.397 3.705 20 10 CHCDRO Cc1cscc1C[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000785522760 1130038710 /nfs/dbraw/zinc/03/87/10/1130038710.db2.gz VGROAYWNGYUYSF-UHFFFAOYSA-N 1 0 278.396 3.551 20 10 CHCDRO CCC(O)(CC)CC[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000788263565 1130178808 /nfs/dbraw/zinc/17/88/08/1130178808.db2.gz SOAMDSOEYCAJPE-LLVKDONJSA-N 1 0 285.815 3.637 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cccc(OC)c1 ZINC000302741657 1126740928 /nfs/dbraw/zinc/74/09/28/1126740928.db2.gz QDKIIZOFFUGJLM-UHFFFAOYSA-N 1 0 298.430 3.783 20 10 CHCDRO Cc1cccc(C[NH2+]Cc2cccc3cccnc32)c1O ZINC000159733464 1126752352 /nfs/dbraw/zinc/75/23/52/1126752352.db2.gz HTVXQMFPJMPRAY-UHFFFAOYSA-N 1 0 278.355 3.539 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)cc1)[C@H]1CC[C@@H](C)C1 ZINC001170159377 1130396127 /nfs/dbraw/zinc/39/61/27/1130396127.db2.gz TXYYZFUVCUXCCI-PBHICJAKSA-N 1 0 260.425 3.763 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CCC[C@@H]2c2cccs2)c1 ZINC000179591835 1126830986 /nfs/dbraw/zinc/83/09/86/1126830986.db2.gz NVOMIVUUHWAQIV-CQSZACIVSA-N 1 0 289.400 3.799 20 10 CHCDRO CCc1nc(C)c([C@H](C)[N@H+](C)Cc2ccccc2O)s1 ZINC000179579035 1126831185 /nfs/dbraw/zinc/83/11/85/1126831185.db2.gz ZPWFWTKPFRQMPP-LBPRGKRZSA-N 1 0 290.432 3.913 20 10 CHCDRO CC[C@](C)([NH2+]Cc1cc(F)ccc1O)c1nc(C)cs1 ZINC000180753425 1126848730 /nfs/dbraw/zinc/84/87/30/1126848730.db2.gz OZRLURSJEFRPEE-HNNXBMFYSA-N 1 0 294.395 3.711 20 10 CHCDRO COc1ccccc1C(C)(C)[NH2+]Cc1cccc(C)c1O ZINC000182153096 1126867617 /nfs/dbraw/zinc/86/76/17/1126867617.db2.gz HLEALJHXXXKDMZ-UHFFFAOYSA-N 1 0 285.387 3.734 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCN(c2ccccc2)C1)c1ccccc1O ZINC000183412592 1126887153 /nfs/dbraw/zinc/88/71/53/1126887153.db2.gz ICCBWRFPHKBHIB-JKSUJKDBSA-N 1 0 296.414 3.569 20 10 CHCDRO CC(C)[C@@H](C[NH2+][C@@H](C)c1ccccc1O)c1cccnc1 ZINC000183546831 1126888860 /nfs/dbraw/zinc/88/88/60/1126888860.db2.gz ZUTBNDCSOPEEOV-WMLDXEAASA-N 1 0 284.403 3.878 20 10 CHCDRO CC(C)c1csc(C[NH2+][C@H](C)c2cc(F)ccc2O)n1 ZINC000185808695 1126902792 /nfs/dbraw/zinc/90/27/92/1126902792.db2.gz CXNCHRJFYULUJQ-SNVBAGLBSA-N 1 0 294.395 3.962 20 10 CHCDRO COC[C@H]([NH2+]Cc1ccccc1O)c1ccc(Cl)cc1 ZINC000193279462 1126967948 /nfs/dbraw/zinc/96/79/48/1126967948.db2.gz FSKOKEDXQIWCBP-HNNXBMFYSA-N 1 0 291.778 3.523 20 10 CHCDRO CCO[C@@H](C[NH2+][C@@H](C)c1ccccc1O)c1ccccc1 ZINC000193434371 1126969180 /nfs/dbraw/zinc/96/91/80/1126969180.db2.gz NEJCPWXKBJRSHE-KSSFIOAISA-N 1 0 285.387 3.821 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H](C)c1ccccn1 ZINC000194980722 1126977520 /nfs/dbraw/zinc/97/75/20/1126977520.db2.gz UQLDQBXZSKRXMZ-AWEZNQCLSA-N 1 0 269.392 3.518 20 10 CHCDRO C[C@H](CCc1ccco1)[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000237531821 1127017919 /nfs/dbraw/zinc/01/79/19/1127017919.db2.gz KDJKAPXVLGRFNZ-OAHLLOKOSA-N 1 0 298.430 3.773 20 10 CHCDRO Oc1ccc(C(F)(F)F)cc1C[NH+]1CCC(F)(F)CC1 ZINC001237135691 1131053946 /nfs/dbraw/zinc/05/39/46/1131053946.db2.gz KZXRJTNXRNOQDZ-UHFFFAOYSA-N 1 0 295.251 3.642 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](C)CCSC)cc1 ZINC000151071145 1127121118 /nfs/dbraw/zinc/12/11/18/1127121118.db2.gz HPYDOBDUKPMWQQ-KBPBESRZSA-N 1 0 280.481 3.935 20 10 CHCDRO C[C@H]1CCCC[N@@H+]1Cc1cc(C(F)(F)F)ccc1O ZINC001237137094 1131056063 /nfs/dbraw/zinc/05/60/63/1131056063.db2.gz LPSYGZNMORMICB-JTQLQIEISA-N 1 0 273.298 3.785 20 10 CHCDRO C[C@H]1C[C@H](C)C[NH+](Cc2c(O)ccc(F)c2Cl)C1 ZINC001237125460 1131056955 /nfs/dbraw/zinc/05/69/55/1131056955.db2.gz CAIZAZIZLJAFNK-UWVGGRQHSA-N 1 0 271.763 3.663 20 10 CHCDRO CC[C@@H](CC(F)(F)F)[NH2+]Cc1cc(C)c(C)cc1O ZINC000760651161 1127144379 /nfs/dbraw/zinc/14/43/79/1127144379.db2.gz BJPLSHQPVFCXAN-LBPRGKRZSA-N 1 0 275.314 3.830 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@@H+](C)C(C2CC2)C2CC2)c1 ZINC000164244550 1127158139 /nfs/dbraw/zinc/15/81/39/1127158139.db2.gz HAAFUABYGRHTGN-UHFFFAOYSA-N 1 0 259.393 3.629 20 10 CHCDRO Cc1nc(CC[NH2+][C@@H](C)c2c(C)cc(C)cc2O)cs1 ZINC000284248963 1127179038 /nfs/dbraw/zinc/17/90/38/1127179038.db2.gz VMZKSTSOUIPFIN-LBPRGKRZSA-N 1 0 290.432 3.667 20 10 CHCDRO Cc1cccc(C[NH2+]C23CC4CC(CC(C4)C2)C3)c1O ZINC000164923468 1127200133 /nfs/dbraw/zinc/20/01/33/1127200133.db2.gz OHCFQXQPXYRDGX-UHFFFAOYSA-N 1 0 271.404 3.759 20 10 CHCDRO [O-]c1cc(Cl)c(F)cc1C[N@@H+]1CCC[C@@H](F)CC1 ZINC001237933622 1131153360 /nfs/dbraw/zinc/15/33/60/1131153360.db2.gz FBRNRZNDLXCMCP-SNVBAGLBSA-N 1 0 275.726 3.509 20 10 CHCDRO CSC1(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)CC1 ZINC000285441231 1127228481 /nfs/dbraw/zinc/22/84/81/1127228481.db2.gz ZBGOKBVXQSXPRU-LBPRGKRZSA-N 1 0 265.422 3.555 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)[C@@H](C)OC)c1cccc(Cl)c1[O-] ZINC000287540934 1127309530 /nfs/dbraw/zinc/30/95/30/1127309530.db2.gz FBLVRJXZFDASCV-CWSCBRNRSA-N 1 0 271.788 3.510 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(C)no1)c1cccc(Cl)c1[O-] ZINC000287544535 1127309782 /nfs/dbraw/zinc/30/97/82/1127309782.db2.gz FHNGOHDMMQNJEH-ZDUSSCGKSA-N 1 0 280.755 3.583 20 10 CHCDRO CCCOc1ccc(C[NH2+][C@@H]2CS[C@H](C)C2)cc1C ZINC001308437239 1127384256 /nfs/dbraw/zinc/38/42/56/1127384256.db2.gz NFCPPGVSEOHOAF-HIFRSBDPSA-N 1 0 279.449 3.767 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]Cc1cccc(C(F)(F)F)c1 ZINC000226582559 1127411864 /nfs/dbraw/zinc/41/18/64/1127411864.db2.gz KAQIFLVCPQVUON-UHFFFAOYSA-N 1 0 299.267 3.840 20 10 CHCDRO CC1(C)CCC[C@@H]1[NH2+]Cc1cc(Br)ccc1O ZINC000226785678 1127425558 /nfs/dbraw/zinc/42/55/58/1127425558.db2.gz WBZQGGSLVGWZIH-ZDUSSCGKSA-N 1 0 298.224 3.823 20 10 CHCDRO COc1ccc([C@@H](C)[NH2+]Cc2cccc(C)c2O)cc1 ZINC000158124062 1127451652 /nfs/dbraw/zinc/45/16/52/1127451652.db2.gz XMKUOFZUXHDCJR-CYBMUJFWSA-N 1 0 271.360 3.560 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1C[C@@H]1C)c1ccc2ccccc2c1O ZINC000168741007 1127464351 /nfs/dbraw/zinc/46/43/51/1127464351.db2.gz BYVWXUMUCATGPU-OBJOEFQTSA-N 1 0 255.361 3.852 20 10 CHCDRO CCOc1cccc(C[NH2+][C@H]2CCC[C@@H](C)CC2)c1O ZINC000227309958 1127469713 /nfs/dbraw/zinc/46/97/13/1127469713.db2.gz ACIXCEVGTAHKCH-HIFRSBDPSA-N 1 0 277.408 3.849 20 10 CHCDRO CC(C)[C@@H](C[NH2+]Cc1ccccc1O)c1ccccc1 ZINC000227436412 1127478151 /nfs/dbraw/zinc/47/81/51/1127478151.db2.gz AMKFEQDIUYSPOT-QGZVFWFLSA-N 1 0 269.388 3.922 20 10 CHCDRO Cc1nocc1C[NH2+]Cc1ccc(N2CCC(C)CC2)cc1 ZINC000293584725 1127506896 /nfs/dbraw/zinc/50/68/96/1127506896.db2.gz NWYQCLVHYSPGAT-UHFFFAOYSA-N 1 0 299.418 3.509 20 10 CHCDRO Cc1sccc1C[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000293578496 1127506923 /nfs/dbraw/zinc/50/69/23/1127506923.db2.gz NMZTURHOOUHBOP-UHFFFAOYSA-N 1 0 278.396 3.551 20 10 CHCDRO C[C@@H]([NH2+]C1CCC2(CCOCC2)CC1)c1ccccc1O ZINC000360713121 1127507601 /nfs/dbraw/zinc/50/76/01/1127507601.db2.gz NOEMKSMJRSDDEM-CQSZACIVSA-N 1 0 289.419 3.782 20 10 CHCDRO CCc1nocc1C[N@H+](C)Cc1c(O)ccc2ccccc21 ZINC000293664298 1127511164 /nfs/dbraw/zinc/51/11/64/1127511164.db2.gz OBRRCLTXJRUISK-UHFFFAOYSA-N 1 0 296.370 3.728 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CC2CCSCC2)c(O)c1 ZINC000293792326 1127520567 /nfs/dbraw/zinc/52/05/67/1127520567.db2.gz QQZBDIORQUSMLL-CYBMUJFWSA-N 1 0 279.449 3.803 20 10 CHCDRO CC[C@@H]([NH2+]Cc1occc1C)c1ccc(N(C)C)cc1 ZINC000293877131 1127528827 /nfs/dbraw/zinc/52/88/27/1127528827.db2.gz YMOQKUURUXQWLE-MRXNPFEDSA-N 1 0 272.392 3.895 20 10 CHCDRO CC[C@H]([NH2+]CCc1cc(F)cc(F)c1)c1ccccc1O ZINC000060717523 1127565427 /nfs/dbraw/zinc/56/54/27/1127565427.db2.gz XBPUVTAEWATJOQ-INIZCTEOSA-N 1 0 291.341 3.954 20 10 CHCDRO CC[N@H+](Cc1cc(Cl)cc(OC)c1O)C1CCCC1 ZINC000228607184 1127572004 /nfs/dbraw/zinc/57/20/04/1127572004.db2.gz CXDJQZYLDLRPHA-UHFFFAOYSA-N 1 0 283.799 3.819 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CCC[C@H]2C(C)C)c1O ZINC000228606815 1127572073 /nfs/dbraw/zinc/57/20/73/1127572073.db2.gz XVRBCTIZXDRJQT-ZDUSSCGKSA-N 1 0 283.799 3.675 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+][C@H]2CCOC(C)(C)C2)c(O)c1 ZINC000294856442 1127604407 /nfs/dbraw/zinc/60/44/07/1127604407.db2.gz SSWYYKSCSQFKSJ-KGLIPLIRSA-N 1 0 277.408 3.617 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1cnn(CC)c1)c1ccc(C)cc1O ZINC000296118399 1127662772 /nfs/dbraw/zinc/66/27/72/1127662772.db2.gz ZWUGFMTUZQZIAV-CJNGLKHVSA-N 1 0 287.407 3.719 20 10 CHCDRO CC(C)C[C@@H]1C[C@H]([NH2+][C@@H]2CCc3cccc(O)c32)CCO1 ZINC000296800239 1127683214 /nfs/dbraw/zinc/68/32/14/1127683214.db2.gz LMSXLKQUJIULNX-BZUAXINKSA-N 1 0 289.419 3.563 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1ccccc1[N+](=O)[O-] ZINC000296920004 1127685647 /nfs/dbraw/zinc/68/56/47/1127685647.db2.gz PPSSNAVVXYVWCS-BXUZGUMPSA-N 1 0 298.342 3.639 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CC(C)(C)c2ccccn2)c1 ZINC000297346140 1127693885 /nfs/dbraw/zinc/69/38/85/1127693885.db2.gz OUPQZRRYKNHLHO-AWEZNQCLSA-N 1 0 284.403 3.724 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]C[C@H]1CCOc3ccccc31)CC2 ZINC000297551423 1127699393 /nfs/dbraw/zinc/69/93/93/1127699393.db2.gz FRGQRECSVJITRT-ZBFHGGJFSA-N 1 0 295.382 3.535 20 10 CHCDRO Cc1ccc2c(c1)CC[C@H]2[NH2+][C@H]1CCc2cccc(O)c21 ZINC000297606073 1127701491 /nfs/dbraw/zinc/70/14/91/1127701491.db2.gz IFVFAMAJBSURON-SJORKVTESA-N 1 0 279.383 3.965 20 10 CHCDRO CCCC(C)(C)[NH2+]Cc1ccc(OC)c(COCC)c1 ZINC000171785898 1127728845 /nfs/dbraw/zinc/72/88/45/1127728845.db2.gz BQYPAJZXQBZJLI-UHFFFAOYSA-N 1 0 279.424 3.900 20 10 CHCDRO CC[NH+](CC)CCC[N@H+](CC)Cc1cccc(Cl)c1[O-] ZINC000230745031 1127773766 /nfs/dbraw/zinc/77/37/66/1127773766.db2.gz SQXAXSBAMFYMDZ-UHFFFAOYSA-N 1 0 298.858 3.599 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2OCCc3ccccc32)c(O)c1 ZINC000371869991 1127782714 /nfs/dbraw/zinc/78/27/14/1127782714.db2.gz MCBKKAJLNJRQMK-LIRRHRJNSA-N 1 0 297.398 3.665 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@]2(C)CCO[C@@H]2C2CC2)c(O)c1 ZINC000372096559 1127788114 /nfs/dbraw/zinc/78/81/14/1127788114.db2.gz TVVFVUIGFJCCSA-VHSSKADRSA-N 1 0 289.419 3.556 20 10 CHCDRO CC(C)=CC[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000232621039 1127898238 /nfs/dbraw/zinc/89/82/38/1127898238.db2.gz MOSJNARMBSDWEF-UHFFFAOYSA-N 1 0 258.409 3.733 20 10 CHCDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CCC3(CC3)C2)c1 ZINC001233284385 1127942903 /nfs/dbraw/zinc/94/29/03/1127942903.db2.gz SJNMISMNBJMOQN-UHFFFAOYSA-N 1 0 259.393 3.676 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H](C2CC2)C2CCC2)c(O)c1 ZINC000325009453 1128009148 /nfs/dbraw/zinc/00/91/48/1128009148.db2.gz CEFXDSTWFCIBTE-PXAZEXFGSA-N 1 0 259.393 3.930 20 10 CHCDRO C[N@H+](Cc1ccccc1O)[C@@H]1CCc2cc(F)ccc2C1 ZINC001168440948 1128067385 /nfs/dbraw/zinc/06/73/85/1128067385.db2.gz NQGVBKDWBKSSSY-QGZVFWFLSA-N 1 0 285.362 3.521 20 10 CHCDRO CCSCC[NH2+]Cc1ccc(N2CCC(C)CC2)cc1 ZINC000761520235 1128132900 /nfs/dbraw/zinc/13/29/00/1128132900.db2.gz MYFHZOMBJKZXFU-UHFFFAOYSA-N 1 0 292.492 3.766 20 10 CHCDRO C[C@H]1C[C@H]1C[NH2+]Cc1ccc(N2CCC(C)CC2)cc1 ZINC000754123206 1128197010 /nfs/dbraw/zinc/19/70/10/1128197010.db2.gz RDENMGRVKFWLNL-RDJZCZTQSA-N 1 0 272.436 3.669 20 10 CHCDRO C[C@@H](CCc1ccc(O)cc1)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000074336347 1128164395 /nfs/dbraw/zinc/16/43/95/1128164395.db2.gz RZNBZZUODADIMC-HNNXBMFYSA-N 1 0 298.430 3.569 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc2c(c1)C[C@H](C)O2)c1ccccc1O ZINC000926922541 1128203013 /nfs/dbraw/zinc/20/30/13/1128203013.db2.gz ZTMDGEGCEZGORM-GUYCJALGSA-N 1 0 297.398 3.957 20 10 CHCDRO CC[C@H]([NH2+]Cc1ncc(C)cc1C)c1ccc(C)cc1O ZINC000926958113 1128206133 /nfs/dbraw/zinc/20/61/33/1128206133.db2.gz CKTSVHPMZXDERU-INIZCTEOSA-N 1 0 284.403 3.953 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCS[C@@H](C)C2)c(O)c1C ZINC000927030367 1128209612 /nfs/dbraw/zinc/20/96/12/1128209612.db2.gz ICTRDBMQYNTQAK-FPMFFAJLSA-N 1 0 279.449 3.944 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCCc2cccnc21)c1ccccc1O ZINC000927062742 1128213093 /nfs/dbraw/zinc/21/30/93/1128213093.db2.gz LNEUGJUJQYVZDS-DOMZBBRYSA-N 1 0 268.360 3.515 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CC(C)(C)OC2(C)C)c1 ZINC000927099173 1128217153 /nfs/dbraw/zinc/21/71/53/1128217153.db2.gz ARHJSROEALQHRU-UONOGXRCSA-N 1 0 291.435 3.945 20 10 CHCDRO C[C@H]([NH2+]CC[C@@H]1CCC2(CCC2)O1)c1cc(F)ccc1O ZINC000927127209 1128220790 /nfs/dbraw/zinc/22/07/90/1128220790.db2.gz GOAVHEHNQXMPRE-JSGCOSHPSA-N 1 0 293.382 3.674 20 10 CHCDRO COCC[N@@H+](Cc1cc(C(C)C)c(C)cc1O)CC(C)C ZINC000914783557 1128242813 /nfs/dbraw/zinc/24/28/13/1128242813.db2.gz UKDXGTSYXYHIDI-UHFFFAOYSA-N 1 0 293.451 3.928 20 10 CHCDRO COc1cc(C)cc(C[N@H+](C)C[C@@H](C)c2ccccc2)c1O ZINC000754726488 1128298899 /nfs/dbraw/zinc/29/88/99/1128298899.db2.gz JNONDLAZLNRLFC-OAHLLOKOSA-N 1 0 299.414 3.945 20 10 CHCDRO Cc1cc([C@@H]2CCC[N@@H+]2Cc2cc(C)cc(C)c2O)on1 ZINC000754727541 1128299302 /nfs/dbraw/zinc/29/93/02/1128299302.db2.gz IJMBXFZSWMPXFZ-HNNXBMFYSA-N 1 0 286.375 3.643 20 10 CHCDRO CCCC[N@H+](C/C=C(\C)COC)Cc1ccccc1O ZINC000930350655 1128314969 /nfs/dbraw/zinc/31/49/69/1128314969.db2.gz ILJFVXHVRNDVCL-XNTDXEJSSA-N 1 0 277.408 3.587 20 10 CHCDRO CCCC[N@H+](Cc1ccccc1O)Cc1cc(C)nnc1C ZINC000930351264 1128315225 /nfs/dbraw/zinc/31/52/25/1128315225.db2.gz NIHYGXTUNXQXRW-UHFFFAOYSA-N 1 0 299.418 3.601 20 10 CHCDRO Oc1cc2c(cc1C[NH+]1CCCC1)oc1ccccc12 ZINC000915790312 1128338344 /nfs/dbraw/zinc/33/83/44/1128338344.db2.gz QEBVCTBKHNFTSE-UHFFFAOYSA-N 1 0 267.328 3.887 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)[C@@H](C)Cc1cccc(F)c1 ZINC001168499303 1128340709 /nfs/dbraw/zinc/34/07/09/1128340709.db2.gz YSNTUAOEGIEVTK-AWEZNQCLSA-N 1 0 287.378 3.984 20 10 CHCDRO C[C@H]([NH2+]Cc1ccccc1CF)c1ccccc1O ZINC000931555261 1128368555 /nfs/dbraw/zinc/36/85/55/1128368555.db2.gz WIBNVVSMHGUPKU-LBPRGKRZSA-N 1 0 259.324 3.713 20 10 CHCDRO Cc1cc(C[NH2+][C@@H](c2ccccn2)C2CC2)ccc1N(C)C ZINC000932384110 1128407331 /nfs/dbraw/zinc/40/73/31/1128407331.db2.gz GFZHYBWBLQBPDB-LJQANCHMSA-N 1 0 295.430 3.697 20 10 CHCDRO CCOC[C@H](C)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000778198619 1128444369 /nfs/dbraw/zinc/44/43/69/1128444369.db2.gz TURHMBIQMCCLSB-AWEZNQCLSA-N 1 0 285.387 3.574 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]Cc1cccc2cccnc21 ZINC000112017854 1128443021 /nfs/dbraw/zinc/44/30/21/1128443021.db2.gz ZBCADGTVDPZLMI-UHFFFAOYSA-N 1 0 298.773 3.884 20 10 CHCDRO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1ccccc1O ZINC000780793302 1128451734 /nfs/dbraw/zinc/45/17/34/1128451734.db2.gz LCBADQPOALYTCU-ZYHUDNBSSA-N 1 0 273.298 3.555 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]CCCc2cccc(C)c2)c1 ZINC000778231089 1128455400 /nfs/dbraw/zinc/45/54/00/1128455400.db2.gz DDRIKOOWLRTWPL-HNNXBMFYSA-N 1 0 299.414 3.993 20 10 CHCDRO COc1ccccc1CC[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000154552123 1128523186 /nfs/dbraw/zinc/52/31/86/1128523186.db2.gz SGQXCPZJARBLRN-HNNXBMFYSA-N 1 0 298.430 3.655 20 10 CHCDRO C[C@H]1CC[C@@]2(CC[N@H+](Cc3c(O)ccc4ccncc43)C2)C1 ZINC000781585508 1128568730 /nfs/dbraw/zinc/56/87/30/1128568730.db2.gz GOYDXGNFMNBJGY-IFXJQAMLSA-N 1 0 296.414 3.953 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCCC[C@@H]2C)c1 ZINC000042856723 1128587622 /nfs/dbraw/zinc/58/76/22/1128587622.db2.gz STZNTCSHOHHFMQ-IHRRRGAJSA-N 1 0 277.408 3.878 20 10 CHCDRO CCCC[C@@H](COC)[NH2+][C@@H](CC)c1ccccc1O ZINC000155902248 1128618026 /nfs/dbraw/zinc/61/80/26/1128618026.db2.gz QGRVAMHXXVSULJ-ZFWWWQNUSA-N 1 0 265.397 3.638 20 10 CHCDRO CC[C@H]([NH2+][C@@H](CCO)C1CCCCC1)c1ccccc1O ZINC000156410809 1128636080 /nfs/dbraw/zinc/63/60/80/1128636080.db2.gz YBIXAVSRZXDXAC-IRXDYDNUSA-N 1 0 291.435 3.764 20 10 CHCDRO CN(C)c1ccc(CN(C)Cc2ccc(F)cc2F)cc1 ZINC000920258872 1128675101 /nfs/dbraw/zinc/67/51/01/1128675101.db2.gz ZZCMSTNLLUFXGW-UHFFFAOYSA-N 1 0 290.357 3.663 20 10 CHCDRO C[C@H]1c2ccccc2CC[N@H+]1Cc1cc(F)ccc1O ZINC000779015209 1128680548 /nfs/dbraw/zinc/68/05/48/1128680548.db2.gz SEIDSULDUPEGOU-LBPRGKRZSA-N 1 0 271.335 3.651 20 10 CHCDRO C[C@@H]1C[C@H](c2ccccc2)C[N@@H+]1Cc1cc(F)ccc1O ZINC000779020259 1128683241 /nfs/dbraw/zinc/68/32/41/1128683241.db2.gz LBGSTMVPFPJIGN-HIFRSBDPSA-N 1 0 285.362 3.909 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CCCSC2)cc1 ZINC000159547980 1128708247 /nfs/dbraw/zinc/70/82/47/1128708247.db2.gz XPPYVOAACQBALM-DZGCQCFKSA-N 1 0 278.465 3.689 20 10 CHCDRO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2cc(F)ccc2O)o1 ZINC000779065328 1128716186 /nfs/dbraw/zinc/71/61/86/1128716186.db2.gz PDUVMHROXBXODX-QMTHXVAHSA-N 1 0 275.323 3.538 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1CCC(C)(C)O1)c1ccc(N(C)C)cc1 ZINC000779079342 1128723085 /nfs/dbraw/zinc/72/30/85/1128723085.db2.gz MPDZXYYLVMQNAM-IAGOWNOFSA-N 1 0 290.451 3.751 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]Cc2ccoc2)cc1F ZINC000171832618 1128719742 /nfs/dbraw/zinc/71/97/42/1128719742.db2.gz HWSPRNPOXLJIBS-UHFFFAOYSA-N 1 0 276.355 3.555 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)c1cc(Cl)ccc1O)c1ccns1 ZINC000858577897 1117811241 /nfs/dbraw/zinc/81/12/41/1117811241.db2.gz SEIHRKBYSSUFOR-RKDXNWHRSA-N 1 0 282.796 3.914 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCOc3ccccc32)c1 ZINC000185404912 1117818229 /nfs/dbraw/zinc/81/82/29/1117818229.db2.gz ZJYSJKKJZUCFDN-GJZGRUSLSA-N 1 0 297.398 3.918 20 10 CHCDRO C[C@H](O)C[C@H](C)C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000185521470 1117833130 /nfs/dbraw/zinc/83/31/30/1117833130.db2.gz JRLBCKCZCXNKHY-IHRRRGAJSA-N 1 0 287.403 3.603 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](C2CC2)C2CCC2)c1 ZINC000325064050 1117842463 /nfs/dbraw/zinc/84/24/63/1117842463.db2.gz UCQRPVVUNFEKPB-SJKOYZFVSA-N 1 0 259.393 3.930 20 10 CHCDRO CCc1cnc(CC[NH2+][C@@H](C)c2cc(C)ccc2O)s1 ZINC000185583218 1117852716 /nfs/dbraw/zinc/85/27/16/1117852716.db2.gz KXTFELRNXILMQK-LBPRGKRZSA-N 1 0 290.432 3.613 20 10 CHCDRO Cc1noc(C)c1[C@@H](C)[NH2+]Cc1cc(Cl)ccc1O ZINC000073007032 1117863016 /nfs/dbraw/zinc/86/30/16/1117863016.db2.gz RPEBVAQKNCNUIU-MRVPVSSYSA-N 1 0 280.755 3.501 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCCS1)c1cc2c(cc1O)CCCC2 ZINC000185698131 1117873201 /nfs/dbraw/zinc/87/32/01/1117873201.db2.gz GHBZKINFURWIDN-SWLSCSKDSA-N 1 0 291.460 3.817 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CCC[C@@H]2c2ccccc2)c(O)c1 ZINC000111412944 1117877825 /nfs/dbraw/zinc/87/78/25/1117877825.db2.gz IJDFGDHSBDTDOR-QZTJIDSGSA-N 1 0 297.398 3.827 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CC[C@@H](OC)C[C@@H]2C)cc1 ZINC000799736021 1117898677 /nfs/dbraw/zinc/89/86/77/1117898677.db2.gz GFPGFAOIPBXYJH-MAUKXSAKSA-N 1 0 290.451 3.532 20 10 CHCDRO C[C@@H]1CCCC[N@H+](Cc2c(O)cccc2Cl)C1 ZINC000705476319 1117973133 /nfs/dbraw/zinc/97/31/33/1117973133.db2.gz IVWLSLRUMCCUNK-LLVKDONJSA-N 1 0 253.773 3.668 20 10 CHCDRO C[C@H]1CC[N@H+](Cc2ccccc2O)[C@H](c2ccco2)C1 ZINC000179582887 1128748800 /nfs/dbraw/zinc/74/88/00/1128748800.db2.gz OCOGKZNCGYAXLV-ZFWWWQNUSA-N 1 0 271.360 3.958 20 10 CHCDRO CC[C@@H]([NH2+]CCSC(F)(F)F)c1ccccc1O ZINC000186121345 1118003978 /nfs/dbraw/zinc/00/39/78/1118003978.db2.gz VZPUFWRHZJIGSS-SNVBAGLBSA-N 1 0 279.327 3.686 20 10 CHCDRO CCOc1cccc(C[N@H+](C)Cc2ccc(F)cc2)c1O ZINC000179646486 1128751688 /nfs/dbraw/zinc/75/16/88/1128751688.db2.gz XIVAXHVANWEFCE-UHFFFAOYSA-N 1 0 289.350 3.562 20 10 CHCDRO COc1ccc([C@@H](C)[N@H+](C)Cc2cccc(C)c2O)cc1 ZINC000179664453 1128753764 /nfs/dbraw/zinc/75/37/64/1128753764.db2.gz JXJIDMODUSWZAU-CQSZACIVSA-N 1 0 285.387 3.902 20 10 CHCDRO CCC[N@H+](Cc1ccc(C#N)cc1)Cc1cccc(C)c1O ZINC000179721331 1128755102 /nfs/dbraw/zinc/75/51/02/1128755102.db2.gz KLCJZDIDFXCQHP-UHFFFAOYSA-N 1 0 294.398 3.985 20 10 CHCDRO CCCN(CCC)c1ccc(C[NH2+]C2(COC)CC2)cc1 ZINC000765270199 1118142091 /nfs/dbraw/zinc/14/20/91/1118142091.db2.gz KBEOYZSAGWQKHD-UHFFFAOYSA-N 1 0 290.451 3.582 20 10 CHCDRO CC[C@@H]([NH2+]C(C1CC1)C1CC1)c1ccc(N(C)C)cc1 ZINC000765350877 1118146857 /nfs/dbraw/zinc/14/68/57/1118146857.db2.gz OTJCAPYCAKHTAL-QGZVFWFLSA-N 1 0 272.436 3.982 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](C)C1CC1)c1ccc(N(C)C)cc1 ZINC000765397030 1118148325 /nfs/dbraw/zinc/14/83/25/1118148325.db2.gz ZQJCDOHRNVPCKK-CXAGYDPISA-N 1 0 260.425 3.839 20 10 CHCDRO COc1ccccc1C1([NH2+][C@H](C)c2ccccc2O)CC1 ZINC000842902243 1118163460 /nfs/dbraw/zinc/16/34/60/1118163460.db2.gz MPWLOSNYVCNKQZ-CYBMUJFWSA-N 1 0 283.371 3.741 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccnc(Cl)c1 ZINC000765609960 1118182412 /nfs/dbraw/zinc/18/24/12/1118182412.db2.gz SAPBZGGKRDJIHO-NSHDSACASA-N 1 0 288.778 3.521 20 10 CHCDRO COc1cc(C)ccc1[C@@H](C)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000765608798 1118182462 /nfs/dbraw/zinc/18/24/62/1118182462.db2.gz KXZSGRNFXZBDGD-CQSZACIVSA-N 1 0 297.398 3.789 20 10 CHCDRO CC[C@H]1CCC[C@@H]([NH2+]Cc2ccc(N(C)C)cc2)C1 ZINC000083639721 1118191621 /nfs/dbraw/zinc/19/16/21/1118191621.db2.gz COTCAJHEBGVDQW-GOEBONIOSA-N 1 0 260.425 3.811 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]Cc2ccc3c(c2)CCCO3)c1 ZINC000921563576 1118201281 /nfs/dbraw/zinc/20/12/81/1118201281.db2.gz MPCRCZXJILSCAM-AWEZNQCLSA-N 1 0 297.398 3.871 20 10 CHCDRO CC(C)OC1CCC([NH2+][C@@H](C)c2cc(F)ccc2O)CC1 ZINC000186160754 1118203192 /nfs/dbraw/zinc/20/31/92/1118203192.db2.gz PAUZXLMRPWQJCO-GRTSSRMGSA-N 1 0 295.398 3.918 20 10 CHCDRO CC(C)OC1CCC([NH2+][C@H](C)c2cc(F)ccc2O)CC1 ZINC000186160772 1118203524 /nfs/dbraw/zinc/20/35/24/1118203524.db2.gz PAUZXLMRPWQJCO-LRVUVFPRSA-N 1 0 295.398 3.918 20 10 CHCDRO C[C@@H]([NH2+]C[C@@](C)(O)C1CCCCC1)c1cc(F)ccc1O ZINC000188664730 1128763945 /nfs/dbraw/zinc/76/39/45/1128763945.db2.gz PZRPTNKZJJUEBN-SJKOYZFVSA-N 1 0 295.398 3.513 20 10 CHCDRO C[C@@H]([NH2+]Cc1cccc(OC(F)F)c1)c1ccccc1O ZINC000179888152 1128765024 /nfs/dbraw/zinc/76/50/24/1128765024.db2.gz NCXNSMFIFJVPPC-LLVKDONJSA-N 1 0 293.313 3.844 20 10 CHCDRO C[C@H]([NH2+]CCOc1ccc(Cl)cc1)c1ccccc1O ZINC000179887144 1128765110 /nfs/dbraw/zinc/76/51/10/1128765110.db2.gz ZBLNVBPBFRICCU-LBPRGKRZSA-N 1 0 291.778 3.775 20 10 CHCDRO COc1ccc([C@@H](C)[N@H+](C)Cc2cc(F)ccc2O)cc1 ZINC000179910267 1128765603 /nfs/dbraw/zinc/76/56/03/1128765603.db2.gz GATLHGGQSMOWPC-GFCCVEGCSA-N 1 0 289.350 3.733 20 10 CHCDRO C[N@H+](Cc1cc(F)ccc1O)[C@H]1CCc2ccccc21 ZINC000179905795 1128766133 /nfs/dbraw/zinc/76/61/33/1128766133.db2.gz DTJXNQPEYWITBK-INIZCTEOSA-N 1 0 271.335 3.651 20 10 CHCDRO Cc1ccc2c(CC[NH2+]Cc3ccccc3O)c[nH]c2c1 ZINC000237885675 1128766363 /nfs/dbraw/zinc/76/63/63/1128766363.db2.gz ODSYKJHYNAWDNJ-UHFFFAOYSA-N 1 0 280.371 3.514 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H](C)CN(CC)CC)cc1 ZINC000765765569 1118269055 /nfs/dbraw/zinc/26/90/55/1118269055.db2.gz GWVDUNGJCPIVRN-CVEARBPZSA-N 1 0 291.483 3.524 20 10 CHCDRO CCOc1ccccc1C[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001648892461 1118273213 /nfs/dbraw/zinc/27/32/13/1118273213.db2.gz CARBYKMRDOSAAQ-UHFFFAOYSA-N 1 0 297.398 3.700 20 10 CHCDRO CC[C@@H](Cc1ccccc1)[NH2+]Cc1ccccc1O ZINC000075944386 1118282523 /nfs/dbraw/zinc/28/25/23/1118282523.db2.gz FRABYLDKUJKNHC-INIZCTEOSA-N 1 0 255.361 3.503 20 10 CHCDRO CCC[N@@H+](Cc1ccccc1O)C[C@H](O)c1ccc(C)cc1 ZINC000076074013 1128768612 /nfs/dbraw/zinc/76/86/12/1128768612.db2.gz CGQCRPWOUJZLOZ-IBGZPJMESA-N 1 0 299.414 3.646 20 10 CHCDRO CCOC1CC(CC[NH2+][C@@H](CC)c2ccccc2O)C1 ZINC000189247466 1128770170 /nfs/dbraw/zinc/77/01/70/1128770170.db2.gz SZNJSAMXFCKQBJ-XUJLQICISA-N 1 0 277.408 3.638 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)CN(CC)CC)c1ccc(N(C)C)cc1 ZINC000765770362 1118322442 /nfs/dbraw/zinc/32/24/42/1118322442.db2.gz WRPBHXRJVVSCTO-MAUKXSAKSA-N 1 0 291.483 3.524 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@](C)(O)C2CCCCC2)c(O)c1 ZINC000188661156 1118325848 /nfs/dbraw/zinc/32/58/48/1118325848.db2.gz LJRNTZHXSUEXFD-KSSFIOAISA-N 1 0 291.435 3.683 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@](C)(O)C1CCCCC1)c1ccccc1O ZINC000188660467 1118326310 /nfs/dbraw/zinc/32/63/10/1118326310.db2.gz CJFAGPCKXPBMNE-SJLPKXTDSA-N 1 0 291.435 3.764 20 10 CHCDRO CCOCCC1(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)CC1 ZINC000285363968 1118399769 /nfs/dbraw/zinc/39/97/69/1118399769.db2.gz VTGLBXYTAIMYGX-OAHLLOKOSA-N 1 0 291.435 3.866 20 10 CHCDRO Oc1ccc2oc3c(c2c1C[NH+]1CCCC1)CCCC3 ZINC000048619055 1118418589 /nfs/dbraw/zinc/41/85/89/1118418589.db2.gz MOSUGBYUGYSCIW-UHFFFAOYSA-N 1 0 271.360 3.613 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccccc1 ZINC000050198286 1118442851 /nfs/dbraw/zinc/44/28/51/1118442851.db2.gz YZAUNUNRGRFXSN-QGZVFWFLSA-N 1 0 267.372 3.862 20 10 CHCDRO CCc1cccc(C[N@@H+]2CCS[C@@H]3CCCC[C@@H]32)c1O ZINC001204542812 1118476292 /nfs/dbraw/zinc/47/62/92/1118476292.db2.gz IOVUFLHBEHDGKE-JKSUJKDBSA-N 1 0 291.460 3.815 20 10 CHCDRO C[C@H]1CC([NH2+]Cc2ccc3c(c2)CCCN3C)C[C@H](C)C1 ZINC000084972214 1118477488 /nfs/dbraw/zinc/47/74/88/1118477488.db2.gz OJAVSFSPQRRJHZ-HUUCEWRRSA-N 1 0 286.463 3.983 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CCOCCC(C)C)c(Cl)c1 ZINC001661178480 1118506323 /nfs/dbraw/zinc/50/63/23/1118506323.db2.gz GWCKDAJGOHRGME-UHFFFAOYSA-N 1 0 285.815 3.506 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2[C@H](C)C[C@@H]3CCCC[C@@H]32)c1 ZINC000180234924 1128782550 /nfs/dbraw/zinc/78/25/50/1128782550.db2.gz PSEQHFQVZRPVKW-WWGRRREGSA-N 1 0 275.392 3.554 20 10 CHCDRO Cc1ccc2cc(C[N@@H+](C)Cc3ccccc3O)ccc2n1 ZINC000189740452 1128783612 /nfs/dbraw/zinc/78/36/12/1128783612.db2.gz BOTKJJFEVHNFQH-UHFFFAOYSA-N 1 0 292.382 3.881 20 10 CHCDRO Cc1noc(C)c1[C@H](C)[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000092326650 1118583026 /nfs/dbraw/zinc/58/30/26/1118583026.db2.gz CRDKNGBUGSOJKP-QWRGUYRKSA-N 1 0 274.364 3.717 20 10 CHCDRO FC1(F)CCC(C[NH2+]Cc2ccc3c(c2)CCO3)CC1 ZINC000693385705 1118614769 /nfs/dbraw/zinc/61/47/69/1118614769.db2.gz HSNUZHQDWJWHAR-UHFFFAOYSA-N 1 0 281.346 3.537 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC(C)(C)C2(O)CCCC2)c(O)c1 ZINC000834906991 1118625946 /nfs/dbraw/zinc/62/59/46/1118625946.db2.gz VODIEHKWIAFHLG-AWEZNQCLSA-N 1 0 291.435 3.683 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC(C)(C)C2(O)CCCC2)c(O)c1 ZINC000834906992 1118626006 /nfs/dbraw/zinc/62/60/06/1118626006.db2.gz VODIEHKWIAFHLG-CQSZACIVSA-N 1 0 291.435 3.683 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@H+](C)Cc2ccc(F)c(F)c2)c1 ZINC000754723444 1118644233 /nfs/dbraw/zinc/64/42/33/1118644233.db2.gz KJYOQUQXSULEQB-UHFFFAOYSA-N 1 0 291.341 3.919 20 10 CHCDRO CC[C@H]1CCCC[N@@H+]1Cc1c(O)cccc1Br ZINC000707145498 1118648161 /nfs/dbraw/zinc/64/81/61/1118648161.db2.gz GLXPAGVLPWBOCL-NSHDSACASA-N 1 0 298.224 3.919 20 10 CHCDRO CC[C@@H]([NH2+]CCCOCC(C)C)c1ccc(F)cc1[O-] ZINC000796676494 1118685238 /nfs/dbraw/zinc/68/52/38/1118685238.db2.gz RUUIOFYEXNKXFW-OAHLLOKOSA-N 1 0 283.387 3.635 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH+]2CCC(C(F)F)CC2)cc1 ZINC000835028159 1118806965 /nfs/dbraw/zinc/80/69/65/1118806965.db2.gz KDQDKADONYJMJN-ONEGZZNKSA-N 1 0 294.389 3.743 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C2CCSCC2)cc1 ZINC000132107742 1118818227 /nfs/dbraw/zinc/81/82/27/1118818227.db2.gz FOIPWECKFVKKPD-UHFFFAOYSA-N 1 0 278.465 3.518 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH+]1C[C@@H]2CCCC[C@H]2C1 ZINC000386462292 1118850522 /nfs/dbraw/zinc/85/05/22/1118850522.db2.gz GCKYHFHYFOKYRB-RYUDHWBXSA-N 1 0 265.784 3.668 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)CCSC)c1ccccc1O ZINC000129683483 1118880497 /nfs/dbraw/zinc/88/04/97/1118880497.db2.gz DMEUGFPGKAJMBB-AAEUAGOBSA-N 1 0 253.411 3.575 20 10 CHCDRO COC[C@@H](C)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000178667359 1119221036 /nfs/dbraw/zinc/22/10/36/1119221036.db2.gz PLKSSKYCOQITIU-HOTGVXAUSA-N 1 0 290.451 3.610 20 10 CHCDRO C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(N(C)C)cc2)[C@@H](C)C1 ZINC000226172767 1119248003 /nfs/dbraw/zinc/24/80/03/1119248003.db2.gz KGNNCCMNPVHWAT-JKIFEVAISA-N 1 0 260.425 3.667 20 10 CHCDRO C[C@@H]1CCC[C@H](C[NH2+]Cc2c(O)cccc2Cl)C1 ZINC000226646785 1119256044 /nfs/dbraw/zinc/25/60/44/1119256044.db2.gz KJJDTBUTIJDDQR-NEPJUHHUSA-N 1 0 267.800 3.962 20 10 CHCDRO CC(C)C1(C[NH2+]Cc2cc(Cl)ccc2O)CC1 ZINC000227832523 1119308224 /nfs/dbraw/zinc/30/82/24/1119308224.db2.gz DKZPJOOGZKHSDA-UHFFFAOYSA-N 1 0 253.773 3.571 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(F)cc1F)c1ccccc1O ZINC000051016633 1119360580 /nfs/dbraw/zinc/36/05/80/1119360580.db2.gz NNVOXZQVEWQXNX-SNVBAGLBSA-N 1 0 263.287 3.521 20 10 CHCDRO CCC[N@H+](Cc1cnc(CC)s1)Cc1ccccc1O ZINC000092704946 1119565016 /nfs/dbraw/zinc/56/50/16/1119565016.db2.gz NARKVBDFSJYWTL-UHFFFAOYSA-N 1 0 290.432 3.823 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@H]1CCCS1 ZINC000250981123 1119597001 /nfs/dbraw/zinc/59/70/01/1119597001.db2.gz NAJOYBWFMFNFMB-UPJWGTAASA-N 1 0 277.433 3.734 20 10 CHCDRO C[C@H]1[C@@H](c2ccccc2)CC[N@@H+]1Cc1ccccc1O ZINC000179580528 1119751858 /nfs/dbraw/zinc/75/18/58/1119751858.db2.gz XEHIIQGXXJSQSB-YOEHRIQHSA-N 1 0 267.372 3.770 20 10 CHCDRO C[C@@H](Cc1ccsc1)[N@H+](C)Cc1ccccc1O ZINC000179581126 1119751927 /nfs/dbraw/zinc/75/19/27/1119751927.db2.gz CPMVWRVXCVEBHN-LBPRGKRZSA-N 1 0 261.390 3.517 20 10 CHCDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]Cc1cccnc1 ZINC000725841686 1119766996 /nfs/dbraw/zinc/76/69/96/1119766996.db2.gz USFGJCTZKXOZKG-UHFFFAOYSA-N 1 0 290.366 3.744 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+]([C@@H](C)C2CC2)C2CC2)c1 ZINC000092009950 1119792224 /nfs/dbraw/zinc/79/22/24/1119792224.db2.gz FWCFHPGHRSZBJZ-LBPRGKRZSA-N 1 0 275.392 3.554 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cccc(OC)c1O)C1CCCCC1 ZINC000052335347 1119813528 /nfs/dbraw/zinc/81/35/28/1119813528.db2.gz QCHRSAJFGOFLPO-OAHLLOKOSA-N 1 0 277.408 3.849 20 10 CHCDRO CSCC[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000154744353 1119829078 /nfs/dbraw/zinc/82/90/78/1119829078.db2.gz BUGGVRBNBKGEGH-ZDUSSCGKSA-N 1 0 296.455 3.830 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]C[C@@H]2CCC[C@H]3C[C@H]32)c1O ZINC000694289314 1119836554 /nfs/dbraw/zinc/83/65/54/1119836554.db2.gz SAPXOHCNZJCAEB-COPLHBTASA-N 1 0 295.810 3.580 20 10 CHCDRO CCOC[C@H]1CC[N@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000177629891 1119836758 /nfs/dbraw/zinc/83/67/58/1119836758.db2.gz XLCFZZBNDLUBIT-HNNXBMFYSA-N 1 0 291.435 3.682 20 10 CHCDRO C[N@H+](Cc1ccccc1O)[C@@H]1CCc2ccc(F)cc21 ZINC000177716238 1119847167 /nfs/dbraw/zinc/84/71/67/1119847167.db2.gz KOEHVQSWRAWMAC-MRXNPFEDSA-N 1 0 271.335 3.651 20 10 CHCDRO C[N@H+](Cc1ccccc1O)[C@H]1CCc2ccc(F)cc21 ZINC000177716250 1119847186 /nfs/dbraw/zinc/84/71/86/1119847186.db2.gz KOEHVQSWRAWMAC-INIZCTEOSA-N 1 0 271.335 3.651 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[NH2+][C@@H]1CCC[C@H]2C[C@H]21 ZINC000694346715 1119875038 /nfs/dbraw/zinc/87/50/38/1119875038.db2.gz QTHDXNXEHCGGTE-CGTJXYLNSA-N 1 0 270.420 3.565 20 10 CHCDRO C[C@H]([NH2+]C[C@]1(C)CC1(F)F)c1ccc(Cl)cc1O ZINC000850536157 1119973112 /nfs/dbraw/zinc/97/31/12/1119973112.db2.gz HPMWFPDXXMFWGO-UFBFGSQYSA-N 1 0 275.726 3.742 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCC(F)(F)C2)c1 ZINC000310976472 1120000926 /nfs/dbraw/zinc/00/09/26/1120000926.db2.gz QHHTVMYVFOLJAG-WDEREUQCSA-N 1 0 255.308 3.539 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(N2CCSCC2)cc1)C1CC1 ZINC000163632454 1120018892 /nfs/dbraw/zinc/01/88/92/1120018892.db2.gz YDBSIQJFVIPKBY-KRWDZBQOSA-N 1 0 290.476 3.518 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]CC(C1CC1)C1CC1 ZINC000088456146 1120038361 /nfs/dbraw/zinc/03/83/61/1120038361.db2.gz JOXGDVIQFCZZMS-UHFFFAOYSA-N 1 0 265.784 3.571 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+][C@H]1CCCC(F)(F)C1 ZINC000695095225 1120104735 /nfs/dbraw/zinc/10/47/35/1120104735.db2.gz FDIMKTNXBOTFRD-VIFPVBQESA-N 1 0 275.726 3.713 20 10 CHCDRO CCC(C)(C)[C@@H](C)[NH2+][C@@H](C)c1cc(OC)ccc1O ZINC000695107867 1120108286 /nfs/dbraw/zinc/10/82/86/1120108286.db2.gz PHWCAKPHOSFEJM-NWDGAFQWSA-N 1 0 265.397 3.876 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CC3CCC2CC3)c(O)c1 ZINC000311858326 1120113355 /nfs/dbraw/zinc/11/33/55/1120113355.db2.gz JZWCFEQPSUPJAP-UWLZSVRSSA-N 1 0 259.393 3.930 20 10 CHCDRO C[C@@H]1CCCC[N@@H+]1Cc1ccc(N2CCCC2)cc1 ZINC001116438857 1120119125 /nfs/dbraw/zinc/11/91/25/1120119125.db2.gz RPJMEZLRRZWCGW-OAHLLOKOSA-N 1 0 258.409 3.661 20 10 CHCDRO Cc1cc(Br)cc(C[N@@H+](C)C(C)(C)C)c1O ZINC000394389053 1120121249 /nfs/dbraw/zinc/12/12/49/1120121249.db2.gz ZPPKKEDGAMUQKZ-UHFFFAOYSA-N 1 0 286.213 3.693 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc(C)cc1O ZINC001140954441 1120145472 /nfs/dbraw/zinc/14/54/72/1120145472.db2.gz RNYJPUQKXRDVNS-UHFFFAOYSA-N 1 0 298.430 3.789 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@@H]1CCc3ccccc3C1)CC2 ZINC000314450166 1120210928 /nfs/dbraw/zinc/21/09/28/1120210928.db2.gz DOEXVVPKXARMAS-IAGOWNOFSA-N 1 0 279.383 3.527 20 10 CHCDRO CC1(C)CC([NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000395173225 1120218123 /nfs/dbraw/zinc/21/81/23/1120218123.db2.gz IQRUHYGRTCFBJA-UHFFFAOYSA-N 1 0 272.436 3.955 20 10 CHCDRO c1cc2c([nH]1)CCC[C@H]2[NH2+]Cc1ccc2c(c1)CCCO2 ZINC000921815076 1120225099 /nfs/dbraw/zinc/22/50/99/1120225099.db2.gz HOLKZFJOPRWUJY-QGZVFWFLSA-N 1 0 282.387 3.507 20 10 CHCDRO CCS[C@H]1CC[C@@H]([N@H+](C)Cc2cc(F)ccc2O)C1 ZINC000180250144 1120269717 /nfs/dbraw/zinc/26/97/17/1120269717.db2.gz XKEFECGUDUDGFX-KGLIPLIRSA-N 1 0 283.412 3.637 20 10 CHCDRO CCCCN(C)CC[NH2+][C@@H](CC)c1ccc(N(C)C)cc1 ZINC000765953812 1120281299 /nfs/dbraw/zinc/28/12/99/1120281299.db2.gz UINOFJGDQVKRTF-SFHVURJKSA-N 1 0 291.483 3.525 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](CC(C)C)N(C)C)c(O)c1C ZINC000756400046 1120312207 /nfs/dbraw/zinc/31/22/07/1120312207.db2.gz UIDAMUKNZYUTNE-JKSUJKDBSA-N 1 0 292.467 3.636 20 10 CHCDRO C[C@H]([NH2+]CC(C)(C)N1CCC[C@H](C)C1)c1ccccc1O ZINC000183440745 1120342013 /nfs/dbraw/zinc/34/20/13/1120342013.db2.gz LNVZEIOCELZUAP-GJZGRUSLSA-N 1 0 290.451 3.553 20 10 CHCDRO Cc1cccc(C)c1C[NH2+]Cc1cc(Cl)ccc1O ZINC000132120878 1120352461 /nfs/dbraw/zinc/35/24/61/1120352461.db2.gz MQQFRRHNIRKUQW-UHFFFAOYSA-N 1 0 275.779 3.952 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCCO2)c1ccsc1 ZINC000922108358 1120369073 /nfs/dbraw/zinc/36/90/73/1120369073.db2.gz PYENCSCHEGEMTM-GFCCVEGCSA-N 1 0 273.401 3.924 20 10 CHCDRO C[C@H](C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F)C1CC1 ZINC000756483698 1120372498 /nfs/dbraw/zinc/37/24/98/1120372498.db2.gz VJVUJXODGHUSDO-BREBYQMCSA-N 1 0 263.356 3.715 20 10 CHCDRO CCCC(O)(CCC)C[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000185500669 1120377907 /nfs/dbraw/zinc/37/79/07/1120377907.db2.gz AZBOWTJJQWETCF-AWEZNQCLSA-N 1 0 279.424 3.683 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2cccc(C#N)c2)c1 ZINC000185610656 1120380645 /nfs/dbraw/zinc/38/06/45/1120380645.db2.gz NUUNQYCIQTVZBF-OLZOCXBDSA-N 1 0 296.370 3.684 20 10 CHCDRO C[C@H]1C[C@H]([NH2+]CCOC2CCCC2)c2c1c(F)ccc2O ZINC000756491568 1120382861 /nfs/dbraw/zinc/38/28/61/1120382861.db2.gz VXBSYPOTCMNUQN-FZMZJTMJSA-N 1 0 293.382 3.628 20 10 CHCDRO CC(C)[N@H+](Cc1ccccc1)Cc1cc(O)ccc1O ZINC001141155600 1120413283 /nfs/dbraw/zinc/41/32/83/1120413283.db2.gz ARIMXXQPHCVCRR-UHFFFAOYSA-N 1 0 271.360 3.508 20 10 CHCDRO CCC[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cccnc1 ZINC000756515454 1120417416 /nfs/dbraw/zinc/41/74/16/1120417416.db2.gz MZSYRRWWJSODMY-KRWDZBQOSA-N 1 0 282.387 3.648 20 10 CHCDRO CCOC1(C[NH2+][C@@H](CC)c2ccccc2O)CCCC1 ZINC000312487716 1120448513 /nfs/dbraw/zinc/44/85/13/1120448513.db2.gz QMAOVHPRIAVSNO-HNNXBMFYSA-N 1 0 277.408 3.782 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCc2cccc(O)c21)c1ccsc1 ZINC000310771716 1120485162 /nfs/dbraw/zinc/48/51/62/1120485162.db2.gz CVJHYRVYXMIEMG-MFKMUULPSA-N 1 0 259.374 3.792 20 10 CHCDRO C[C@@H]1CC[C@@H](C[NH2+]Cc2c(O)cccc2Cl)C1 ZINC000230413681 1120506513 /nfs/dbraw/zinc/50/65/13/1120506513.db2.gz LQWVOCHDNKXHDO-GHMZBOCLSA-N 1 0 253.773 3.571 20 10 CHCDRO CCN1CCCC[C@H]1C[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000756565185 1120531564 /nfs/dbraw/zinc/53/15/64/1120531564.db2.gz WIJFHZXBQPGNHH-JSGCOSHPSA-N 1 0 296.842 3.571 20 10 CHCDRO Cc1cc(F)ccc1[C@H](C)[NH2+]Cc1ccccc1O ZINC000922671186 1120576497 /nfs/dbraw/zinc/57/64/97/1120576497.db2.gz NTUILFUPPBZOFQ-LBPRGKRZSA-N 1 0 259.324 3.691 20 10 CHCDRO COc1ccc([C@H](C)[NH2+]Cc2cc(C)ccc2O)cc1C ZINC000922671616 1120576522 /nfs/dbraw/zinc/57/65/22/1120576522.db2.gz BXKYNKOANIKQJZ-AWEZNQCLSA-N 1 0 285.387 3.868 20 10 CHCDRO COc1ccccc1[C@H](C)[NH2+][C@@H](C)c1ccccc1O ZINC000020096743 1120584814 /nfs/dbraw/zinc/58/48/14/1120584814.db2.gz BTASRJDHHMNLDA-STQMWFEESA-N 1 0 271.360 3.813 20 10 CHCDRO CC(C)CC[C@](C)(O)C[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000756606152 1120595294 /nfs/dbraw/zinc/59/52/94/1120595294.db2.gz VXBMAZZACBQRHO-LRDDRELGSA-N 1 0 299.842 3.883 20 10 CHCDRO CC1(C2([NH2+]Cc3cc(Br)ccc3O)CC2)CC1 ZINC000398228936 1120596378 /nfs/dbraw/zinc/59/63/78/1120596378.db2.gz WXDLDWVYXZLOFH-UHFFFAOYSA-N 1 0 296.208 3.577 20 10 CHCDRO CCO[C@H](C[NH2+]Cc1cc(C)ccc1O)c1ccccc1 ZINC000194459329 1120599924 /nfs/dbraw/zinc/59/99/24/1120599924.db2.gz SGIQXEZSORNCGO-GOSISDBHSA-N 1 0 285.387 3.568 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]C2(Cc3ccccc3)CC2)c1 ZINC000186583931 1120608714 /nfs/dbraw/zinc/60/87/14/1120608714.db2.gz HMEZPCQCRIZJHS-CQSZACIVSA-N 1 0 297.398 3.827 20 10 CHCDRO CC(C)OCC[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000186640757 1120630313 /nfs/dbraw/zinc/63/03/13/1120630313.db2.gz RZQKYPXUFMZELA-MRXNPFEDSA-N 1 0 290.451 3.753 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CCCc3cccnc32)cc1C ZINC000922886257 1120630827 /nfs/dbraw/zinc/63/08/27/1120630827.db2.gz YYPWBMXAEGMVOK-MRXNPFEDSA-N 1 0 282.387 3.566 20 10 CHCDRO COCC(C)(C)C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000314001948 1120842987 /nfs/dbraw/zinc/84/29/87/1120842987.db2.gz ZJZTVHZEEBOIMY-ZDUSSCGKSA-N 1 0 287.403 3.869 20 10 CHCDRO CCOCCCC[NH2+][C@@H](C)c1ccc(N(C)CC)cc1 ZINC000165094684 1120904648 /nfs/dbraw/zinc/90/46/48/1120904648.db2.gz JMFJBGVUKZJWRW-HNNXBMFYSA-N 1 0 278.440 3.610 20 10 CHCDRO CC(C)c1ccc(C[N@@H+]2CCC(F)(F)[C@@H](C)C2)c(O)c1 ZINC001237045366 1128952252 /nfs/dbraw/zinc/95/22/52/1128952252.db2.gz JOKSHVAPZGCUJR-LBPRGKRZSA-N 1 0 283.362 3.993 20 10 CHCDRO CCC[N@H+](Cc1ccsc1)Cc1ccccc1O ZINC000092705069 1120964251 /nfs/dbraw/zinc/96/42/51/1120964251.db2.gz QNKNLLXBHQHPGX-UHFFFAOYSA-N 1 0 261.390 3.866 20 10 CHCDRO CC(C)c1ccc(C[N@@H+]2CCC(F)(F)[C@H](C)C2)c(O)c1 ZINC001237045361 1128952763 /nfs/dbraw/zinc/95/27/63/1128952763.db2.gz JOKSHVAPZGCUJR-GFCCVEGCSA-N 1 0 283.362 3.993 20 10 CHCDRO COc1ccccc1C[C@H](C)[N@H+](C)Cc1cc(C)ccc1O ZINC000317455759 1121011073 /nfs/dbraw/zinc/01/10/73/1121011073.db2.gz WXKABYFSNNYJAE-HNNXBMFYSA-N 1 0 299.414 3.772 20 10 CHCDRO Cc1ccsc1CC[NH2+]Cc1c(O)cccc1Cl ZINC000773409394 1121046280 /nfs/dbraw/zinc/04/62/80/1121046280.db2.gz MFHVLUSWWXJHGC-UHFFFAOYSA-N 1 0 281.808 3.748 20 10 CHCDRO C[C@H]([NH2+]CCCOc1ccccc1)c1cc(F)ccc1O ZINC000094618083 1121085419 /nfs/dbraw/zinc/08/54/19/1121085419.db2.gz KDYLNKHXFYLXKK-ZDUSSCGKSA-N 1 0 289.350 3.651 20 10 CHCDRO COCc1cccc(C[NH2+][C@H](C)c2cc(C)ccc2O)c1 ZINC000038010679 1121094762 /nfs/dbraw/zinc/09/47/62/1121094762.db2.gz DBFAQZPJKYMMHJ-CQSZACIVSA-N 1 0 285.387 3.698 20 10 CHCDRO CO[C@@H](C)C[N@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000182382064 1128963718 /nfs/dbraw/zinc/96/37/18/1128963718.db2.gz DLCOCQXCHGSMHW-HOTGVXAUSA-N 1 0 299.414 3.990 20 10 CHCDRO C[C@@H](F)CC[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000702624685 1121206332 /nfs/dbraw/zinc/20/63/32/1121206332.db2.gz XCGMDEOENOIJOI-NEPJUHHUSA-N 1 0 261.340 3.944 20 10 CHCDRO CCCC[C@@H]1CCC[C@@H]1[NH2+]Cc1cccc(OC)c1O ZINC000236865771 1121274966 /nfs/dbraw/zinc/27/49/66/1121274966.db2.gz RQJLNXRDKZSTFI-HIFRSBDPSA-N 1 0 277.408 3.849 20 10 CHCDRO Oc1ccc(F)c(Cl)c1C[N@@H+]1CC[C@@H]2CCC[C@H]2C1 ZINC001237123798 1128982020 /nfs/dbraw/zinc/98/20/20/1128982020.db2.gz LGCPLBWEMYMJSA-QWRGUYRKSA-N 1 0 283.774 3.807 20 10 CHCDRO C[N@@H+]1CCC=C(N(c2ccccc2)c2ccc(N)cc2)C1 ZINC001175579951 1121397972 /nfs/dbraw/zinc/39/79/72/1121397972.db2.gz INWIRNUWIOUAMR-UHFFFAOYSA-N 1 0 279.387 3.626 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CC[C@@H]2SC)cc1 ZINC000706504225 1121432125 /nfs/dbraw/zinc/43/21/25/1121432125.db2.gz GSXUUHAABIQGKK-CVEARBPZSA-N 1 0 278.465 3.516 20 10 CHCDRO Oc1ccc(Br)cc1C[NH2+][C@@H]1CCCC12CC2 ZINC000706932469 1121445988 /nfs/dbraw/zinc/44/59/88/1121445988.db2.gz BEPORTMFYKTNMR-CYBMUJFWSA-N 1 0 296.208 3.577 20 10 CHCDRO [O-]c1c(Cl)cccc1C[NH2+]Cc1csc(C2CC2)n1 ZINC000708208774 1121462879 /nfs/dbraw/zinc/46/28/79/1121462879.db2.gz QOBQUVPLODIATL-UHFFFAOYSA-N 1 0 294.807 3.669 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCC2(CCCC2)O1)c1ccccc1O ZINC000709496876 1121470616 /nfs/dbraw/zinc/47/06/16/1121470616.db2.gz BOWIYYZXVZHCMW-KBPBESRZSA-N 1 0 275.392 3.535 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)C1CCSCC1 ZINC000187117960 1121538297 /nfs/dbraw/zinc/53/82/97/1121538297.db2.gz VCPPVBUKHXYCCG-LBPRGKRZSA-N 1 0 296.455 3.513 20 10 CHCDRO CN(c1ccc(N)cc1)c1cccc(C[NH+]2CCCC2)c1 ZINC001176198194 1121571492 /nfs/dbraw/zinc/57/14/92/1121571492.db2.gz ZGATWMZRMIXIQU-UHFFFAOYSA-N 1 0 281.403 3.633 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCCO[C@H]2C(C)C)c(O)c1 ZINC000248517241 1121572877 /nfs/dbraw/zinc/57/28/77/1121572877.db2.gz PGJLGILSQLLRBW-MPGHIAIKSA-N 1 0 291.435 3.802 20 10 CHCDRO COc1cc(C)cc(C[NH2+]Cc2ccc(Cl)cc2)c1O ZINC000894161005 1121677947 /nfs/dbraw/zinc/67/79/47/1121677947.db2.gz QCFAFJWMORMURF-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO CC[C@H]1CCC[N@@H+]1Cc1c(O)ccc2ccc(OC)cc21 ZINC000727825266 1121750575 /nfs/dbraw/zinc/75/05/75/1121750575.db2.gz XMPMZAAUHCQWDE-AWEZNQCLSA-N 1 0 285.387 3.928 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H]2CC[C@H](C)C2)cc1F ZINC001177795469 1121750533 /nfs/dbraw/zinc/75/05/33/1121750533.db2.gz TWTYXUDSQLRBLS-ZFWWWQNUSA-N 1 0 278.415 3.950 20 10 CHCDRO CCOCCC1(C[NH2+]Cc2ccc(OC)c(C)c2)CCC1 ZINC001177986158 1121764136 /nfs/dbraw/zinc/76/41/36/1121764136.db2.gz VAMZNXISLKNDEU-UHFFFAOYSA-N 1 0 291.435 3.690 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C[C@@](C)(CC)OC)cc1F ZINC001178769289 1121814615 /nfs/dbraw/zinc/81/46/15/1121814615.db2.gz LAYPIQOOYAOVAR-QGZVFWFLSA-N 1 0 296.430 3.577 20 10 CHCDRO COc1ccc(C[NH2+]C2CC(C(C)(C)C)C2)cc1C ZINC001178809983 1121820113 /nfs/dbraw/zinc/82/01/13/1121820113.db2.gz BFMGNJFBQYJJQA-UHFFFAOYSA-N 1 0 261.409 3.918 20 10 CHCDRO CCCOc1ccc(C[NH2+]CCC2CC(OC)C2)cc1C ZINC001179142148 1121850145 /nfs/dbraw/zinc/85/01/45/1121850145.db2.gz AWFUDBWSODYNKJ-UHFFFAOYSA-N 1 0 291.435 3.689 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H]2[C@@H]3CCC[C@@H]32)cc1F ZINC001179266710 1121865730 /nfs/dbraw/zinc/86/57/30/1121865730.db2.gz WEQJRDYUTLYJKM-XOIINTDNSA-N 1 0 276.399 3.560 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H]2CC23CCCCC3)cc1F ZINC001179259703 1121866477 /nfs/dbraw/zinc/86/64/77/1121866477.db2.gz XBYNDLCEQIYRNQ-INIZCTEOSA-N 1 0 276.399 3.704 20 10 CHCDRO CCn1ccnc1C[N@H+](Cc1ccccc1O)C1CCCC1 ZINC000732204420 1121913160 /nfs/dbraw/zinc/91/31/60/1121913160.db2.gz KZOOSTXFXVZCDS-UHFFFAOYSA-N 1 0 299.418 3.553 20 10 CHCDRO CCc1cnccc1[C@H](C)[NH2+]Cc1ccc(N(C)CC)cc1 ZINC000773835484 1121914562 /nfs/dbraw/zinc/91/45/62/1121914562.db2.gz FWIMJHMKSBEEHW-HNNXBMFYSA-N 1 0 297.446 3.951 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@H+]1CCC[C@H](C)[C@@H]1C ZINC001179858353 1121915530 /nfs/dbraw/zinc/91/55/30/1121915530.db2.gz DBJLRRYTVWTFNH-ZFWWWQNUSA-N 1 0 260.425 3.681 20 10 CHCDRO C[C@H]([NH2+]C1CCC(F)(F)CC1)c1ccc(N(C)C)cc1 ZINC000688516760 1129020784 /nfs/dbraw/zinc/02/07/84/1129020784.db2.gz CWSYQVKIHZYAIG-LBPRGKRZSA-N 1 0 282.378 3.981 20 10 CHCDRO CCN(C)c1ccc(C[NH2+][C@@H](C)c2cnccc2C)cc1 ZINC000773840799 1121962270 /nfs/dbraw/zinc/96/22/70/1121962270.db2.gz QOQGVVPGIGNJTK-HNNXBMFYSA-N 1 0 283.419 3.697 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C/C=C\c2ccccc2)c1 ZINC000733326526 1121978410 /nfs/dbraw/zinc/97/84/10/1121978410.db2.gz IHVVKKVXHUPXFV-YVMONPNESA-N 1 0 253.345 3.504 20 10 CHCDRO COc1ccccc1C[N@H+](C)Cc1ccc(N(C)C)cc1C ZINC001180489212 1121990661 /nfs/dbraw/zinc/99/06/61/1121990661.db2.gz WSJCNYIBGBYDBY-UHFFFAOYSA-N 1 0 298.430 3.702 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C2CC2)[C@H]2C=CCCC2)cc1 ZINC000733609737 1122001099 /nfs/dbraw/zinc/00/10/99/1122001099.db2.gz HXASFAPXLMUONC-KRWDZBQOSA-N 1 0 270.420 3.826 20 10 CHCDRO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(O)cc2O)cc1 ZINC001204275659 1122001450 /nfs/dbraw/zinc/00/14/50/1122001450.db2.gz XWBQHJLPQFFNKY-KRWDZBQOSA-N 1 0 283.371 3.743 20 10 CHCDRO CC[C@H](CC(F)(F)F)[NH2+]Cc1ccc(Cl)cc1O ZINC001180602034 1122002475 /nfs/dbraw/zinc/00/24/75/1122002475.db2.gz FKZSRPGLKOHNBU-SNVBAGLBSA-N 1 0 281.705 3.866 20 10 CHCDRO CC(C)c1ccc(O)c(C[NH2+][C@@H]2CCO[C@@H](C3CC3)C2)c1 ZINC001180592364 1122003051 /nfs/dbraw/zinc/00/30/51/1122003051.db2.gz FIXVLEGWYDKNDQ-SJLPKXTDSA-N 1 0 289.419 3.563 20 10 CHCDRO C[C@H]1CC[N@H+](Cc2cc(F)c(N(C)C)cc2F)CC1(C)C ZINC001180673489 1122004360 /nfs/dbraw/zinc/00/43/60/1122004360.db2.gz OLAOFOVTMCWWLH-LBPRGKRZSA-N 1 0 296.405 3.899 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@H]1CC[C@H]1C1CCC1 ZINC001181446292 1122055877 /nfs/dbraw/zinc/05/58/77/1122055877.db2.gz XDHSVXFIKDRWMD-ROUUACIJSA-N 1 0 272.436 3.940 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H](c2ccccc2)N(C)C)c1 ZINC000192743759 1129032838 /nfs/dbraw/zinc/03/28/38/1129032838.db2.gz PMYXJPXITCBTPV-QAPCUYQASA-N 1 0 298.430 3.654 20 10 CHCDRO CSC1(C[N@H+](C)Cc2ccc(N3CCCC3)cc2)CC1 ZINC001181555410 1122063884 /nfs/dbraw/zinc/06/38/84/1122063884.db2.gz MIDJQNQOEYAZAP-UHFFFAOYSA-N 1 0 290.476 3.614 20 10 CHCDRO CCOC[C@@H]1CCCC[N@@H+]1Cc1c(O)cc(C)cc1Cl ZINC001182284857 1122130776 /nfs/dbraw/zinc/13/07/76/1122130776.db2.gz IXIIYQWPKPGIJO-ZDUSSCGKSA-N 1 0 297.826 3.745 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+][C@@H]1CC[C@H]1C1CCC1 ZINC001182684098 1122182895 /nfs/dbraw/zinc/18/28/95/1122182895.db2.gz JQSHMMCAZGMGIM-UONOGXRCSA-N 1 0 265.784 3.714 20 10 CHCDRO CC1(C)CCC[C@@H]1CC[NH2+]Cc1cc(F)ccc1O ZINC001183010438 1122199332 /nfs/dbraw/zinc/19/93/32/1122199332.db2.gz HNKJVJDDHXJFHJ-CYBMUJFWSA-N 1 0 265.372 3.837 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)C[C@@H]2CC2(C)C)c(Cl)c1 ZINC001183074291 1122201777 /nfs/dbraw/zinc/20/17/77/1122201777.db2.gz DIKSQLBZMIREMS-NSHDSACASA-N 1 0 267.800 3.832 20 10 CHCDRO COc1ccc(C[N@@H+]2CCC[C@@H]2c2cccs2)c(O)c1 ZINC000162717479 1122202871 /nfs/dbraw/zinc/20/28/71/1122202871.db2.gz PEOHLFCCAJHLAM-CQSZACIVSA-N 1 0 289.400 3.799 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCO[C@@H](C(C)(C)C)C1)c1ccccc1O ZINC000272803928 1122212930 /nfs/dbraw/zinc/21/29/30/1122212930.db2.gz BVOAYNYNDAAAAI-WOSRLPQWSA-N 1 0 277.408 3.637 20 10 CHCDRO C[C@@H](C[N@H+](C)Cc1c(O)cccc1Cl)c1nccs1 ZINC000273150053 1122222114 /nfs/dbraw/zinc/22/21/14/1122222114.db2.gz HKVCDFXDLKYUTO-JTQLQIEISA-N 1 0 296.823 3.738 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)cn1 ZINC000273382777 1122230358 /nfs/dbraw/zinc/23/03/58/1122230358.db2.gz IPWAUSOOGHTRLR-AWEZNQCLSA-N 1 0 296.414 3.825 20 10 CHCDRO COc1cc(C[NH2+]Cc2ccc(N(C)C)cc2C)ccc1C ZINC000774988669 1122379453 /nfs/dbraw/zinc/37/94/53/1122379453.db2.gz GYLBXJBGUNYRNL-UHFFFAOYSA-N 1 0 298.430 3.668 20 10 CHCDRO COc1ccc(C)cc1CC[NH2+][C@H](C)c1ccccc1O ZINC000183389819 1129051857 /nfs/dbraw/zinc/05/18/57/1129051857.db2.gz XCLFTOFSUBTIMN-CQSZACIVSA-N 1 0 285.387 3.603 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)c2ccccc2O)cc1F ZINC000183392982 1129051899 /nfs/dbraw/zinc/05/18/99/1129051899.db2.gz ZBTUWQJDOIFAOG-LBPRGKRZSA-N 1 0 259.324 3.691 20 10 CHCDRO COC[C@@H]1CCC[N@H+](Cc2cc(Cl)cc(C)c2O)CC1 ZINC000825321977 1122427296 /nfs/dbraw/zinc/42/72/96/1122427296.db2.gz TYIPKVXEYXMKPF-CYBMUJFWSA-N 1 0 297.826 3.603 20 10 CHCDRO Cc1cc(C)cc(C[N@@H+](C)Cc2cccc(C)c2O)c1 ZINC000775147302 1122443992 /nfs/dbraw/zinc/44/39/92/1122443992.db2.gz BFVKCIJKSNLWGY-UHFFFAOYSA-N 1 0 269.388 3.949 20 10 CHCDRO C[C@H]([NH2+]CC(C)(C)N1CCC[C@@H](C)C1)c1ccccc1O ZINC000183440728 1129055168 /nfs/dbraw/zinc/05/51/68/1129055168.db2.gz LNVZEIOCELZUAP-CABCVRRESA-N 1 0 290.451 3.553 20 10 CHCDRO C[C@H](C[NH2+][C@H](C)c1ccccc1O)COCc1ccccc1 ZINC000183459167 1129055848 /nfs/dbraw/zinc/05/58/48/1129055848.db2.gz VVXXUDUNAKKOMP-HZPDHXFCSA-N 1 0 299.414 3.896 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1c(F)cncc1F)c1ccccc1O ZINC000285826933 1122523857 /nfs/dbraw/zinc/52/38/57/1122523857.db2.gz XLSUEYXHHGOMSL-QMTHXVAHSA-N 1 0 292.329 3.867 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H]2CCCO[C@@H]2CC(C)C)cc1C ZINC000775372105 1122531455 /nfs/dbraw/zinc/53/14/55/1122531455.db2.gz RRGULRZBUDOIJA-FUHWJXTLSA-N 1 0 291.435 3.692 20 10 CHCDRO C[C@@H]([NH2+]C[C@H](C)Oc1ccc(F)cc1)c1ccccc1O ZINC000183534813 1129061017 /nfs/dbraw/zinc/06/10/17/1129061017.db2.gz NCXUOPGUMLUTJM-QWHCGFSZSA-N 1 0 289.350 3.649 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc(C)ccc1OC)c1ccccc1O ZINC000775413775 1122556006 /nfs/dbraw/zinc/55/60/06/1122556006.db2.gz AWYKSJSIBJQHHA-MRXNPFEDSA-N 1 0 285.387 3.950 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H]2C[C@H](SC)C2)cc1 ZINC001203288928 1122593135 /nfs/dbraw/zinc/59/31/35/1122593135.db2.gz HVPJPJWFYQJJES-KOMQPUFPSA-N 1 0 278.465 3.516 20 10 CHCDRO Cc1cc(C[N@@H+]2CC(C)(C)C2(C)C)ccc1N(C)C ZINC001191390892 1122595077 /nfs/dbraw/zinc/59/50/77/1122595077.db2.gz SCLZYFGFINSEEY-UHFFFAOYSA-N 1 0 260.425 3.681 20 10 CHCDRO CC[C@@H]([NH2+]Cc1c(C)noc1C)c1cc(Cl)ccc1O ZINC000775489770 1122620253 /nfs/dbraw/zinc/62/02/53/1122620253.db2.gz SBERKTNJKQQFQI-CQSZACIVSA-N 1 0 294.782 3.891 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)COc1ccccc1)c1ccccc1O ZINC000775495869 1122624386 /nfs/dbraw/zinc/62/43/86/1122624386.db2.gz DYECPANTQMFFKX-PBHICJAKSA-N 1 0 285.387 3.900 20 10 CHCDRO CC[C@H]([NH2+]CC(O)(CC)CC)c1cc(Cl)ccc1O ZINC000775496625 1122626563 /nfs/dbraw/zinc/62/65/63/1122626563.db2.gz LAXOQUBVLIAWDP-ZDUSSCGKSA-N 1 0 285.815 3.637 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](C)N(C)C1CC1)c1cc(Cl)ccc1O ZINC000775501739 1122628946 /nfs/dbraw/zinc/62/89/46/1122628946.db2.gz KTDWBYZGDNWZGU-ABAIWWIYSA-N 1 0 296.842 3.569 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1cnn(C(C)C)c1)c1ccccc1O ZINC000775503424 1122631054 /nfs/dbraw/zinc/63/10/54/1122631054.db2.gz IGQHUXGUUJAFGR-CZUORRHYSA-N 1 0 287.407 3.972 20 10 CHCDRO CC[C@H](C)[C@@](C)(O)C[NH2+][C@@H](CC)c1cc(Cl)ccc1O ZINC000775503608 1122631287 /nfs/dbraw/zinc/63/12/87/1122631287.db2.gz KSEDVZKPZXCNHT-PJODQICGSA-N 1 0 299.842 3.883 20 10 CHCDRO CC[C@@H]([NH2+]CC1CCC(OC)CC1)c1ccccc1O ZINC000775510902 1122633693 /nfs/dbraw/zinc/63/36/93/1122633693.db2.gz AOHZXAOJXIRXEE-ZBCRRDGASA-N 1 0 277.408 3.638 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)C1CCOCC1)c1cc(Cl)ccc1O ZINC000775514391 1122635756 /nfs/dbraw/zinc/63/57/56/1122635756.db2.gz USSYYNJNVLJBQC-IAQYHMDHSA-N 1 0 297.826 3.901 20 10 CHCDRO CC[C@@H]([NH2+]CC1Cc2ccccc2C1)c1ccccc1O ZINC000775523041 1122639318 /nfs/dbraw/zinc/63/93/18/1122639318.db2.gz DWCICNOTRONNIR-GOSISDBHSA-N 1 0 281.399 3.848 20 10 CHCDRO CC[C@H]([NH2+]CCC[C@@H]1CCCC[C@H]1O)c1ccccc1O ZINC000775522405 1122639542 /nfs/dbraw/zinc/63/95/42/1122639542.db2.gz OPOMBGJTTSAIEP-BHYGNILZSA-N 1 0 291.435 3.764 20 10 CHCDRO C1=CC[C@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000080123298 1129068055 /nfs/dbraw/zinc/06/80/55/1129068055.db2.gz UFSZURZIPRVTHZ-KRWDZBQOSA-N 1 0 270.420 3.875 20 10 CHCDRO CC[C@H]([NH2+][C@H](c1cccnc1)C1CC1)c1ccccc1O ZINC000775526629 1122643560 /nfs/dbraw/zinc/64/35/60/1122643560.db2.gz SKBALXZFDJCXLX-WMZOPIPTSA-N 1 0 282.387 3.979 20 10 CHCDRO CC[C@@H]([NH2+]CC(C)(C)C[C@@H](C)O)c1cc(Cl)ccc1O ZINC000775527707 1122644399 /nfs/dbraw/zinc/64/43/99/1122644399.db2.gz SQLCFLJYCFDGOR-BXUZGUMPSA-N 1 0 299.842 3.883 20 10 CHCDRO COCC1(CC[NH2+][C@H](C)c2cc(Cl)ccc2O)CCC1 ZINC000293635002 1122716001 /nfs/dbraw/zinc/71/60/01/1122716001.db2.gz GUIVITJSOSBSIF-GFCCVEGCSA-N 1 0 297.826 3.903 20 10 CHCDRO Cc1csc([C@@H](C)[NH2+][C@@H](C)c2cc(C)ccc2O)n1 ZINC000080270210 1129079519 /nfs/dbraw/zinc/07/95/19/1129079519.db2.gz DUMGTTJHONUXDT-NWDGAFQWSA-N 1 0 276.405 3.877 20 10 CHCDRO Cc1cccc(C[N@@H+]2CC[C@@H]2c2ccccc2)c1O ZINC000775633291 1122837271 /nfs/dbraw/zinc/83/72/71/1122837271.db2.gz HQKQDDSJUDJYEW-MRXNPFEDSA-N 1 0 253.345 3.648 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCSC[C@@H]2c2ccccc2)c1O ZINC000775650345 1122865161 /nfs/dbraw/zinc/86/51/61/1122865161.db2.gz YNRSZSYUDPHYCR-QGZVFWFLSA-N 1 0 299.439 3.991 20 10 CHCDRO Cc1cc(Cl)cc(C[NH+]2CCC(OC(C)C)CC2)c1O ZINC000775663558 1122875615 /nfs/dbraw/zinc/87/56/15/1122875615.db2.gz NKRNRJKDMIXTFW-UHFFFAOYSA-N 1 0 297.826 3.743 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2CCC[C@H]2C2CC2)c1O ZINC000775677154 1122901267 /nfs/dbraw/zinc/90/12/67/1122901267.db2.gz HYIOATRCGSAIDK-AWEZNQCLSA-N 1 0 265.784 3.728 20 10 CHCDRO CC[C@H](C)[C@@H](C)[N@H+](Cc1cc(OC)ccc1O)C1CC1 ZINC000775682508 1122901818 /nfs/dbraw/zinc/90/18/18/1122901818.db2.gz ZNJYCOGTWUHNEW-QWHCGFSZSA-N 1 0 277.408 3.800 20 10 CHCDRO CCC[C@@H](C)[C@H]1CCC[N@@H+]1Cc1cc(OC)ccc1O ZINC000775732057 1122928907 /nfs/dbraw/zinc/92/89/07/1122928907.db2.gz LORGETNJVBQSEM-CZUORRHYSA-N 1 0 277.408 3.801 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2C[C@H](C)CC2(C)C)cc1 ZINC001197360113 1122954189 /nfs/dbraw/zinc/95/41/89/1122954189.db2.gz UWZNKLBMLFQNAF-CQSZACIVSA-N 1 0 260.425 3.763 20 10 CHCDRO Cc1cc(Br)cc(C[NH2+]C2(C)CCCC2)c1O ZINC000775819447 1122980862 /nfs/dbraw/zinc/98/08/62/1122980862.db2.gz HTOIANOCBSSOHO-UHFFFAOYSA-N 1 0 298.224 3.885 20 10 CHCDRO CCOCc1cc(C[NH2+][C@@H]2CCCC[C@H]2C)ccc1OC ZINC001198959168 1123017550 /nfs/dbraw/zinc/01/75/50/1123017550.db2.gz JJUWPDSQQXSVFW-RHSMWYFYSA-N 1 0 291.435 3.900 20 10 CHCDRO CN(C)c1ccc(C[NH+]2CC3(C2)CCCCC3)cc1 ZINC001203937866 1123034199 /nfs/dbraw/zinc/03/41/99/1123034199.db2.gz WGFZOKHMWSSALP-UHFFFAOYSA-N 1 0 258.409 3.519 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCCC3(CC(F)C3)CC2)cc1 ZINC001203937882 1123034273 /nfs/dbraw/zinc/03/42/73/1123034273.db2.gz XEGWWQZBPFJDPH-UHFFFAOYSA-N 1 0 290.426 3.857 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@H]2CC=CCC2)c(Cl)c1 ZINC001199843510 1123042472 /nfs/dbraw/zinc/04/24/72/1123042472.db2.gz NVPSGOBLVBGGAO-LBPRGKRZSA-N 1 0 265.784 3.800 20 10 CHCDRO [O-]c1c(Cl)cccc1C[NH2+]Cc1ccc2ccccc2n1 ZINC000776085940 1123055037 /nfs/dbraw/zinc/05/50/37/1123055037.db2.gz ADCWKOQWUZGKEG-UHFFFAOYSA-N 1 0 298.773 3.884 20 10 CHCDRO COc1cccc(Cl)c1C[NH2+][C@@H](C)c1ccccc1O ZINC000188281453 1123056422 /nfs/dbraw/zinc/05/64/22/1123056422.db2.gz FUQAYSMZGHXYGZ-NSHDSACASA-N 1 0 291.778 3.905 20 10 CHCDRO CCC1(C[NH2+]C/C=C\c2ccc(N(C)C)cc2)CCC1 ZINC001200940987 1123066951 /nfs/dbraw/zinc/06/69/51/1123066951.db2.gz BVNJKUPXJAGTSG-ALCCZGGFSA-N 1 0 272.436 3.936 20 10 CHCDRO CC[C@@](C)([NH2+]Cc1cc(OC)ccc1O)c1ccccc1 ZINC000776179788 1123096559 /nfs/dbraw/zinc/09/65/59/1123096559.db2.gz YJYPAVVQDMVABK-GOSISDBHSA-N 1 0 285.387 3.816 20 10 CHCDRO CC[N@@H+](Cc1ccc(N(C)C)cc1)C[C@@H]1CC=CCC1 ZINC001201428518 1123100168 /nfs/dbraw/zinc/10/01/68/1123100168.db2.gz QMKRMOGOIMPZHI-MRXNPFEDSA-N 1 0 272.436 3.931 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C[C@H](C)c2ccc(F)cc2)c1 ZINC000776173740 1123101635 /nfs/dbraw/zinc/10/16/35/1123101635.db2.gz ILROGCVMFZSSCK-ZDUSSCGKSA-N 1 0 273.351 3.733 20 10 CHCDRO Cc1cc(O)c(C[NH+]2Cc3ccccc3C2)cc1C ZINC000106063276 1123122471 /nfs/dbraw/zinc/12/24/71/1123122471.db2.gz YMPOUWMFQHNXSX-UHFFFAOYSA-N 1 0 253.345 3.525 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2ccc[nH]2)cc1 ZINC001201833484 1123154315 /nfs/dbraw/zinc/15/43/15/1123154315.db2.gz QMRWAQAPPQYSHT-CQSZACIVSA-N 1 0 271.408 3.712 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+][C@H]2CCC(F)(F)C2)c1O ZINC000776251389 1123179477 /nfs/dbraw/zinc/17/94/77/1123179477.db2.gz GSGNJZZWSSFCNU-NSHDSACASA-N 1 0 275.726 3.631 20 10 CHCDRO CCc1cnccc1[C@@H](C)[NH2+]Cc1cccc(C)c1O ZINC000776255730 1123187673 /nfs/dbraw/zinc/18/76/73/1123187673.db2.gz HLDIKBPBDBCYKP-CYBMUJFWSA-N 1 0 270.376 3.509 20 10 CHCDRO Cc1ccc2cc(C[NH2+]Cc3ccc(N(C)C)cc3)[nH]c2c1 ZINC000850011730 1123237530 /nfs/dbraw/zinc/23/75/30/1123237530.db2.gz STSQLEQIHUKQGN-UHFFFAOYSA-N 1 0 293.414 3.832 20 10 CHCDRO CC1(C)C[C@H]([NH2+]Cc2cc(-c3ccccc3)ccc2O)CO1 ZINC000850341266 1123253595 /nfs/dbraw/zinc/25/35/95/1123253595.db2.gz DZCRVFWSPZCVDQ-KRWDZBQOSA-N 1 0 297.398 3.716 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]CCCOC(C)(C)C)cc1 ZINC000850369061 1123258643 /nfs/dbraw/zinc/25/86/43/1123258643.db2.gz GSYPPYNQUYSEDJ-VURMDHGXSA-N 1 0 290.451 3.561 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]C[C@@H]2C(C)(C)C2(F)F)cc1 ZINC000850394243 1123261609 /nfs/dbraw/zinc/26/16/09/1123261609.db2.gz NVDLJDMKBDLWDV-LLYBFZRZSA-N 1 0 294.389 3.647 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1CCN1C(C)(C)C)c1ccc(C)cc1O ZINC000850483547 1123274197 /nfs/dbraw/zinc/27/41/97/1123274197.db2.gz ZTXFDMOUZGJNTM-GOEBONIOSA-N 1 0 290.451 3.614 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CCN(C(C)(C)C)C2)c(O)c1 ZINC000850492643 1123274535 /nfs/dbraw/zinc/27/45/35/1123274535.db2.gz FOBSZEIAABTOSJ-LSDHHAIUSA-N 1 0 290.451 3.532 20 10 CHCDRO CC[C@H](COCC1CC1)[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000850495103 1123274979 /nfs/dbraw/zinc/27/49/79/1123274979.db2.gz WKCSYJQFSOKJRK-RHSMWYFYSA-N 1 0 290.451 3.608 20 10 CHCDRO CC[C@H](COCC1CC1)[NH2+][C@H](C)c1cc(C)ccc1O ZINC000850493858 1123275463 /nfs/dbraw/zinc/27/54/63/1123275463.db2.gz LOKYKDATOSLIPR-UKRRQHHQSA-N 1 0 277.408 3.556 20 10 CHCDRO Cc1ccncc1CC[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000850506335 1123275904 /nfs/dbraw/zinc/27/59/04/1123275904.db2.gz IYGIITASDCUEHU-LBPRGKRZSA-N 1 0 290.794 3.642 20 10 CHCDRO CSCC1(CC[NH2+][C@@H](C)c2ccccc2O)CC1 ZINC000850506098 1123276215 /nfs/dbraw/zinc/27/62/15/1123276215.db2.gz FNRFBWMOGZBRSV-LBPRGKRZSA-N 1 0 265.422 3.576 20 10 CHCDRO CC[C@H]([NH2+][C@H]1C=CCC1)c1cc(Cl)ccc1O ZINC000850510351 1123278277 /nfs/dbraw/zinc/27/82/77/1123278277.db2.gz SUDWVOKEVOCSAA-AAEUAGOBSA-N 1 0 251.757 3.805 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]Cc2cc(C)cc(C)c2)c1O ZINC000850522188 1123279984 /nfs/dbraw/zinc/27/99/84/1123279984.db2.gz HIZFSWZYAKGLNI-AWEZNQCLSA-N 1 0 285.387 3.868 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@H]2C[C@H](O)c3ccccc32)c(O)c1 ZINC000850524204 1123280996 /nfs/dbraw/zinc/28/09/96/1123280996.db2.gz ANMOGKFIWPTVQA-JQFCIGGWSA-N 1 0 297.398 3.838 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1COC2(CCC2)C1)c1ccc(N(C)C)cc1 ZINC000850524296 1123281382 /nfs/dbraw/zinc/28/13/82/1123281382.db2.gz GCKYPRPWEDKZEC-DOTOQJQBSA-N 1 0 288.435 3.505 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2C[C@H](O)c3ccccc32)c1 ZINC000850526394 1123281585 /nfs/dbraw/zinc/28/15/85/1123281585.db2.gz BUVJEQKCWRXCJU-IWEFOYFVSA-N 1 0 283.371 3.530 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2C[C@@H](O)c3ccccc32)c(O)c1 ZINC000850526967 1123282319 /nfs/dbraw/zinc/28/23/19/1123282319.db2.gz DHKSXDYRNMWKJG-BJOOFOGMSA-N 1 0 283.371 3.530 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+]CCc2ccoc2)c2c1c(F)ccc2O ZINC000850531528 1123284972 /nfs/dbraw/zinc/28/49/72/1123284972.db2.gz LGESARSSHVHUPV-MFKMUULPSA-N 1 0 275.323 3.505 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CCC(C)(C)F)c(O)c1 ZINC000850531311 1123285411 /nfs/dbraw/zinc/28/54/11/1123285411.db2.gz IYHUJNJQYAYXPR-GFCCVEGCSA-N 1 0 253.361 3.798 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCC[C@@H](C)O2)c(O)c1C ZINC000850533803 1123285765 /nfs/dbraw/zinc/28/57/65/1123285765.db2.gz CEZMQPPGXWRBKR-VHDGCEQUSA-N 1 0 277.408 3.617 20 10 CHCDRO C[C@@H]([NH2+]CCc1cn(C)c2ccccc12)c1ccccc1O ZINC000850533898 1123285816 /nfs/dbraw/zinc/28/58/16/1123285816.db2.gz DDGJADDCQIAHSM-CQSZACIVSA-N 1 0 294.398 3.777 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+]CCc2ccoc2)c1O ZINC000850532777 1123285845 /nfs/dbraw/zinc/28/58/45/1123285845.db2.gz XDZMDRHRTKWUHG-NSHDSACASA-N 1 0 279.767 3.840 20 10 CHCDRO COCc1csc(C[NH2+][C@H](C)c2cc(C)ccc2O)c1 ZINC000850533139 1123286115 /nfs/dbraw/zinc/28/61/15/1123286115.db2.gz RFYSTITVPZSCOR-GFCCVEGCSA-N 1 0 291.416 3.759 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC[C@]2(C)CC2(F)F)c(O)c1 ZINC000850537672 1123288005 /nfs/dbraw/zinc/28/80/05/1123288005.db2.gz WXTLHDDXDDVSSV-SMDDNHRTSA-N 1 0 269.335 3.787 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCc2ccc(O)cc21)c1ccc(N(C)C)cc1 ZINC000850543397 1123288712 /nfs/dbraw/zinc/28/87/12/1123288712.db2.gz IXIMFLDBEWRTPX-BFUOFWGJSA-N 1 0 296.414 3.796 20 10 CHCDRO CC[C@H]([NH2+]Cc1c(C2CCC2)cnn1C)c1ccccc1O ZINC000850550507 1123289193 /nfs/dbraw/zinc/28/91/93/1123289193.db2.gz NUEWZSPLEAXVKM-INIZCTEOSA-N 1 0 299.418 3.634 20 10 CHCDRO C[C@@H]1C[C@@H]([NH2+]C[C@H]2C(C)(C)C2(F)F)c2c1c(F)ccc2O ZINC000850552676 1123289968 /nfs/dbraw/zinc/28/99/68/1123289968.db2.gz PJDRAUJCGFZEMJ-UISBYWKRSA-N 1 0 299.336 3.961 20 10 CHCDRO CC[C@@H]([NH2+]CC1CCC(O)CC1)c1cc(Cl)ccc1O ZINC000850553699 1123290689 /nfs/dbraw/zinc/29/06/89/1123290689.db2.gz AVYGLUGQZMOACM-ABIUDSBCSA-N 1 0 297.826 3.637 20 10 CHCDRO CO[C@@H](C[NH2+][C@H]1CCc2cccc(O)c21)C1CCCCC1 ZINC000850569597 1123294600 /nfs/dbraw/zinc/29/46/00/1123294600.db2.gz KADRQYCTMDRBRO-RDJZCZTQSA-N 1 0 289.419 3.564 20 10 CHCDRO CC[C@H]([NH2+][C@H](c1ccccc1)[C@@H](C)O)c1ccccc1O ZINC000850582914 1123296000 /nfs/dbraw/zinc/29/60/00/1123296000.db2.gz HOTIWSBEYJPSRQ-SKDZVZGDSA-N 1 0 285.387 3.555 20 10 CHCDRO CC[C@H]([NH2+]Cc1cccc(OC)c1C)c1ccccc1O ZINC000850578322 1123296102 /nfs/dbraw/zinc/29/61/02/1123296102.db2.gz KRRBSCUJQTVYHW-INIZCTEOSA-N 1 0 285.387 3.950 20 10 CHCDRO CCN(C)c1ccccc1C[NH2+][C@@H](C)c1ccccc1O ZINC000783508132 1123388994 /nfs/dbraw/zinc/38/89/94/1123388994.db2.gz GNKDHEPCZCDQCT-AWEZNQCLSA-N 1 0 284.403 3.699 20 10 CHCDRO Cc1cc(C)cc(CC[NH2+][C@H](C)c2ccccc2O)c1 ZINC000783512918 1123408288 /nfs/dbraw/zinc/40/82/88/1123408288.db2.gz HCVZCEHTAWHZEE-OAHLLOKOSA-N 1 0 269.388 3.902 20 10 CHCDRO CCn1nccc1C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000853241457 1123428791 /nfs/dbraw/zinc/42/87/91/1123428791.db2.gz VKSISULCOOIVLX-ZDUSSCGKSA-N 1 0 295.386 3.613 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]C[C@@H]2C[C@H]2c2ccccc2)c1 ZINC000111397783 1123443237 /nfs/dbraw/zinc/44/32/37/1123443237.db2.gz FGPSCUJNLCNBEX-YJBOKZPZSA-N 1 0 297.398 3.684 20 10 CHCDRO CC[C@H]([NH2+]Cc1cccc(N)c1)c1ccc(N(C)C)cc1 ZINC000854217006 1123477872 /nfs/dbraw/zinc/47/78/72/1123477872.db2.gz GXFVITXWQLMCNO-SFHVURJKSA-N 1 0 283.419 3.576 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCc3cc(N)ccc32)c(O)c1 ZINC000854226892 1123478057 /nfs/dbraw/zinc/47/80/57/1123478057.db2.gz SBDJWBSGYQDJMN-SJKOYZFVSA-N 1 0 282.387 3.621 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCc2cc(N)ccc21)c1ccc(N(C)C)cc1 ZINC000854226945 1123478064 /nfs/dbraw/zinc/47/80/64/1123478064.db2.gz SQDQLNQDGLJZMG-BFUOFWGJSA-N 1 0 295.430 3.673 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]Cc2cccc(N)c2)c1O ZINC000854216047 1123478226 /nfs/dbraw/zinc/47/82/26/1123478226.db2.gz SJOKWFCYSRCDTG-LLVKDONJSA-N 1 0 290.794 3.787 20 10 CHCDRO Oc1ccccc1C[N@H+](C[C@@H]1CCC=CO1)C1CCCC1 ZINC000193932659 1129125834 /nfs/dbraw/zinc/12/58/34/1129125834.db2.gz RQNXEOKCOAAUGX-KRWDZBQOSA-N 1 0 287.403 3.830 20 10 CHCDRO Cc1cccc(C[NH2+][C@H]2CCc3c2cccc3F)c1O ZINC000895854342 1123522553 /nfs/dbraw/zinc/52/25/53/1123522553.db2.gz KGVFOFWOGXKFBP-INIZCTEOSA-N 1 0 271.335 3.617 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+](C)CC2CC(F)(F)C2)c1O ZINC001237686044 1129128161 /nfs/dbraw/zinc/12/81/61/1129128161.db2.gz GDWLMTSXHCTDRT-UHFFFAOYSA-N 1 0 289.753 3.831 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]CC[C@H]1CC1(Cl)Cl)CC2 ZINC000857080442 1123585060 /nfs/dbraw/zinc/58/50/60/1123585060.db2.gz GMZPYJFFPITURH-WDEREUQCSA-N 1 0 286.202 3.553 20 10 CHCDRO CC[C@H]([NH2+]CC[C@@H]1CC1(F)F)c1ccc(N(C)C)cc1 ZINC000857082198 1123585579 /nfs/dbraw/zinc/58/55/79/1123585579.db2.gz URSJRLZSOYGBIT-HIFRSBDPSA-N 1 0 282.378 3.839 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](c1ccccn1)C1CC1 ZINC000896609395 1123605255 /nfs/dbraw/zinc/60/52/55/1123605255.db2.gz NGTGVISBQXBOKF-LJQANCHMSA-N 1 0 295.430 3.697 20 10 CHCDRO CCOc1cccc(C[NH2+]Cc2ccc(N(C)C)cc2C)c1 ZINC000115629247 1123619846 /nfs/dbraw/zinc/61/98/46/1123619846.db2.gz XCVORNWJYYNDFS-UHFFFAOYSA-N 1 0 298.430 3.750 20 10 CHCDRO C[C@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)c1ccccc1 ZINC000858086655 1123629764 /nfs/dbraw/zinc/62/97/64/1123629764.db2.gz LXEBPPPKWBVMDU-LBPRGKRZSA-N 1 0 290.357 3.882 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CCC[C@H](C)[C@@H]2C)c1O ZINC000228631310 1123634127 /nfs/dbraw/zinc/63/41/27/1123634127.db2.gz UOJRBWXJCDTQKG-QWRGUYRKSA-N 1 0 283.799 3.675 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CCC[C@@H](C)CC2)c1O ZINC000228631210 1123634459 /nfs/dbraw/zinc/63/44/59/1123634459.db2.gz HLIBFECXFGVBKI-LLVKDONJSA-N 1 0 283.799 3.676 20 10 CHCDRO CC[C@@H]1CCC[N@H+](Cc2cc(Cl)cc(OC)c2O)C1 ZINC000228630092 1123634500 /nfs/dbraw/zinc/63/45/00/1123634500.db2.gz XNMFLNZZYHFXNK-LLVKDONJSA-N 1 0 283.799 3.676 20 10 CHCDRO C[C@@H]([NH2+]CCCSc1nccs1)[C@@H]1C[C@H]1C1CC1 ZINC000858141696 1123634611 /nfs/dbraw/zinc/63/46/11/1123634611.db2.gz QTQVBPYFJWOAKV-WXHSDQCUSA-N 1 0 282.478 3.650 20 10 CHCDRO COc1c(C)cc(C[NH2+]Cc2cc(C)ccc2O)cc1C ZINC000858237685 1123639130 /nfs/dbraw/zinc/63/91/30/1123639130.db2.gz OQYWPWSKEYDYET-UHFFFAOYSA-N 1 0 285.387 3.616 20 10 CHCDRO CSc1ccc(C[NH2+]Cc2cc(C)ccc2O)s1 ZINC000858239279 1123639204 /nfs/dbraw/zinc/63/92/04/1123639204.db2.gz KTQXOUPRNOBXBE-UHFFFAOYSA-N 1 0 279.430 3.774 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2cc(C)ccc2O)c(Cl)c1 ZINC000858239375 1123639483 /nfs/dbraw/zinc/63/94/83/1123639483.db2.gz MSIVTWJYAOACBD-UHFFFAOYSA-N 1 0 275.779 3.952 20 10 CHCDRO Oc1ccccc1C[NH2+]Cc1ccccc1CC(F)(F)F ZINC000858330255 1123645868 /nfs/dbraw/zinc/64/58/68/1123645868.db2.gz MIKMEOPWSXETFO-UHFFFAOYSA-N 1 0 295.304 3.787 20 10 CHCDRO Cc1ccc(C(C)(C)C[NH2+][C@H](C)c2ccccc2O)nc1 ZINC000858487591 1123657484 /nfs/dbraw/zinc/65/74/84/1123657484.db2.gz CNLXOPRLLZLDNH-CQSZACIVSA-N 1 0 284.403 3.724 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CO[C@@H](C2CC2)C1)c1cc(Cl)ccc1O ZINC000858547931 1123661644 /nfs/dbraw/zinc/66/16/44/1123661644.db2.gz PMBBZLVKFDWNIU-IVMMDQJWSA-N 1 0 295.810 3.654 20 10 CHCDRO CCCC[N@H+](Cc1ccnc(F)c1)Cc1ccccc1O ZINC000859296611 1123694172 /nfs/dbraw/zinc/69/41/72/1123694172.db2.gz MBYOIGUPRCMJLD-UHFFFAOYSA-N 1 0 288.366 3.729 20 10 CHCDRO CCc1cccc(C[NH2+][C@H]2CCSC3(CCC3)C2)c1O ZINC000896950614 1123792542 /nfs/dbraw/zinc/79/25/42/1123792542.db2.gz GFGVFFLLXKTUQZ-HNNXBMFYSA-N 1 0 291.460 3.863 20 10 CHCDRO CCC[N@H+](Cc1cccc2n[nH]cc21)Cc1ccccc1O ZINC000862237389 1123794004 /nfs/dbraw/zinc/79/40/04/1123794004.db2.gz NLMDCYSUIFCAHL-UHFFFAOYSA-N 1 0 295.386 3.681 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H]2CCC(F)(F)C2)cc1 ZINC000777240905 1123796451 /nfs/dbraw/zinc/79/64/51/1123796451.db2.gz FERBNARPYRHRIH-JSGCOSHPSA-N 1 0 282.378 3.981 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)C1CC(F)(F)C1 ZINC000862280140 1123798128 /nfs/dbraw/zinc/79/81/28/1123798128.db2.gz WNNHFPZFSDHDBP-GFCCVEGCSA-N 1 0 282.378 3.584 20 10 CHCDRO CCCC[N@H+](Cc1nc(C)c(C)[nH]1)Cc1ccccc1O ZINC000862354906 1123801191 /nfs/dbraw/zinc/80/11/91/1123801191.db2.gz AECYHCRTBYOPPM-UHFFFAOYSA-N 1 0 287.407 3.534 20 10 CHCDRO CN(C)c1ccc(/C=C\Cn2cnc3c2CCCC3)cc1 ZINC000862432285 1123808654 /nfs/dbraw/zinc/80/86/54/1123808654.db2.gz XUCDQUWXVFCNQI-WAYWQWQTSA-N 1 0 281.403 3.541 20 10 CHCDRO Cc1cccc(C[NH2+]CC2(C(F)(F)F)CCCC2)c1O ZINC000862536271 1123816145 /nfs/dbraw/zinc/81/61/45/1123816145.db2.gz JAFKMRXZCTXGNE-UHFFFAOYSA-N 1 0 287.325 3.913 20 10 CHCDRO CCC(O)(CC)C[N@H+](C)Cc1ccc2ccccc2c1O ZINC000862538687 1123818150 /nfs/dbraw/zinc/81/81/50/1123818150.db2.gz CPNHVNMDZFUDRE-UHFFFAOYSA-N 1 0 287.403 3.528 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CCC[C@@H]2C[C@@H]21)c1ccc(C)cc1O ZINC000840819124 1123827578 /nfs/dbraw/zinc/82/75/78/1123827578.db2.gz FDJPVAWDBGYCRH-BVUBDWEXSA-N 1 0 259.393 3.930 20 10 CHCDRO CCCCOCCC[NH2+][C@@H](CC)c1ccccc1O ZINC000119120206 1123831186 /nfs/dbraw/zinc/83/11/86/1123831186.db2.gz BYZYTZSGMVQXIL-HNNXBMFYSA-N 1 0 265.397 3.640 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](C)CCOC)c1cc(Cl)ccc1O ZINC000840836222 1123838304 /nfs/dbraw/zinc/83/83/04/1123838304.db2.gz VWEFAKUCUYVICX-BXUZGUMPSA-N 1 0 285.815 3.759 20 10 CHCDRO CC[C@H]([NH2+]Cc1cccc(C)c1O)c1ccccc1 ZINC000083411184 1129149939 /nfs/dbraw/zinc/14/99/39/1129149939.db2.gz BJXRMVJYECTNIQ-INIZCTEOSA-N 1 0 255.361 3.942 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](C)[C@H](C)c2ccccc2)c1 ZINC000119380991 1123858728 /nfs/dbraw/zinc/85/87/28/1123858728.db2.gz SALXSSZFKOMOMW-CQSZACIVSA-N 1 0 285.387 3.984 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CC3(CCC3)C[C@H]2C)c1O ZINC000763644825 1129150762 /nfs/dbraw/zinc/15/07/62/1129150762.db2.gz ADRZVTADAVHPDK-LLVKDONJSA-N 1 0 295.810 3.819 20 10 CHCDRO CO[C@@H](C)C1C[NH+](Cc2cc(C)n(-c3ccccc3)c2C)C1 ZINC001137859206 1123881990 /nfs/dbraw/zinc/88/19/90/1123881990.db2.gz NQUGGIWTAMGXCT-INIZCTEOSA-N 1 0 298.430 3.561 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CC(C)(C)OCC2CC2)c1 ZINC000840875467 1123888955 /nfs/dbraw/zinc/88/89/55/1123888955.db2.gz FOYXUHGYSHAWLI-CYBMUJFWSA-N 1 0 277.408 3.556 20 10 CHCDRO CC[C@H](C[NH2+][C@H](CC)c1ccc(C)cc1O)N1CCCC1 ZINC000794797002 1123949792 /nfs/dbraw/zinc/94/97/92/1123949792.db2.gz LPKLNEDHEKQQBB-NVXWUHKLSA-N 1 0 290.451 3.616 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](C)N1CCCCC1)c1ccc(C)cc1O ZINC000794798639 1123950367 /nfs/dbraw/zinc/95/03/67/1123950367.db2.gz XNKVGSIDHHKRGE-DOTOQJQBSA-N 1 0 290.451 3.616 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](C)N1CCCCC1)c1ccc(C)cc1O ZINC000794798642 1123950387 /nfs/dbraw/zinc/95/03/87/1123950387.db2.gz XNKVGSIDHHKRGE-WBVHZDCISA-N 1 0 290.451 3.616 20 10 CHCDRO CC[C@@H]([NH2+]CC1CCC(OC)CC1)c1ccc(C)cc1O ZINC000794802109 1123950431 /nfs/dbraw/zinc/95/04/31/1123950431.db2.gz MTJNADOQNUAQDI-VMBOVVBDSA-N 1 0 291.435 3.947 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](OC)C(C)(C)C)c1ccc(C)cc1O ZINC000794802983 1123953096 /nfs/dbraw/zinc/95/30/96/1123953096.db2.gz PBFLCJPGONMPAG-GDBMZVCRSA-N 1 0 279.424 3.802 20 10 CHCDRO CC[C@H]([NH2+]C(C1CC1)C1CC1)c1ccc(C)cc1O ZINC000794804584 1123953163 /nfs/dbraw/zinc/95/31/63/1123953163.db2.gz VDWUERMIXLWQSS-HNNXBMFYSA-N 1 0 259.393 3.930 20 10 CHCDRO CC[C@H]([NH2+]Cc1scnc1C)c1ccc(C)cc1O ZINC000794807245 1123953888 /nfs/dbraw/zinc/95/38/88/1123953888.db2.gz LEGCMFSZOYZRQI-ZDUSSCGKSA-N 1 0 276.405 3.706 20 10 CHCDRO CC[C@H]([NH2+][C@@H](CC)C1CCOCC1)c1ccc(C)cc1O ZINC000794805612 1123955307 /nfs/dbraw/zinc/95/53/07/1123955307.db2.gz XWHSDGDQYFVWKB-IRXDYDNUSA-N 1 0 291.435 3.947 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](O)c1ccccc1C)c1ccc(C)cc1O ZINC000794806394 1123955312 /nfs/dbraw/zinc/95/53/12/1123955312.db2.gz IGRZQFFERPBBPV-IEBWSBKVSA-N 1 0 299.414 3.783 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CCC(F)(F)C1)c1ccc(C)cc1O ZINC000794815566 1123957209 /nfs/dbraw/zinc/95/72/09/1123957209.db2.gz WJYJNXDGDXEEIL-DGCLKSJQSA-N 1 0 269.335 3.929 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccc(C)nc1)c1ccc(C)cc1O ZINC000794809117 1123957554 /nfs/dbraw/zinc/95/75/54/1123957554.db2.gz QKJSMQBMMSOSIV-KRWDZBQOSA-N 1 0 284.403 3.687 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)COC2)c1ccc(C)cc1O ZINC000794819669 1123961492 /nfs/dbraw/zinc/96/14/92/1123961492.db2.gz XDWZSUMFPRDXRM-GOSISDBHSA-N 1 0 297.398 3.972 20 10 CHCDRO COC1(C[NH2+][C@H](C)c2cc(C)ccc2O)CCC(C)CC1 ZINC000794834483 1123965253 /nfs/dbraw/zinc/96/52/53/1123965253.db2.gz NVKPTDRYPZNSIU-NSWWBONSSA-N 1 0 291.435 3.947 20 10 CHCDRO Cc1cc(N[C@@H](C)c2ccc(N(C)C)cc2)cc[nH+]1 ZINC000302449282 1123968323 /nfs/dbraw/zinc/96/83/23/1123968323.db2.gz NHIAYMBAIDSBBA-ZDUSSCGKSA-N 1 0 255.365 3.629 20 10 CHCDRO CC(C)(C)Oc1cccc(C[NH2+]Cc2ccccc2O)c1 ZINC000865443285 1123985623 /nfs/dbraw/zinc/98/56/23/1123985623.db2.gz ZWPRBUPZMBOQTO-UHFFFAOYSA-N 1 0 285.387 3.859 20 10 CHCDRO Cc1cc(C[NH2+]Cc2ccc(N(C)C)cc2C)c(C)o1 ZINC000120598321 1123989577 /nfs/dbraw/zinc/98/95/77/1123989577.db2.gz BNQZUPYIRWKRLQ-UHFFFAOYSA-N 1 0 272.392 3.561 20 10 CHCDRO CCOCc1cc(C[NH2+][C@@H]2CCCC[C@@H]2F)ccc1OC ZINC000865698728 1124005608 /nfs/dbraw/zinc/00/56/08/1124005608.db2.gz GOBJOTYOSGGWFN-JKSUJKDBSA-N 1 0 295.398 3.602 20 10 CHCDRO COc1ccc2c(c1)CC[C@@H]2[NH2+]Cc1ccc(N(C)C)cc1 ZINC000866218539 1124038294 /nfs/dbraw/zinc/03/82/94/1124038294.db2.gz RBXAGYIRKSCVAS-IBGZPJMESA-N 1 0 296.414 3.538 20 10 CHCDRO CCC[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cc(C)ccn1 ZINC000866252624 1124042726 /nfs/dbraw/zinc/04/27/26/1124042726.db2.gz MIFWKAHCYPNQLA-KRWDZBQOSA-N 1 0 296.414 3.956 20 10 CHCDRO C[C@H]1C[C@@H]([NH2+]Cc2ccc3ccccc3c2O)CS1 ZINC000840958948 1124042983 /nfs/dbraw/zinc/04/29/83/1124042983.db2.gz POTYWRHVJNRHKI-SMDDNHRTSA-N 1 0 273.401 3.529 20 10 CHCDRO CCC[C@H](CCO)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000866414757 1124064743 /nfs/dbraw/zinc/06/47/43/1124064743.db2.gz KKPDLQKPWVHRRL-DZGCQCFKSA-N 1 0 287.403 3.747 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCCC[C@@H]2F)c(O)c1 ZINC000866449745 1124066131 /nfs/dbraw/zinc/06/61/31/1124066131.db2.gz GXMYZSUXQFUHTE-KWCYVHTRSA-N 1 0 251.345 3.632 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCCC[C@@H]2F)c(O)c1 ZINC000866449744 1124066960 /nfs/dbraw/zinc/06/69/60/1124066960.db2.gz GXMYZSUXQFUHTE-FPMFFAJLSA-N 1 0 251.345 3.632 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1cnc(C)s1)c1ccccc1O ZINC000866456237 1124068465 /nfs/dbraw/zinc/06/84/65/1124068465.db2.gz XMWMNXGOQHCXJF-MFKMUULPSA-N 1 0 276.405 3.959 20 10 CHCDRO C[C@H]([NH2+]CC1([C@@H]2CCCCO2)CCC1)c1ccccc1O ZINC000866480627 1124070790 /nfs/dbraw/zinc/07/07/90/1124070790.db2.gz GNJYAKDBQHCUQL-YOEHRIQHSA-N 1 0 289.419 3.782 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCC23CCOCC3)c(O)c1 ZINC000866529661 1124078490 /nfs/dbraw/zinc/07/84/90/1124078490.db2.gz RJXDFCMBXDFFCP-HUUCEWRRSA-N 1 0 289.419 3.558 20 10 CHCDRO C[C@H]([NH2+][C@H](CF)c1ccc(F)cc1)c1ccccc1O ZINC000866597213 1124085790 /nfs/dbraw/zinc/08/57/90/1124085790.db2.gz ZDVBBEOXCJWVFN-XHDPSFHLSA-N 1 0 277.314 3.893 20 10 CHCDRO C[C@H]([NH2+]C1([C@@H]2CCCCO2)CCC1)c1ccccc1O ZINC000866623092 1124091059 /nfs/dbraw/zinc/09/10/59/1124091059.db2.gz RYIGPSCHCZOKDR-BBRMVZONSA-N 1 0 275.392 3.535 20 10 CHCDRO CC[C@H](C[C@H](C)O)[NH2+][C@H](C)c1cc(Cl)cc(C)c1O ZINC000866632680 1124091784 /nfs/dbraw/zinc/09/17/84/1124091784.db2.gz BDAJYNPXXVYDTC-DMDPSCGWSA-N 1 0 285.815 3.554 20 10 CHCDRO CCC[C@H]1CCCC[N@@H+]1Cc1cc(OC)c(OC)cc1O ZINC000184233263 1129177532 /nfs/dbraw/zinc/17/75/32/1129177532.db2.gz WDNHNJAAKHGTPS-AWEZNQCLSA-N 1 0 293.407 3.564 20 10 CHCDRO CCc1ccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)o1 ZINC000122486020 1124504115 /nfs/dbraw/zinc/50/41/15/1124504115.db2.gz XXXCHXHDBNAUSN-GFCCVEGCSA-N 1 0 290.382 3.898 20 10 CHCDRO Cc1c[nH+]ccc1NCc1ccc(N2CCC(C)CC2)cc1 ZINC000795093754 1124527152 /nfs/dbraw/zinc/52/71/52/1124527152.db2.gz RSJMKYDOKKTCCQ-UHFFFAOYSA-N 1 0 295.430 3.660 20 10 CHCDRO c1cc(N2CCCCC2)ccc1C[NH2+]CCC1CCC1 ZINC000123006612 1124550869 /nfs/dbraw/zinc/55/08/69/1124550869.db2.gz IMOZCNOXTQHDKK-UHFFFAOYSA-N 1 0 272.436 3.957 20 10 CHCDRO CC(C)([NH2+]Cc1ccc(N)cc1)c1ccc(F)cc1F ZINC001120372062 1131275035 /nfs/dbraw/zinc/27/50/35/1131275035.db2.gz YFFLBEAZFWQONP-UHFFFAOYSA-N 1 0 276.330 3.572 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1ccc(N(C)C)cc1)[C@@H]1CCCOC1 ZINC000872064426 1124672509 /nfs/dbraw/zinc/67/25/09/1124672509.db2.gz YSEIVTVGMZYWET-KYJSFNMBSA-N 1 0 290.451 3.608 20 10 CHCDRO CC(C)OC1(C[NH2+][C@@H](C)c2cc(F)ccc2O)CCC1 ZINC000872114946 1124687150 /nfs/dbraw/zinc/68/71/50/1124687150.db2.gz FGOJBEQQOOSILA-LBPRGKRZSA-N 1 0 281.371 3.530 20 10 CHCDRO Cc1nccnc1[C@@H](C)[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000872132360 1124691702 /nfs/dbraw/zinc/69/17/02/1124691702.db2.gz FFJWYZHNCOFLNA-MWLCHTKSSA-N 1 0 291.782 3.556 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2nccnc2C)c(O)c1C ZINC000872134332 1124692533 /nfs/dbraw/zinc/69/25/33/1124692533.db2.gz RKVKNYSNZZOGPI-OCCSQVGLSA-N 1 0 285.391 3.519 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCC[C@H](OC3CCC3)CC2)c1 ZINC000872262124 1124702109 /nfs/dbraw/zinc/70/21/09/1124702109.db2.gz QDHUSCDMNKWFOZ-KRWDZBQOSA-N 1 0 289.419 3.624 20 10 CHCDRO CCCOc1ccc(C[NH2+][C@H]2CCCn3nccc32)cc1C ZINC000873152542 1124742589 /nfs/dbraw/zinc/74/25/89/1124742589.db2.gz STOXIEHXYGOXOW-INIZCTEOSA-N 1 0 299.418 3.605 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccccc1O)c1ccc(C(F)(F)F)nc1 ZINC000873184545 1124746730 /nfs/dbraw/zinc/74/67/30/1124746730.db2.gz DHUGITSTAAYCFN-SNVBAGLBSA-N 1 0 296.292 3.657 20 10 CHCDRO C[C@H]([NH2+]CC[C@@H]1CNc2ccccc21)c1ccccc1O ZINC000873236880 1124752423 /nfs/dbraw/zinc/75/24/23/1124752423.db2.gz JYFASCWDWIXKLR-UONOGXRCSA-N 1 0 282.387 3.642 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]CC[C@H]1CNc3ccccc31)CC2 ZINC000873238274 1124755414 /nfs/dbraw/zinc/75/54/14/1124755414.db2.gz YWYXDRDEDIKEOW-WMLDXEAASA-N 1 0 294.398 3.569 20 10 CHCDRO C[C@H]([NH2+]C1CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000020550937 1124850006 /nfs/dbraw/zinc/85/00/06/1124850006.db2.gz VVDGCXCZWFLNBF-LBPRGKRZSA-N 1 0 262.372 3.629 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)CCC(C)C)c1 ZINC000020560539 1124852436 /nfs/dbraw/zinc/85/24/36/1124852436.db2.gz UYWBCQBAQFRXEK-CHWSQXEVSA-N 1 0 265.397 3.876 20 10 CHCDRO CCC1CCC([NH2+]Cc2ccc(N(C)C)cc2)CC1 ZINC000021008344 1124891315 /nfs/dbraw/zinc/89/13/15/1124891315.db2.gz RYMJRQUJBYFSKX-UHFFFAOYSA-N 1 0 260.425 3.811 20 10 CHCDRO CCC(CC)[C@@H](C[NH2+][C@@H](CC)c1ccccc1O)N(C)C ZINC000021036357 1124893571 /nfs/dbraw/zinc/89/35/71/1124893571.db2.gz WHNCVMAIPKREHR-DLBZAZTESA-N 1 0 292.467 3.799 20 10 CHCDRO Cc1ccc(C[NH+]2CCC(OCCC(C)C)CC2)c(O)c1 ZINC000876620601 1124966204 /nfs/dbraw/zinc/96/62/04/1124966204.db2.gz QGHKPIXYQNDTPW-UHFFFAOYSA-N 1 0 291.435 3.728 20 10 CHCDRO Cc1cccc(O)c1C[NH2+][C@@H]1CCCc2ccccc21 ZINC000876884544 1124986725 /nfs/dbraw/zinc/98/67/25/1124986725.db2.gz CNNNMOUKAFHTTQ-QGZVFWFLSA-N 1 0 267.372 3.868 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]Cc1ccc([C@@H]2C[C@H]2C)o1 ZINC000876945614 1124991639 /nfs/dbraw/zinc/99/16/39/1124991639.db2.gz GLKSEFPUONIZKE-TZMCWYRMSA-N 1 0 271.360 3.707 20 10 CHCDRO Cc1cccc(O)c1C[NH2+][C@@H]1CCOc2c(C)cccc21 ZINC000876994363 1124995227 /nfs/dbraw/zinc/99/52/27/1124995227.db2.gz FXUDIMIETBQXHC-MRXNPFEDSA-N 1 0 283.371 3.622 20 10 CHCDRO Cc1csc(CCCC[NH2+]Cc2ccc(C)cc2O)n1 ZINC000877003167 1124996443 /nfs/dbraw/zinc/99/64/43/1124996443.db2.gz NOXKYXLTBPVPSO-UHFFFAOYSA-N 1 0 290.432 3.578 20 10 CHCDRO Cc1ccc(C[NH2+][C@H]2CCc3ccc(F)cc32)c(O)c1 ZINC000877015006 1124997683 /nfs/dbraw/zinc/99/76/83/1124997683.db2.gz DFTVLGIZFQYARG-INIZCTEOSA-N 1 0 271.335 3.617 20 10 CHCDRO Cc1cnc([C@H]([NH2+]Cc2ccc(C)cc2O)C2CC2)s1 ZINC000877064407 1125003037 /nfs/dbraw/zinc/00/30/37/1125003037.db2.gz SGKAFSZQIHZUDB-OAHLLOKOSA-N 1 0 288.416 3.706 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](c2ccccc2)[C@@H]2CCOC2)c(O)c1 ZINC000877133652 1125014196 /nfs/dbraw/zinc/01/41/96/1125014196.db2.gz FUJLSVVXKLLCPK-IEBWSBKVSA-N 1 0 297.398 3.568 20 10 CHCDRO Cc1nc2c(s1)[C@@H]([NH2+]Cc1ccc(C)cc1O)CCC2 ZINC000877183099 1125019444 /nfs/dbraw/zinc/01/94/44/1125019444.db2.gz YCARUOWYSDEZQS-ZDUSSCGKSA-N 1 0 288.416 3.633 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2ccc(C(F)F)cc2)c(O)c1 ZINC000877376586 1125023546 /nfs/dbraw/zinc/02/35/46/1125023546.db2.gz URMLEXIBIYYMAD-UHFFFAOYSA-N 1 0 277.314 3.928 20 10 CHCDRO CCCC[N@H+](Cc1ccns1)Cc1ccccc1O ZINC000877503635 1125037133 /nfs/dbraw/zinc/03/71/33/1125037133.db2.gz RZIALGXENFZSRW-UHFFFAOYSA-N 1 0 276.405 3.651 20 10 CHCDRO CC[N@H+](Cc1ccc(C)cc1O)[C@@H](C)c1cccnc1 ZINC000877532190 1125040410 /nfs/dbraw/zinc/04/04/10/1125040410.db2.gz SUECZHVKRJBVCS-AWEZNQCLSA-N 1 0 270.376 3.679 20 10 CHCDRO C[C@H](C[N@@H+]1Cc2cccc(O)c2C1)c1ccccc1 ZINC000877702964 1125066509 /nfs/dbraw/zinc/06/65/09/1125066509.db2.gz MLRZJTWCALLCEX-CYBMUJFWSA-N 1 0 253.345 3.512 20 10 CHCDRO C[C@@H]([NH2+]Cc1cccc2c1CCC2)c1ccccc1O ZINC000877756012 1125071400 /nfs/dbraw/zinc/07/14/00/1125071400.db2.gz YKEDDOVRXKLTJT-CYBMUJFWSA-N 1 0 267.372 3.732 20 10 CHCDRO COc1cccc(C)c1C[NH2+][C@H](C)c1ccccc1O ZINC000877755626 1125072031 /nfs/dbraw/zinc/07/20/31/1125072031.db2.gz INSIUQSANBNDHY-CYBMUJFWSA-N 1 0 271.360 3.560 20 10 CHCDRO CCc1cccc(F)c1C[NH2+][C@H](C)c1ccccc1O ZINC000877755591 1125072044 /nfs/dbraw/zinc/07/20/44/1125072044.db2.gz HLQCISASLILKER-GFCCVEGCSA-N 1 0 273.351 3.945 20 10 CHCDRO CCn1nc(C[NH2+][C@H](C)c2ccccc2O)c2ccccc21 ZINC000877755890 1125072863 /nfs/dbraw/zinc/07/28/63/1125072863.db2.gz RDSKURFHDFKSHH-CYBMUJFWSA-N 1 0 295.386 3.613 20 10 CHCDRO CCc1cccc(C[NH2+][C@H](CF)c2ccc(F)cc2)c1O ZINC000877758472 1125073931 /nfs/dbraw/zinc/07/39/31/1125073931.db2.gz CEMVJHAIUBEORU-MRXNPFEDSA-N 1 0 291.341 3.894 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](CF)c2ccc(F)cc2)c(O)c1 ZINC000877758525 1125074058 /nfs/dbraw/zinc/07/40/58/1125074058.db2.gz HFCOJXHNFWQPPU-HNNXBMFYSA-N 1 0 277.314 3.640 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCC2(CCC2)O1)c1ccc(N(C)C)cc1 ZINC000878454715 1125154921 /nfs/dbraw/zinc/15/49/21/1125154921.db2.gz GXNYHDJGWSKWLX-RHSMWYFYSA-N 1 0 288.435 3.505 20 10 CHCDRO CC[C@H]([NH2+]Cc1cccc(C)n1)c1ccc(N(C)C)cc1 ZINC000127264216 1125170719 /nfs/dbraw/zinc/17/07/19/1125170719.db2.gz DQPIVKLXAVVCJV-SFHVURJKSA-N 1 0 283.419 3.697 20 10 CHCDRO CCCc1ncc(C[NH2+]Cc2cc(Cl)c(C)cc2O)o1 ZINC000826089602 1125193738 /nfs/dbraw/zinc/19/37/38/1125193738.db2.gz KTPKAAVIHAPHAB-UHFFFAOYSA-N 1 0 294.782 3.584 20 10 CHCDRO CCC(CC)n1ccc(C[NH2+][C@H](C)c2ccccc2O)n1 ZINC000879648949 1125222662 /nfs/dbraw/zinc/22/26/62/1125222662.db2.gz GUOWEVWTXODHGQ-CYBMUJFWSA-N 1 0 287.407 3.801 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(CF)cc1)c1ccccc1O ZINC000879648811 1125222720 /nfs/dbraw/zinc/22/27/20/1125222720.db2.gz APFGJWRLSQIAPO-GFCCVEGCSA-N 1 0 259.324 3.713 20 10 CHCDRO C[C@H]([NH2+]CCCCC1CCOCC1)c1ccccc1O ZINC000879650549 1125224568 /nfs/dbraw/zinc/22/45/68/1125224568.db2.gz GYNSEDKNSUSIRU-AWEZNQCLSA-N 1 0 277.408 3.640 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2C[C@H](C)CC[C@@H]2C)c1O ZINC000228667692 1125250733 /nfs/dbraw/zinc/25/07/33/1125250733.db2.gz DBHQOHCKZFQTJF-MNOVXSKESA-N 1 0 283.799 3.675 20 10 CHCDRO Cc1cc(C[NH2+][C@@H]2CCCOCC2)c(C)n1-c1ccccc1 ZINC000321034376 1125265086 /nfs/dbraw/zinc/26/50/86/1125265086.db2.gz VLPPGMOXRNINEA-GOSISDBHSA-N 1 0 298.430 3.753 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CCc2ccccc2C1 ZINC000211486143 1125306933 /nfs/dbraw/zinc/30/69/33/1125306933.db2.gz PKGXQWNXWQFBIE-UHFFFAOYSA-N 1 0 273.763 3.604 20 10 CHCDRO CSCCCC[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000130476300 1125362134 /nfs/dbraw/zinc/36/21/34/1125362134.db2.gz HSVLQOVERLDVLF-UHFFFAOYSA-N 1 0 292.492 3.910 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CC2(C)CC(F)(F)C2)cc1C ZINC000883250385 1125384830 /nfs/dbraw/zinc/38/48/30/1125384830.db2.gz SYIHHMFHZRISNQ-UHFFFAOYSA-N 1 0 269.335 3.534 20 10 CHCDRO C[C@H]1C[C@H](C)C[NH+](Cc2c(O)cccc2Cl)C1 ZINC000131818652 1125410663 /nfs/dbraw/zinc/41/06/63/1125410663.db2.gz CHEPATDYEKKAMP-QWRGUYRKSA-N 1 0 253.773 3.524 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2scnc2C)cc1 ZINC000132366527 1125417851 /nfs/dbraw/zinc/41/78/51/1125417851.db2.gz VOGKRIYZDAIPOO-LBPRGKRZSA-N 1 0 289.448 3.758 20 10 CHCDRO CC[C@H]([NH2+]Cc1scnc1C)c1ccc(N(C)C)cc1 ZINC000132427345 1125418494 /nfs/dbraw/zinc/41/84/94/1125418494.db2.gz JDTPNTQNUUCBBC-HNNXBMFYSA-N 1 0 289.448 3.758 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCC[C@H]2C2CCCC2)c1 ZINC000132817236 1125422917 /nfs/dbraw/zinc/42/29/17/1125422917.db2.gz RHGRXSWZJQCHLN-INIZCTEOSA-N 1 0 259.393 3.855 20 10 CHCDRO Cc1cc(C)c(C[NH2+][C@@H]2CCc3cccc(F)c3C2)c(O)c1 ZINC001170972749 1131354726 /nfs/dbraw/zinc/35/47/26/1131354726.db2.gz QXWPFSKSCCJCQT-OAHLLOKOSA-N 1 0 299.389 3.795 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCCC23CCOCC3)c(O)c1 ZINC000282855472 1125446039 /nfs/dbraw/zinc/44/60/39/1125446039.db2.gz UJDROZVKIQLNKS-RHSMWYFYSA-N 1 0 289.419 3.701 20 10 CHCDRO C[C@@H]([NH2+]CCCNc1cccc(F)c1)c1ccccc1O ZINC000184462850 1129201531 /nfs/dbraw/zinc/20/15/31/1129201531.db2.gz ZPIJYMANUGRIBP-CYBMUJFWSA-N 1 0 288.366 3.684 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H](C)C[C@@H](C)CC)c1O ZINC000088293757 1129203038 /nfs/dbraw/zinc/20/30/38/1129203038.db2.gz KSWVVJXKNGNPHJ-STQMWFEESA-N 1 0 265.397 3.705 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]C[C@@H]1CCCCC1(F)F)CC2 ZINC000297211818 1129225081 /nfs/dbraw/zinc/22/50/81/1129225081.db2.gz GRNLYSRGFRLSDI-QWHCGFSZSA-N 1 0 281.346 3.795 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2ccccc2F)c1 ZINC000037764024 1129266676 /nfs/dbraw/zinc/26/66/76/1129266676.db2.gz AAZYFEFHCYGLKS-NWDGAFQWSA-N 1 0 289.350 3.952 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]Cc2cc(Cl)ccc2O)c1 ZINC000037771077 1129267735 /nfs/dbraw/zinc/26/77/35/1129267735.db2.gz IMKXWWBTSGCJAD-LLVKDONJSA-N 1 0 291.778 3.905 20 10 CHCDRO CN(C)c1ccc(C[NH2+]CC(C)(C)c2ccccc2)cc1 ZINC000037864142 1129280103 /nfs/dbraw/zinc/28/01/03/1129280103.db2.gz DJMLGHOBNHWHBM-UHFFFAOYSA-N 1 0 282.431 3.820 20 10 CHCDRO CC(C)(C[NH2+]Cc1ccc2c(c1)CCO2)Oc1ccccc1 ZINC000734160746 1129297496 /nfs/dbraw/zinc/29/74/96/1129297496.db2.gz FTMZXNMQOLNCRQ-UHFFFAOYSA-N 1 0 297.398 3.569 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]C[C@H](C)C(C)(C)C)c1 ZINC000734510719 1129311709 /nfs/dbraw/zinc/31/17/09/1129311709.db2.gz RMWWPWNTTFVQTI-LBPRGKRZSA-N 1 0 265.397 3.563 20 10 CHCDRO C[C@H]([NH2+]Cc1nc2c(s1)CCCC2)c1ccccc1O ZINC000719528190 1129342660 /nfs/dbraw/zinc/34/26/60/1129342660.db2.gz QREPXMMJPRWCNT-NSHDSACASA-N 1 0 288.416 3.578 20 10 CHCDRO CCOc1cccc(C[N@H+]([C@H](C)C2CC2)C2CC2)c1O ZINC000092009597 1129377416 /nfs/dbraw/zinc/37/74/16/1129377416.db2.gz ZVIBAUIOOYTHHA-GFCCVEGCSA-N 1 0 275.392 3.554 20 10 CHCDRO CC[C@H]1CCC[N@H+](Cc2c(O)ccc3ccncc32)CC1 ZINC000738257255 1129391544 /nfs/dbraw/zinc/39/15/44/1129391544.db2.gz VQYOTGVQTMKCEY-AWEZNQCLSA-N 1 0 284.403 3.953 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)CCc2cccnc2)cc1 ZINC000738300210 1129392120 /nfs/dbraw/zinc/39/21/20/1129392120.db2.gz UTLODTFGGIHIAN-UHFFFAOYSA-N 1 0 297.446 3.602 20 10 CHCDRO CC(C)CCn1cccc1C[NH2+]Cc1ccccc1O ZINC000738430076 1129393689 /nfs/dbraw/zinc/39/36/89/1129393689.db2.gz IMZUKKKRYRPKDW-UHFFFAOYSA-N 1 0 272.392 3.530 20 10 CHCDRO CCC(CC)[NH2+]Cc1ccc(N(CC)CC)c(F)c1 ZINC000740003269 1129408715 /nfs/dbraw/zinc/40/87/15/1129408715.db2.gz WZSOGBNIRVKRIM-UHFFFAOYSA-N 1 0 266.404 3.950 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CC[C@H]2CCCCO2)cc1 ZINC000248422050 1129417247 /nfs/dbraw/zinc/41/72/47/1129417247.db2.gz YLIAIHBCFGIBRZ-MAUKXSAKSA-N 1 0 290.451 3.753 20 10 CHCDRO CCO[C@@H]1C[C@@H]([NH2+][C@H](C)c2ccc(C)cc2O)C12CCC2 ZINC000248484962 1129419274 /nfs/dbraw/zinc/41/92/74/1129419274.db2.gz DQXOMZZTRKUNTH-KBRIMQKVSA-N 1 0 289.419 3.699 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2[C@@H]3Cc4ccccc4[C@H]23)c(O)c1 ZINC000248532673 1129420864 /nfs/dbraw/zinc/42/08/64/1129420864.db2.gz YSCZOSGSBFVGMP-NTCOEUGSSA-N 1 0 293.410 3.937 20 10 CHCDRO CCO[C@@H]1C[C@H]([N@H+](C)Cc2cc(C)c(C)cc2O)C1(C)C ZINC000740861681 1129421060 /nfs/dbraw/zinc/42/10/60/1129421060.db2.gz QXGUYJRCLQFRBM-DLBZAZTESA-N 1 0 291.435 3.644 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](C)[C@@H](C)Cc2ccc(O)cc2)cc1C ZINC000093324682 1129421077 /nfs/dbraw/zinc/42/10/77/1129421077.db2.gz LMYQKRKXEJPWBG-HNNXBMFYSA-N 1 0 299.414 3.778 20 10 CHCDRO Cc1ccc(O)c(C[N@H+]2CCCC[C@@H]2c2cccn2C)c1 ZINC000093845512 1129428515 /nfs/dbraw/zinc/42/85/15/1129428515.db2.gz VGHDGPYBMCKZMK-QGZVFWFLSA-N 1 0 284.403 3.766 20 10 CHCDRO CCS[C@H]1CC[C@@H]([N@H+](C)Cc2cc(C)ccc2O)C1 ZINC000093868900 1129428747 /nfs/dbraw/zinc/42/87/47/1129428747.db2.gz PTYRMXCXPXMXPZ-CABCVRRESA-N 1 0 279.449 3.807 20 10 CHCDRO Cc1cccc([C@H](C)C[NH2+]Cc2ccc3c(c2)CCO3)c1 ZINC000741255100 1129432520 /nfs/dbraw/zinc/43/25/20/1129432520.db2.gz FPYLCBFRJTWGFE-OAHLLOKOSA-N 1 0 281.399 3.823 20 10 CHCDRO Cc1cc(C[NH+]2CCC(C)(C)CC2)ccc1N(C)C ZINC001139670521 1131374069 /nfs/dbraw/zinc/37/40/69/1131374069.db2.gz AMMZELYCGYRWPW-UHFFFAOYSA-N 1 0 260.425 3.683 20 10 CHCDRO CCC(CC)[C@@H](C[NH2+][C@@H](C)c1cc(F)ccc1O)N(C)C ZINC000094616999 1129448149 /nfs/dbraw/zinc/44/81/49/1129448149.db2.gz IITVNAXMBQVUSZ-BLLLJJGKSA-N 1 0 296.430 3.548 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCc2ccccc2C1)c1cc(F)ccc1O ZINC000094618068 1129448319 /nfs/dbraw/zinc/44/83/19/1129448319.db2.gz VUKXPMSTGKLXQJ-MLGOLLRUSA-N 1 0 285.362 3.739 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)Cc1cccs1)c1cc(F)ccc1O ZINC000094617297 1129448337 /nfs/dbraw/zinc/44/83/37/1129448337.db2.gz HLCODAGVIVTZCQ-WDEREUQCSA-N 1 0 279.380 3.875 20 10 CHCDRO COc1ccc(C[NH2+]C2CC(c3ccccc3C)C2)c(O)c1 ZINC000742384401 1129473954 /nfs/dbraw/zinc/47/39/54/1129473954.db2.gz AWVKCTULQKQKGT-UHFFFAOYSA-N 1 0 297.398 3.745 20 10 CHCDRO CCO[C@H](CC[NH2+]Cc1c(O)cccc1Cl)C(C)C ZINC000746053445 1129624356 /nfs/dbraw/zinc/62/43/56/1129624356.db2.gz PXZFMSFMTFCCDW-OAHLLOKOSA-N 1 0 285.815 3.586 20 10 CHCDRO CCC[N@H+](CCc1ccccn1)Cc1ccc(N(C)C)cc1 ZINC000746136880 1129626955 /nfs/dbraw/zinc/62/69/55/1129626955.db2.gz KUMHGAOLDVPWTC-UHFFFAOYSA-N 1 0 297.446 3.602 20 10 CHCDRO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1cc(Br)ccc1O ZINC000097814917 1129629981 /nfs/dbraw/zinc/62/99/81/1129629981.db2.gz YSERRPMMHCTHGS-PHIMTYICSA-N 1 0 298.224 3.918 20 10 CHCDRO CC[C@@H]([NH2+]CCNc1ccccc1)c1ccc(N(C)C)cc1 ZINC000766516241 1129678760 /nfs/dbraw/zinc/67/87/60/1129678760.db2.gz STPVULYCHXSQBD-LJQANCHMSA-N 1 0 297.446 3.905 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](C)C[C@H]2CCOC2)cc1 ZINC000766579918 1129693929 /nfs/dbraw/zinc/69/39/29/1129693929.db2.gz CDUYIWOZEQIWGA-HRCADAONSA-N 1 0 290.451 3.608 20 10 CHCDRO CNc1ccccc1N[C@@H]1CC(C)(C)C[C@](C)(C[NH3+])C1 ZINC001169152407 1129705353 /nfs/dbraw/zinc/70/53/53/1129705353.db2.gz PNTJLNLSYZUNAO-CXAGYDPISA-N 1 0 275.440 3.684 20 10 CHCDRO CC[C@@H]([NH2+]CC1(C)CC(F)(F)C1)c1ccccc1O ZINC000720901141 1129718296 /nfs/dbraw/zinc/71/82/96/1129718296.db2.gz QENIAZNETBKIEI-GFCCVEGCSA-N 1 0 269.335 3.868 20 10 CHCDRO C[C@@H]1CSC[C@H]1[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000796481214 1129742087 /nfs/dbraw/zinc/74/20/87/1129742087.db2.gz CPDZBNWHUZWOHS-CXAGYDPISA-N 1 0 299.439 3.900 20 10 CHCDRO Cc1noc(C)c1C(C)(C)[NH2+]Cc1cc(Cl)ccc1O ZINC000796528333 1129775332 /nfs/dbraw/zinc/77/53/32/1129775332.db2.gz RJWBHYMSLDTIIW-UHFFFAOYSA-N 1 0 294.782 3.675 20 10 CHCDRO COc1cccc(O)c1C[NH2+][C@H]1CCCc2sccc21 ZINC000767190844 1129780785 /nfs/dbraw/zinc/78/07/85/1129780785.db2.gz PXKUBFCNCXIKKX-ZDUSSCGKSA-N 1 0 289.400 3.630 20 10 CHCDRO CCc1cccc(C[NH2+]C[C@H]2CCCCC2(F)F)c1O ZINC000691436605 1129783942 /nfs/dbraw/zinc/78/39/42/1129783942.db2.gz SDWKBQXVMBNXIM-CQSZACIVSA-N 1 0 283.362 3.870 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C[C@H]2C[C@@H]2c2ccccc2)cc1F ZINC000767363963 1129789111 /nfs/dbraw/zinc/78/91/11/1129789111.db2.gz NDIAACYFQJNSRL-IAGOWNOFSA-N 1 0 298.405 3.785 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H]2CCCC(F)(F)C2)cc1C ZINC000767927819 1129821999 /nfs/dbraw/zinc/82/19/99/1129821999.db2.gz DGIRFUFJUWVFQM-ZDUSSCGKSA-N 1 0 269.335 3.677 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2CCCC(F)(F)C2)cc1F ZINC000767929962 1129822453 /nfs/dbraw/zinc/82/24/53/1129822453.db2.gz UXBPZKJBJIEACT-GFCCVEGCSA-N 1 0 286.341 3.559 20 10 CHCDRO CC[C@H](C)[C@@H](C[NH2+]Cc1ccc(N(CC)CC)cc1)OC ZINC000381128639 1129834107 /nfs/dbraw/zinc/83/41/07/1129834107.db2.gz GQUIOSMAFKVZGE-MAUKXSAKSA-N 1 0 292.467 3.684 20 10 CHCDRO Cc1cc(C[N@@H+](C)Cc2ccc(N(C)C)cc2)c(C)o1 ZINC000768131257 1129834483 /nfs/dbraw/zinc/83/44/83/1129834483.db2.gz ZGQTYNDPFPKRJQ-UHFFFAOYSA-N 1 0 272.392 3.594 20 10 CHCDRO Cn1cccc1[C@@H]1CCC[N@@H+]1Cc1c(O)cccc1Cl ZINC000768199819 1129839625 /nfs/dbraw/zinc/83/96/25/1129839625.db2.gz ZITJNQYMTMYDNE-HNNXBMFYSA-N 1 0 290.794 3.721 20 10 CHCDRO COc1cccc(O)c1C[N@H+](C)Cc1ccc(Cl)s1 ZINC000768193821 1129842469 /nfs/dbraw/zinc/84/24/69/1129842469.db2.gz RICIQDSLOLCBMD-UHFFFAOYSA-N 1 0 297.807 3.748 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@H+](C1CC1)C1CCCC1 ZINC000768252766 1129846415 /nfs/dbraw/zinc/84/64/15/1129846415.db2.gz OZUBRPXWGXDRAJ-UHFFFAOYSA-N 1 0 265.784 3.953 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)[C@H]2CCSC2)cc1F ZINC000768263617 1129848253 /nfs/dbraw/zinc/84/82/53/1129848253.db2.gz VWLZOICLKWPPAS-AWEZNQCLSA-N 1 0 296.455 3.609 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](C)[C@@H]2CCC[C@H](C)C2)c1 ZINC000768261223 1129848278 /nfs/dbraw/zinc/84/82/78/1129848278.db2.gz AFAOMFMVSACQIQ-DZGCQCFKSA-N 1 0 277.408 3.801 20 10 CHCDRO CC(C)[N@H+](Cc1ccn(C)c1)Cc1ccc(N(C)C)cc1 ZINC000768351867 1129852237 /nfs/dbraw/zinc/85/22/37/1129852237.db2.gz LJSQAWNUSWSUSC-UHFFFAOYSA-N 1 0 285.435 3.502 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)[C@@H]2CC3CCC2CC3)c(O)c1 ZINC000382067745 1129854880 /nfs/dbraw/zinc/85/48/80/1129854880.db2.gz GVUSFELGDQJPSM-WNZJFKNXSA-N 1 0 289.419 3.705 20 10 CHCDRO CC[N@H+](CCc1ccccc1)Cc1cc(OC)c(C)cc1O ZINC000768440229 1129856500 /nfs/dbraw/zinc/85/65/00/1129856500.db2.gz UODSFOBEUQGRMO-UHFFFAOYSA-N 1 0 299.414 3.774 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H](C)COC(C)C)cc1F ZINC000800234984 1129856665 /nfs/dbraw/zinc/85/66/65/1129856665.db2.gz GVBXBWJRHHTLHA-CQSZACIVSA-N 1 0 296.430 3.575 20 10 CHCDRO CC(C)OCCC[N@H+](C)Cc1cc2c(cc1O)CCCC2 ZINC000768449306 1129857503 /nfs/dbraw/zinc/85/75/03/1129857503.db2.gz ZCBYFECISBYSJR-UHFFFAOYSA-N 1 0 291.435 3.518 20 10 CHCDRO CCC1(CC)C[N@H+](Cc2cccc(OC)c2O)CCS1 ZINC000768529398 1129860135 /nfs/dbraw/zinc/86/01/35/1129860135.db2.gz VPAIYAUTKXBUGN-UHFFFAOYSA-N 1 0 295.448 3.508 20 10 CHCDRO Cc1oc2ccccc2c1CC[NH2+]Cc1cc(F)ccc1O ZINC000768526079 1129860144 /nfs/dbraw/zinc/86/01/44/1129860144.db2.gz JWWASNCACVDYBU-UHFFFAOYSA-N 1 0 299.345 3.918 20 10 CHCDRO CCOc1ccc(C[N@H+]([C@@H](C)C2CC2)C2CC2)c(O)c1 ZINC000768533360 1129860830 /nfs/dbraw/zinc/86/08/30/1129860830.db2.gz VTWWXQNEIFEFCN-LBPRGKRZSA-N 1 0 275.392 3.554 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@H]2CCCC(F)(F)C2)cc1C ZINC000800274450 1129861287 /nfs/dbraw/zinc/86/12/87/1129861287.db2.gz NKSWDQHCXZOLKA-ZDUSSCGKSA-N 1 0 283.362 3.924 20 10 CHCDRO CC(C)[N@@H+](Cc1c(O)cccc1Cl)CC1CC1 ZINC000768675804 1129865705 /nfs/dbraw/zinc/86/57/05/1129865705.db2.gz VVYIADKTIGKXJR-UHFFFAOYSA-N 1 0 253.773 3.666 20 10 CHCDRO C[C@]12C[C@H]1CCC[C@H]2[NH2+]CCCSc1nccs1 ZINC000800479990 1129876784 /nfs/dbraw/zinc/87/67/84/1129876784.db2.gz MIBXMPOMHFQZBO-BZPMIXESSA-N 1 0 282.478 3.794 20 10 CHCDRO COc1cccc(C[N@@H+]2CC[C@H](C)[C@@H]3CCCC[C@@H]32)c1O ZINC000768848450 1129877613 /nfs/dbraw/zinc/87/76/13/1129877613.db2.gz CDKSJYFAYYXNLN-BPUTZDHNSA-N 1 0 289.419 3.801 20 10 CHCDRO CC[C@@H]1COCC[N@@H+]1Cc1cc(-c2ccccc2)ccc1O ZINC000768882132 1129879510 /nfs/dbraw/zinc/87/95/10/1129879510.db2.gz QALPZBCPNMTURP-GOSISDBHSA-N 1 0 297.398 3.670 20 10 CHCDRO C[C@@H]([NH2+]CCc1cccc2[nH]ccc21)c1ccccc1O ZINC000800500542 1129881226 /nfs/dbraw/zinc/88/12/26/1129881226.db2.gz FBFSLIYQWCVPJS-CYBMUJFWSA-N 1 0 280.371 3.767 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCOc3ccccc3[C@@H]2C)c1 ZINC000768930231 1129882585 /nfs/dbraw/zinc/88/25/85/1129882585.db2.gz NQWDGQCZKNOKOB-AWEZNQCLSA-N 1 0 283.371 3.656 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCOc3ccccc3[C@H]2C)c1 ZINC000768930232 1129882813 /nfs/dbraw/zinc/88/28/13/1129882813.db2.gz NQWDGQCZKNOKOB-CQSZACIVSA-N 1 0 283.371 3.656 20 10 CHCDRO C[N@H+](Cc1cc(Cl)ccc1O)C1Cc2ccccc2C1 ZINC000769033733 1129886514 /nfs/dbraw/zinc/88/65/14/1129886514.db2.gz NEASIQBAGDSYKK-UHFFFAOYSA-N 1 0 287.790 3.645 20 10 CHCDRO COc1cccc(O)c1C[N@@H+]1CC(C)(C)[C@@H]1c1ccccc1 ZINC000769084669 1129890548 /nfs/dbraw/zinc/89/05/48/1129890548.db2.gz JNCUHEYEHGRQGF-SFHVURJKSA-N 1 0 297.398 3.984 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC[C@@H](c3ccccc3C)C2)c1 ZINC000769231407 1129895939 /nfs/dbraw/zinc/89/59/39/1129895939.db2.gz ATJHJUMJZBJLTF-MRXNPFEDSA-N 1 0 281.399 3.999 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H](C)c2ccsc2)cc1C ZINC000800889585 1129896622 /nfs/dbraw/zinc/89/66/22/1129896622.db2.gz QVCCWBCDTAPZKW-LBPRGKRZSA-N 1 0 261.390 3.921 20 10 CHCDRO c1csc(SCCC[NH2+][C@@H]2CC[C@@H]2C2CCC2)n1 ZINC000800971997 1129900636 /nfs/dbraw/zinc/90/06/36/1129900636.db2.gz ZRNWYBRKRNZQIA-CHWSQXEVSA-N 1 0 282.478 3.794 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2CCC[C@@H]2CCCF)cc1F ZINC000800969514 1129900830 /nfs/dbraw/zinc/90/08/30/1129900830.db2.gz RKVVANKGRPJEJM-GDBMZVCRSA-N 1 0 296.405 3.900 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2cc(-c3ccccc3)ccc2O)CCCO1 ZINC000769319137 1129902586 /nfs/dbraw/zinc/90/25/86/1129902586.db2.gz RIVGGOCCWABTDF-OAHLLOKOSA-N 1 0 297.398 3.670 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCc3ccccc3OC2)c1 ZINC000800986512 1129902700 /nfs/dbraw/zinc/90/27/00/1129902700.db2.gz GWQIFFSBVTVFBJ-GDBMZVCRSA-N 1 0 297.398 3.745 20 10 CHCDRO CCCN(CCC)c1ccc(C[N@H+](C)[C@@H]2CCOC2)cc1 ZINC000769331643 1129903154 /nfs/dbraw/zinc/90/31/54/1129903154.db2.gz VFVRVJARGSTKFG-GOSISDBHSA-N 1 0 290.451 3.534 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCc3ccccc3[C@@H]2C)c1 ZINC000769353025 1129904053 /nfs/dbraw/zinc/90/40/53/1129904053.db2.gz RHHMCFYAKXONLH-AWEZNQCLSA-N 1 0 267.372 3.820 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CCc3ccccc3[C@H]2C)c1 ZINC000769353156 1129904244 /nfs/dbraw/zinc/90/42/44/1129904244.db2.gz SYNNKAUQELVVCU-CQSZACIVSA-N 1 0 297.398 3.910 20 10 CHCDRO COc1cccc(C[N@@H+]2CCCC3(CCCCC3)C2)c1O ZINC000769405424 1129907192 /nfs/dbraw/zinc/90/71/92/1129907192.db2.gz VFKWKDFEWPBHLQ-UHFFFAOYSA-N 1 0 289.419 3.947 20 10 CHCDRO CCOc1ccc(C[N@@H+]2Cc3ccccc3C[C@@H]2C)c(O)c1 ZINC000769482773 1129909293 /nfs/dbraw/zinc/90/92/93/1129909293.db2.gz HYGNJLBSKFSLMM-AWEZNQCLSA-N 1 0 297.398 3.738 20 10 CHCDRO CCCN(CCC)c1ccc(C[N@H+](C)CC[C@H](C)O)cc1 ZINC000769452443 1129910981 /nfs/dbraw/zinc/91/09/81/1129910981.db2.gz RPTJEFKCXNKKBT-INIZCTEOSA-N 1 0 292.467 3.516 20 10 CHCDRO CCOc1cccc(C[N@@H+]2C[C@@H](C)CCC[C@@H]2C)c1O ZINC000769452313 1129911098 /nfs/dbraw/zinc/91/10/98/1129911098.db2.gz WFTWRKAGZIDEEO-KBPBESRZSA-N 1 0 277.408 3.801 20 10 CHCDRO C[C@@H]1C[C@@H](C)[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000769470968 1129912690 /nfs/dbraw/zinc/91/26/90/1129912690.db2.gz PJASNOMUHAWEBT-HZPDHXFCSA-N 1 0 272.436 3.907 20 10 CHCDRO C[C@@H](Cc1ccsc1)[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC000769501337 1129914161 /nfs/dbraw/zinc/91/41/61/1129914161.db2.gz CNVCDJXYQZDEOV-AWEZNQCLSA-N 1 0 288.460 3.877 20 10 CHCDRO COc1cccc(C[N@@H+]2CCCC23CCCCC3)c1O ZINC000769506579 1129914787 /nfs/dbraw/zinc/91/47/87/1129914787.db2.gz YDMPQSNQTYESTL-UHFFFAOYSA-N 1 0 275.392 3.700 20 10 CHCDRO CCS[C@@H]1CC[C@H]([N@H+](C)Cc2ccc(N(C)C)cc2)C1 ZINC000769550331 1129917162 /nfs/dbraw/zinc/91/71/62/1129917162.db2.gz RBZKDZDHJWWRNA-DLBZAZTESA-N 1 0 292.492 3.859 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccccc1N(C)C ZINC000769686896 1129920364 /nfs/dbraw/zinc/92/03/64/1129920364.db2.gz KKTLOWHXGFVDSU-CQSZACIVSA-N 1 0 296.414 3.538 20 10 CHCDRO CC(=O)c1cc(F)cc(C[NH2+][C@@H](C)c2ccsc2)c1O ZINC000801570621 1129928080 /nfs/dbraw/zinc/92/80/80/1129928080.db2.gz STFHOLIIMFCMBX-VIFPVBQESA-N 1 0 293.363 3.646 20 10 CHCDRO C[C@H]1CC[N@H+](Cc2ccc(N3CCCCC3)cc2)[C@H]1C ZINC000770283037 1129943077 /nfs/dbraw/zinc/94/30/77/1129943077.db2.gz IEXVWJUGEKJLFR-HOTGVXAUSA-N 1 0 272.436 3.907 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC000770509648 1129948818 /nfs/dbraw/zinc/94/88/18/1129948818.db2.gz QAAUFCDWNKHPOW-MRXNPFEDSA-N 1 0 271.335 3.868 20 10 CHCDRO CN(C)c1ccc(C[N@H+](CC2CC2)C2CCC2)cc1 ZINC000770509485 1129949312 /nfs/dbraw/zinc/94/93/12/1129949312.db2.gz AUEQUXXBQIPILX-UHFFFAOYSA-N 1 0 258.409 3.517 20 10 CHCDRO Oc1ccccc1C[NH2+][C@@H]1CC[C@H](c2ccccc2)C1 ZINC000770739521 1129957739 /nfs/dbraw/zinc/95/77/39/1129957739.db2.gz CRSQIHHETOSGGZ-DOTOQJQBSA-N 1 0 267.372 3.818 20 10 CHCDRO Oc1cc2c(cc1C[N@@H+]1CCc3ccc(F)cc3C1)CCC2 ZINC000771171489 1129973760 /nfs/dbraw/zinc/97/37/60/1129973760.db2.gz OUNDIVXNCAYESX-UHFFFAOYSA-N 1 0 297.373 3.578 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)c(C)n1 ZINC000771388900 1129979534 /nfs/dbraw/zinc/97/95/34/1129979534.db2.gz KPQNSONGNPCDCS-HNNXBMFYSA-N 1 0 297.446 3.924 20 10 CHCDRO Cc1ccncc1[C@H](C)[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000771388964 1129979614 /nfs/dbraw/zinc/97/96/14/1129979614.db2.gz QDRVGEMFXCQVRI-CABCVRRESA-N 1 0 283.419 3.868 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)[C@H]1CCc2cccc(F)c2C1 ZINC001171004381 1131412255 /nfs/dbraw/zinc/41/22/55/1131412255.db2.gz DBKSUNGGJYLDHW-INIZCTEOSA-N 1 0 299.389 3.911 20 10 CHCDRO C[C@H]([NH2+]CCC1C[C@@H](C)O[C@H](C)C1)c1cc(F)ccc1O ZINC000802309032 1129991319 /nfs/dbraw/zinc/99/13/19/1129991319.db2.gz MSTRTMKDKNWWCP-UPJWGTAASA-N 1 0 295.398 3.776 20 10 CHCDRO C[C@@H]([NH2+]CC[C@@H]1C[C@@H](C)O[C@@H](C)C1)c1ccccc1O ZINC000802309697 1129991481 /nfs/dbraw/zinc/99/14/81/1129991481.db2.gz UERMYHJGAGWOSP-LXTVHRRPSA-N 1 0 277.408 3.637 20 10 CHCDRO C[C@H]([NH2+]CCC1C[C@@H](C)O[C@H](C)C1)c1ccccc1O ZINC000802309698 1129991663 /nfs/dbraw/zinc/99/16/63/1129991663.db2.gz UERMYHJGAGWOSP-MCIONIFRSA-N 1 0 277.408 3.637 20 10 CHCDRO C[N@H+](Cc1ccccc1)Cc1c(O)cccc1Cl ZINC000771926119 1129995268 /nfs/dbraw/zinc/99/52/68/1129995268.db2.gz BGEDNJKKZKIZMU-UHFFFAOYSA-N 1 0 261.752 3.678 20 10 CHCDRO CN(C)c1ccc(C[NH+]2CC(Cc3ccc(F)cc3)C2)cc1 ZINC000785765289 1130054774 /nfs/dbraw/zinc/05/47/74/1130054774.db2.gz HDFPBIQMBDBQOQ-UHFFFAOYSA-N 1 0 298.405 3.566 20 10 CHCDRO Oc1ccccc1C[N@H+](CC[C@@H]1CCCO1)C1CCCC1 ZINC000787244629 1130140835 /nfs/dbraw/zinc/14/08/35/1130140835.db2.gz AOIQOKQDDGFBIM-KRWDZBQOSA-N 1 0 289.419 3.706 20 10 CHCDRO CC1(C)C[C@H]([NH2+][C@H]2CCc3cccc(O)c32)CCS1 ZINC000903281820 1130145135 /nfs/dbraw/zinc/14/51/35/1130145135.db2.gz INEIOACEPDDKKQ-OLZOCXBDSA-N 1 0 277.433 3.643 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](C)C2(C)CCCC2)c1 ZINC000787336202 1130147906 /nfs/dbraw/zinc/14/79/06/1130147906.db2.gz CUJAUQAWXWWLEH-UHFFFAOYSA-N 1 0 263.381 3.555 20 10 CHCDRO CC[C@H]([NH2+]Cc1c(C)cc(CO)cc1C)c1ccccc1O ZINC000903306905 1130149590 /nfs/dbraw/zinc/14/95/90/1130149590.db2.gz CXSBIDJVDATYRO-SFHVURJKSA-N 1 0 299.414 3.742 20 10 CHCDRO COC(C)(C)[C@@H](C)[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000903329953 1130157066 /nfs/dbraw/zinc/15/70/66/1130157066.db2.gz GECRHBNATDHQHW-NXEZZACHSA-N 1 0 271.788 3.510 20 10 CHCDRO COC(C)(C)[C@H](C)[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000903329954 1130157220 /nfs/dbraw/zinc/15/72/20/1130157220.db2.gz GECRHBNATDHQHW-UWVGGRQHSA-N 1 0 271.788 3.510 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCOC12CCCC2)c1cc(Cl)ccc1O ZINC000903382833 1130169206 /nfs/dbraw/zinc/16/92/06/1130169206.db2.gz JNOJYQNMXKXHNQ-ABAIWWIYSA-N 1 0 295.810 3.798 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCOC12CCCC2)c1ccc(C)cc1O ZINC000903387059 1130169608 /nfs/dbraw/zinc/16/96/08/1130169608.db2.gz FUBJOUGOWMTRLJ-DOTOQJQBSA-N 1 0 289.419 3.843 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCc2cccnc2C)c(O)c1C ZINC000903416466 1130173275 /nfs/dbraw/zinc/17/32/75/1130173275.db2.gz UCVNZKMAHBHQGF-OAHLLOKOSA-N 1 0 284.403 3.606 20 10 CHCDRO C[C@H]([NH2+][C@@H]1COC[C@@H]1C1CC1)c1ccc2ccccc2c1O ZINC000903438835 1130176959 /nfs/dbraw/zinc/17/69/59/1130176959.db2.gz XPEDSEDGSCOSGK-JBBXEZCESA-N 1 0 297.398 3.621 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C[C@@]2(C)CC2(F)F)cc1 ZINC000689237542 1130182692 /nfs/dbraw/zinc/18/26/92/1130182692.db2.gz YBJVQHMCSCOJKX-OAHLLOKOSA-N 1 0 282.378 3.668 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C[C@]2(C)CC2(F)F)cc1 ZINC000689237540 1130182796 /nfs/dbraw/zinc/18/27/96/1130182796.db2.gz YBJVQHMCSCOJKX-HNNXBMFYSA-N 1 0 282.378 3.668 20 10 CHCDRO CC1=CC[C@H]([NH2+]Cc2ccc3c(c2)CCCN3C)CC1 ZINC000788582577 1130195481 /nfs/dbraw/zinc/19/54/81/1130195481.db2.gz HOMVTMLVZYGDAV-KRWDZBQOSA-N 1 0 270.420 3.657 20 10 CHCDRO CC(C)[C@H]([NH2+][C@@H](C)c1ccccc1O)[C@H](O)c1ccccc1 ZINC000788624890 1130199212 /nfs/dbraw/zinc/19/92/12/1130199212.db2.gz HCUKQVYEZQNOBK-ZOCIIQOWSA-N 1 0 299.414 3.801 20 10 CHCDRO CCC(CC)[C@H](CC[NH2+]Cc1ccc(N(C)C)cc1)OC ZINC000746762080 1130207556 /nfs/dbraw/zinc/20/75/56/1130207556.db2.gz UTGFNONAAYAXHH-SFHVURJKSA-N 1 0 292.467 3.684 20 10 CHCDRO CC1(C)Nc2ccccc2[C@H]1[NH2+]Cc1ccc2c(c1)CCO2 ZINC000903947637 1130211511 /nfs/dbraw/zinc/21/15/11/1130211511.db2.gz DAVITLTXOKTTMY-GOSISDBHSA-N 1 0 294.398 3.657 20 10 CHCDRO CC[C@H]([NH2+]CCOC(F)(F)F)c1cc(Cl)ccc1O ZINC000788978946 1130224201 /nfs/dbraw/zinc/22/42/01/1130224201.db2.gz CJXOREGVTXDARD-JTQLQIEISA-N 1 0 297.704 3.623 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H](C(C)C)[C@@H](O)c2ccccc2)c1O ZINC000789779936 1130276473 /nfs/dbraw/zinc/27/64/73/1130276473.db2.gz RYLXDUQUQUBRTC-HKUYNNGSSA-N 1 0 299.414 3.548 20 10 CHCDRO CC[C@@H]([NH2+]CCCC1CCOCC1)c1ccccc1O ZINC000790324642 1130306784 /nfs/dbraw/zinc/30/67/84/1130306784.db2.gz LOTRLNAXMNXKQC-MRXNPFEDSA-N 1 0 277.408 3.640 20 10 CHCDRO CCc1ccc(C)[nH+]c1NCc1cccc(C)c1O ZINC000826911346 1130309940 /nfs/dbraw/zinc/30/99/40/1130309940.db2.gz XCPQHFDPQUTCHV-UHFFFAOYSA-N 1 0 256.349 3.579 20 10 CHCDRO CC(C)(C)[C@@H]1C[N@H+](Cc2c(O)ccc3ccccc32)CCO1 ZINC000790416447 1130313304 /nfs/dbraw/zinc/31/33/04/1130313304.db2.gz PPNOXCDKTONMFC-SFHVURJKSA-N 1 0 299.414 3.792 20 10 CHCDRO CSCC1(CC[NH2+]Cc2ccc(N(C)C)cc2C)CC1 ZINC000826936706 1130315203 /nfs/dbraw/zinc/31/52/03/1130315203.db2.gz CTTXOLXREPUKOR-UHFFFAOYSA-N 1 0 292.492 3.684 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C(C)C)C(C)(C)O)c1ccc(N(C)C)cc1 ZINC000790701700 1130326652 /nfs/dbraw/zinc/32/66/52/1130326652.db2.gz MEDBHDNWYDJXSV-IRXDYDNUSA-N 1 0 292.467 3.589 20 10 CHCDRO C[C@@H]1CC[C@H]([N@H+](C)Cc2ccc(N3CCCC3)cc2)C1 ZINC001170144661 1130330111 /nfs/dbraw/zinc/33/01/11/1130330111.db2.gz MWJTUUJURMAABC-QAPCUYQASA-N 1 0 272.436 3.907 20 10 CHCDRO CS[C@H]1CC[C@H]([NH2+]Cc2c([O-])ccc(Cl)c2F)C1 ZINC000790974224 1130343897 /nfs/dbraw/zinc/34/38/97/1130343897.db2.gz QHRCXLFTWJUUEE-IUCAKERBSA-N 1 0 289.803 3.558 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCc3cc(C)ccc3C2)c1O ZINC000792178428 1130436597 /nfs/dbraw/zinc/43/65/97/1130436597.db2.gz CDQHFZXPGYRUCI-UHFFFAOYSA-N 1 0 297.398 3.658 20 10 CHCDRO Cc1ccnc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)c1 ZINC000792205951 1130439901 /nfs/dbraw/zinc/43/99/01/1130439901.db2.gz CORGORSAMRNICJ-UHFFFAOYSA-N 1 0 297.446 3.867 20 10 CHCDRO C[C@@H]1CCC[N@@H+]1Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000792821602 1130500670 /nfs/dbraw/zinc/50/06/70/1130500670.db2.gz YNZSAQPYYOXGTA-LLVKDONJSA-N 1 0 286.341 3.756 20 10 CHCDRO C[C@@H]1C[C@H](C)[N@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000793227615 1130531717 /nfs/dbraw/zinc/53/17/17/1130531717.db2.gz FJGXTJVFMSEGNY-GASCZTMLSA-N 1 0 258.409 3.660 20 10 CHCDRO COc1cc(C)cc(C[N@H+]2CC=C(C(C)(C)C)CC2)c1O ZINC000758358516 1130607092 /nfs/dbraw/zinc/60/70/92/1130607092.db2.gz PLWPRSDUXIRBEQ-UHFFFAOYSA-N 1 0 289.419 3.887 20 10 CHCDRO CCOCc1cc(C[NH2+][C@@H]2CC23CCCC3)ccc1OC ZINC000758524806 1130616273 /nfs/dbraw/zinc/61/62/73/1130616273.db2.gz KQFIMVRXFDEBMJ-QGZVFWFLSA-N 1 0 289.419 3.654 20 10 CHCDRO CC1(C)C[N@H+](Cc2c(O)cccc2Cl)[C@H]1C1CC1 ZINC000811513991 1130620378 /nfs/dbraw/zinc/62/03/78/1130620378.db2.gz YWWKIGLCNKZTFL-AWEZNQCLSA-N 1 0 265.784 3.666 20 10 CHCDRO CO[C@H]1CCC[N@H+](Cc2cccc(-c3ccccc3)c2O)C1 ZINC001234992838 1130701714 /nfs/dbraw/zinc/70/17/14/1130701714.db2.gz SEPUBESNDHNNEO-KRWDZBQOSA-N 1 0 297.398 3.670 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CCCCF)cc1F ZINC000812773831 1130712924 /nfs/dbraw/zinc/71/29/24/1130712924.db2.gz VEAOHHPNFHWAFQ-UHFFFAOYSA-N 1 0 270.367 3.511 20 10 CHCDRO Oc1c(Cl)cccc1CNc1cc2c(c[nH+]1)CCCC2 ZINC000812782360 1130713906 /nfs/dbraw/zinc/71/39/06/1130713906.db2.gz WWJZGDMSJWJSHB-UHFFFAOYSA-N 1 0 288.778 3.932 20 10 CHCDRO Nc1ccc(C[NH+]2CCC3(C=Cc4ccccc43)CC2)cc1 ZINC001235186251 1130720546 /nfs/dbraw/zinc/72/05/46/1130720546.db2.gz GIBULEBESLILHC-UHFFFAOYSA-N 1 0 290.410 3.829 20 10 CHCDRO COc1cc(C)cc(C[N@@H+]2CC[C@@]3(CC[C@@H](C)C3)C2)c1O ZINC000781585431 1130728550 /nfs/dbraw/zinc/72/85/50/1130728550.db2.gz FTNSDNQVCLYOME-FZKQIMNGSA-N 1 0 289.419 3.721 20 10 CHCDRO CCN(Cc1ccccc1O)Cc1cncc(F)c1Cl ZINC001235501351 1130748883 /nfs/dbraw/zinc/74/88/83/1130748883.db2.gz XWHSEIBTEVJSSO-UHFFFAOYSA-N 1 0 294.757 3.602 20 10 CHCDRO Cc1ccc(O)c(C[N@H+]2CC[C@@]3(CC[C@H](C)C3)C2)c1 ZINC000781928118 1130749825 /nfs/dbraw/zinc/74/98/25/1130749825.db2.gz JRNICHIFXNTOSV-WMLDXEAASA-N 1 0 259.393 3.713 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CC[C@]3(CC[C@@H](C)C3)C2)c1O ZINC000781929145 1130750068 /nfs/dbraw/zinc/75/00/68/1130750068.db2.gz PXLYQZLUYPCNCL-KDOFPFPSSA-N 1 0 289.419 3.803 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)Cc2ccc3[nH]ccc3c2)cc1 ZINC000813334393 1130761617 /nfs/dbraw/zinc/76/16/17/1130761617.db2.gz ILBIHAGLSZAALW-UHFFFAOYSA-N 1 0 293.414 3.866 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2c(O)ccc3ccncc32)[C@H]2CCCC[C@H]12 ZINC000782274315 1130767607 /nfs/dbraw/zinc/76/76/07/1130767607.db2.gz AMVMHJPMYYANNE-SIIHOXLZSA-N 1 0 296.414 3.951 20 10 CHCDRO COc1cc(C[N@@H+]2C[C@H](C)[C@@H]3CCCC[C@H]32)c(O)cc1C ZINC000782278909 1130767962 /nfs/dbraw/zinc/76/79/62/1130767962.db2.gz ZMMXCAZGJJSYTH-CWRNSKLLSA-N 1 0 289.419 3.720 20 10 CHCDRO Nc1ccc(C[N@@H+]2CC[C@H](c3ccccc3Cl)C2)cc1 ZINC001235826583 1130783856 /nfs/dbraw/zinc/78/38/56/1130783856.db2.gz YZIFFCSCCGEFQW-AWEZNQCLSA-N 1 0 286.806 3.912 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]CCCc2ccsc2)c1 ZINC000782985324 1130792791 /nfs/dbraw/zinc/79/27/91/1130792791.db2.gz NXLQXINBIFKFHX-GFCCVEGCSA-N 1 0 291.416 3.746 20 10 CHCDRO C[C@H]([NH2+]CC1CC(F)(F)C1)c1cc2c(cc1O)CCCC2 ZINC000813873090 1130792927 /nfs/dbraw/zinc/79/29/27/1130792927.db2.gz OOEDVMXKLSEXFN-NSHDSACASA-N 1 0 295.373 3.967 20 10 CHCDRO Cc1ccoc1C[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000813882618 1130793646 /nfs/dbraw/zinc/79/36/46/1130793646.db2.gz FILWEPABUYIDMC-JQWIXIFHSA-N 1 0 275.323 3.771 20 10 CHCDRO CCN(CC)[C@H](C[NH2+][C@@H](C)c1ccccc1O)CC(C)C ZINC000783500518 1130830912 /nfs/dbraw/zinc/83/09/12/1130830912.db2.gz WOXDURGVLCKMOU-HOTGVXAUSA-N 1 0 292.467 3.799 20 10 CHCDRO C[C@H]([NH2+][C@H]1C[C@@H]2[C@H](C1)C2(C)C)c1ccc(N(C)C)cc1 ZINC001170728095 1130831951 /nfs/dbraw/zinc/83/19/51/1130831951.db2.gz ROXGEANYVJKTQU-SDNTUTLCSA-N 1 0 272.436 3.838 20 10 CHCDRO Cc1ccncc1[C@H](C)[NH2+][C@@H](C)c1ccccc1O ZINC000783519903 1130833844 /nfs/dbraw/zinc/83/38/44/1130833844.db2.gz MXRRWDVFRROVKW-STQMWFEESA-N 1 0 256.349 3.507 20 10 CHCDRO C[C@H]([NH2+][C@H]1COc2ccc(Cl)cc21)c1ccccc1O ZINC000783518826 1130834397 /nfs/dbraw/zinc/83/43/97/1130834397.db2.gz PBJKIDLPSJJQCH-HZMBPMFUSA-N 1 0 289.762 3.830 20 10 CHCDRO C[C@@H]([NH2+]CCc1cc(F)c(F)c(F)c1)c1ccccc1O ZINC000783533089 1130835283 /nfs/dbraw/zinc/83/52/83/1130835283.db2.gz NNOQWGJQUNCRLO-SNVBAGLBSA-N 1 0 295.304 3.703 20 10 CHCDRO Oc1ccccc1C[N@H+](CC[C@@H]1CCOC1)C1CCCC1 ZINC000783565523 1130837607 /nfs/dbraw/zinc/83/76/07/1130837607.db2.gz BQGFBWVFXPDGBT-OAHLLOKOSA-N 1 0 289.419 3.563 20 10 CHCDRO CC(C)(C)CC[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000783596498 1130842310 /nfs/dbraw/zinc/84/23/10/1130842310.db2.gz LEIJGTKUXYWLGL-UHFFFAOYSA-N 1 0 292.492 3.766 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCS[C@H]2C)cc1F ZINC000783628745 1130843576 /nfs/dbraw/zinc/84/35/76/1130843576.db2.gz LUNLMTYOWGOYJX-WFASDCNBSA-N 1 0 296.455 3.656 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCCC3(CCCC3)C2)c1O ZINC000783746534 1130852865 /nfs/dbraw/zinc/85/28/65/1130852865.db2.gz ZLCXKTUSHWGQDY-UHFFFAOYSA-N 1 0 259.393 3.857 20 10 CHCDRO CC(C)(C)[C@H]1CC[N@H+](Cc2c(O)ccc3ccncc32)C1 ZINC000784034276 1130871680 /nfs/dbraw/zinc/87/16/80/1130871680.db2.gz VEVSSJGGRYJRRL-AWEZNQCLSA-N 1 0 284.403 3.808 20 10 CHCDRO CS[C@@H](C[NH2+]Cc1c(O)cccc1Cl)C(C)(C)C ZINC000784626410 1130912905 /nfs/dbraw/zinc/91/29/05/1130912905.db2.gz SVHHEOUVAKSSJN-ZDUSSCGKSA-N 1 0 287.856 3.913 20 10 CHCDRO CS[C@H](C[NH2+]Cc1ccc(N(C)C)c(F)c1)C(C)(C)C ZINC000784626348 1130913791 /nfs/dbraw/zinc/91/37/91/1130913791.db2.gz QVCMKCSYUONBKT-OAHLLOKOSA-N 1 0 298.471 3.759 20 10 CHCDRO COc1ccc(C2(C[NH2+]Cc3ccccc3O)CCC2)cc1 ZINC000784653517 1130914772 /nfs/dbraw/zinc/91/47/72/1130914772.db2.gz KBVPOWARVANHQA-UHFFFAOYSA-N 1 0 297.398 3.612 20 10 CHCDRO C[C@H]1OCC[C@@]1(C)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000784640494 1130914979 /nfs/dbraw/zinc/91/49/79/1130914979.db2.gz PGSZWINAANMFGH-AUUYWEPGSA-N 1 0 297.398 3.716 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H]2C=CCCCCC2)c1 ZINC000815083433 1130957508 /nfs/dbraw/zinc/95/75/08/1130957508.db2.gz YDVPXOCFQZHVTN-ZIAGYGMSSA-N 1 0 275.392 3.940 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H]2CSC[C@@H]2C)cc1 ZINC000797063276 1130957982 /nfs/dbraw/zinc/95/79/82/1130957982.db2.gz AXYJTQBHEFFNQW-XEZPLFJOSA-N 1 0 278.465 3.545 20 10 CHCDRO Cc1cc(C[N@@H+]2CCC=C(c3ccco3)C2)ccc1N(C)C ZINC000815116372 1130958764 /nfs/dbraw/zinc/95/87/64/1130958764.db2.gz KPWHCQUCBPTHHP-UHFFFAOYSA-N 1 0 296.414 3.943 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000815151030 1130966924 /nfs/dbraw/zinc/96/69/24/1130966924.db2.gz SPUMHTGNHMHZGO-KBPBESRZSA-N 1 0 287.790 3.939 20 10 CHCDRO CCOc1cccc(C[NH2+]C2CC(C(C)(C)C)C2)c1O ZINC000815146731 1130967035 /nfs/dbraw/zinc/96/70/35/1130967035.db2.gz KINZLBRCJRAGCN-UHFFFAOYSA-N 1 0 277.408 3.705 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@H](C)c2ccncc2)c(O)c1 ZINC000815586994 1131005513 /nfs/dbraw/zinc/00/55/13/1131005513.db2.gz WSDSFEWLVJWSML-LSDHHAIUSA-N 1 0 284.403 3.858 20 10 CHCDRO CCc1ccc(C[N@H+](C)CCc2ccccc2)c(O)c1 ZINC001236784327 1131006677 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YPTWIOPPXNGZQZ-JKSUJKDBSA-N 1 0 285.387 3.593 20 10 CHCDRO Cc1cccc(C[N@@H+](C)Cc2cc(F)cc(C)c2O)c1 ZINC001238059002 1131165550 /nfs/dbraw/zinc/16/55/50/1131165550.db2.gz XFAHNXMNPVBTTO-UHFFFAOYSA-N 1 0 273.351 3.780 20 10 CHCDRO Cc1cc(F)cc(C[N@H+](C)CCCc2ccccc2)c1O ZINC001238062348 1131167090 /nfs/dbraw/zinc/16/70/90/1131167090.db2.gz OXDZVNCAKUSMBJ-UHFFFAOYSA-N 1 0 287.378 3.904 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)Cc1cc(F)cc(C)c1O ZINC001238070771 1131168138 /nfs/dbraw/zinc/16/81/38/1131168138.db2.gz PBTVHHMJXVWDJP-UHFFFAOYSA-N 1 0 289.350 3.567 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccncc1Cl ZINC000817574470 1131172197 /nfs/dbraw/zinc/17/21/97/1131172197.db2.gz ONJOJCZJALLKLJ-LLVKDONJSA-N 1 0 288.778 3.521 20 10 CHCDRO CC[C@@H]([NH2+]CC1([NH3+])CCCCC1)c1cccc(Cl)c1[O-] ZINC000817938603 1131188066 /nfs/dbraw/zinc/18/80/66/1131188066.db2.gz OFWGSEAZXOXIJD-CQSZACIVSA-N 1 0 296.842 3.748 20 10 CHCDRO CC(C)[C@@H]1CCCC[C@@H]1[NH2+]CCc1ccc(N)cc1 ZINC000817955990 1131190669 /nfs/dbraw/zinc/19/06/69/1131190669.db2.gz MYZWCXYMBYBJJR-IRXDYDNUSA-N 1 0 260.425 3.616 20 10 CHCDRO C[C@H]([NH2+]CCc1ccc(N)cc1)c1ccc2c(c1)CCC2 ZINC000817955790 1131190673 /nfs/dbraw/zinc/19/06/73/1131190673.db2.gz HUHHWKSDWIJHHY-AWEZNQCLSA-N 1 0 280.415 3.651 20 10 CHCDRO C[C@H]1C[C@@H]([NH2+]CCc2ccc(N)cc2)c2ccccc21 ZINC000817956701 1131190729 /nfs/dbraw/zinc/19/07/29/1131190729.db2.gz AVNKKXTUIYOJDG-SCLBCKFNSA-N 1 0 266.388 3.649 20 10 CHCDRO Nc1ccc(CC[NH2+][C@H]2CCCC23CCCC3)cc1 ZINC000817956830 1131190738 /nfs/dbraw/zinc/19/07/38/1131190738.db2.gz DTTRRXGMNZOLBC-INIZCTEOSA-N 1 0 258.409 3.514 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCc2ccc(N)cc2)s1 ZINC000817955646 1131190743 /nfs/dbraw/zinc/19/07/43/1131190743.db2.gz DPNGCDCIFVWRKF-LBPRGKRZSA-N 1 0 260.406 3.532 20 10 CHCDRO Cc1cc(F)ccc1[C@H](C)[NH2+]CCc1ccc(N)cc1 ZINC000817958190 1131191207 /nfs/dbraw/zinc/19/12/07/1131191207.db2.gz SSVFKHOWMNKAQY-ZDUSSCGKSA-N 1 0 272.367 3.610 20 10 CHCDRO CC[C@H]([NH2+]CC([NH3+])(CC)CC)c1cccc(Cl)c1[O-] ZINC000817959696 1131191398 /nfs/dbraw/zinc/19/13/98/1131191398.db2.gz GRTYGHPMEMJUPL-ZDUSSCGKSA-N 1 0 284.831 3.604 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccc(N)cc1)c1ccc(OC)cc1 ZINC000817956419 1131191466 /nfs/dbraw/zinc/19/14/66/1131191466.db2.gz YQPPUYFZBKVNIR-SFHVURJKSA-N 1 0 284.403 3.561 20 10 CHCDRO Cc1ccc(O)c([C@H](C)NCC[NH2+]C2CCCCCC2)c1 ZINC000817959622 1131191489 /nfs/dbraw/zinc/19/14/89/1131191489.db2.gz DRUSQCDGIFWEIS-HNNXBMFYSA-N 1 0 290.451 3.664 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]C/C=C/C2CC2)c1O ZINC001117712578 1131193720 /nfs/dbraw/zinc/19/37/20/1131193720.db2.gz IONZZEULGNRRNF-PGLGOXFNSA-N 1 0 265.784 3.971 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]Cc1ccc3c(c1)CCCN3)CC2 ZINC000817978153 1131195198 /nfs/dbraw/zinc/19/51/98/1131195198.db2.gz XJDPPTGSZNWZLH-KRWDZBQOSA-N 1 0 294.398 3.527 20 10 CHCDRO Oc1ccccc1C[NH2+][C@@H]1CCc2cccc(Cl)c2C1 ZINC001170893785 1131206748 /nfs/dbraw/zinc/20/67/48/1131206748.db2.gz NNAPSFQPUYUENX-CQSZACIVSA-N 1 0 287.790 3.693 20 10 CHCDRO Cc1ccc(Cl)c(C[N@@H+]2CCc3cccc(O)c3C2)c1 ZINC001238569768 1131218445 /nfs/dbraw/zinc/21/84/45/1131218445.db2.gz SGTSVORIANXEME-UHFFFAOYSA-N 1 0 287.790 3.912 20 10 CHCDRO COC1CC(CC[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)C1 ZINC001118428211 1131225817 /nfs/dbraw/zinc/22/58/17/1131225817.db2.gz RICSUYQLPXXSMM-PPWQZUPISA-N 1 0 289.419 3.654 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)Cc2ccncc2C)cc1 ZINC000823390383 1131424692 /nfs/dbraw/zinc/42/46/92/1131424692.db2.gz GHACZORTDWEENK-UHFFFAOYSA-N 1 0 297.446 3.868 20 10 CHCDRO Cc1cccc(C[NH2+]Cc2ccc(N(C)C)c(F)c2)c1F ZINC000823736481 1131439575 /nfs/dbraw/zinc/43/95/75/1131439575.db2.gz CZKGZBXQFACKBZ-UHFFFAOYSA-N 1 0 290.357 3.629 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@H](C)Cc1ccoc1 ZINC000824291753 1131461934 /nfs/dbraw/zinc/46/19/34/1131461934.db2.gz HAEBETQXFAGOQS-CQSZACIVSA-N 1 0 272.392 3.586 20 10 CHCDRO CCOc1cccc(C[N@H+](CC)Cc2ccccc2O)c1 ZINC001138101196 1131464132 /nfs/dbraw/zinc/46/41/32/1131464132.db2.gz PVHRLOMVLALHCT-UHFFFAOYSA-N 1 0 285.387 3.813 20 10 CHCDRO c1ccc2c(c1)SC[C@@H]2C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000824482923 1131470335 /nfs/dbraw/zinc/47/03/35/1131470335.db2.gz FAICJNHNKFJVBH-HNNXBMFYSA-N 1 0 297.423 3.601 20 10 CHCDRO COc1cc(C[N@H+](C)C(C)C)c(O)c(C(C)(C)C)c1 ZINC000824490255 1131470465 /nfs/dbraw/zinc/47/04/65/1131470465.db2.gz DTOXYGCEXVOYBR-UHFFFAOYSA-N 1 0 265.397 3.539 20 10 CHCDRO COc1cccc(C[NH2+]CC[C@@H]2CCc3ccccc32)c1O ZINC000824548960 1131473670 /nfs/dbraw/zinc/47/36/70/1131473670.db2.gz UFDRALDYNDDPLT-HNNXBMFYSA-N 1 0 297.398 3.611 20 10 CHCDRO Cc1c(CN2CCC(F)(F)[C@H](F)C2)c2ccccc2n1C ZINC001138252723 1131482452 /nfs/dbraw/zinc/48/24/52/1131482452.db2.gz RVMUHDBAKYOONP-OAHLLOKOSA-N 1 0 296.336 3.666 20 10 CHCDRO CC[N@H+](Cc1c2ccccc2n(C)c1C)Cc1ccccn1 ZINC001138258016 1131483048 /nfs/dbraw/zinc/48/30/48/1131483048.db2.gz IKXPBWJONRYKHY-UHFFFAOYSA-N 1 0 293.414 3.904 20 10 CHCDRO Cc1c(C[N@H+](C)CCc2cccnc2)c2ccccc2n1C ZINC001138258128 1131483566 /nfs/dbraw/zinc/48/35/66/1131483566.db2.gz MMNNCQVXUPYSMF-UHFFFAOYSA-N 1 0 293.414 3.556 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@@H]2CCO[C@@H](C(C)C)C2)cc1C ZINC000824798572 1131485259 /nfs/dbraw/zinc/48/52/59/1131485259.db2.gz FAFANMKPFAQOBU-CRAIPNDOSA-N 1 0 291.435 3.550 20 10 CHCDRO CCOc1ccc(C[NH2+]C23CCC(CC2)CC3)c(O)c1 ZINC000824936360 1131489445 /nfs/dbraw/zinc/48/94/45/1131489445.db2.gz XHTUXLASCZAHSZ-UHFFFAOYSA-N 1 0 275.392 3.603 20 10 CHCDRO Cc1cccc2c1C[N@H+](Cc1ccc3c(c1)CCCN3C)C2 ZINC001138354271 1131494104 /nfs/dbraw/zinc/49/41/04/1131494104.db2.gz CQHPGPGTBAVWDM-UHFFFAOYSA-N 1 0 292.426 3.893 20 10 CHCDRO C[C@H](CN1CCCCC1)[NH2+]Cc1ccc2ccccc2c1O ZINC000825101954 1131495644 /nfs/dbraw/zinc/49/56/44/1131495644.db2.gz IRNGJUWHCQWAGY-OAHLLOKOSA-N 1 0 298.430 3.509 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CC3(CCC3)[C@H]2c2ccco2)c1 ZINC000825104529 1131495894 /nfs/dbraw/zinc/49/58/94/1131495894.db2.gz ZKMQXUVEDRRGOY-QGZVFWFLSA-N 1 0 299.370 3.721 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)C(C)(C)C)c(OC)c1 ZINC001138389435 1131496808 /nfs/dbraw/zinc/49/68/08/1131496808.db2.gz OUUAAWSWZFLUNB-UHFFFAOYSA-N 1 0 278.440 3.772 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@H]2C)c(OC)c1 ZINC001138387343 1131497183 /nfs/dbraw/zinc/49/71/83/1131497183.db2.gz CECMGVXOZPQKHN-CQSZACIVSA-N 1 0 276.424 3.526 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@H](C)C2)c(OC)c1 ZINC001138387306 1131497549 /nfs/dbraw/zinc/49/75/49/1131497549.db2.gz APKTVBJREYOHRC-HNNXBMFYSA-N 1 0 290.451 3.773 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H]3C[C@@H]32)c(OC)c1 ZINC001138391554 1131498405 /nfs/dbraw/zinc/49/84/05/1131498405.db2.gz FYDSYSPDGFDKDS-PBHICJAKSA-N 1 0 288.435 3.526 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)CC2CCC2)c(OC)c1 ZINC001138389873 1131498850 /nfs/dbraw/zinc/49/88/50/1131498850.db2.gz SRPLNEHSBWVEJF-UHFFFAOYSA-N 1 0 290.451 3.773 20 10 CHCDRO Cc1occc1C[NH2+]Cc1cc(Cl)c(C)cc1O ZINC000825131367 1131500197 /nfs/dbraw/zinc/50/01/97/1131500197.db2.gz MRBVCQVEGNVXHQ-UHFFFAOYSA-N 1 0 265.740 3.545 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CCc3cccc(O)c3C2)c(C)c1 ZINC001138436346 1131505749 /nfs/dbraw/zinc/50/57/49/1131505749.db2.gz ZJSNEYNPEVTNPD-UHFFFAOYSA-N 1 0 297.398 3.658 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@@H](C)c2ccncc2)cc1Cl ZINC000825326052 1131506497 /nfs/dbraw/zinc/50/64/97/1131506497.db2.gz MAYKSLZMDASICT-GFCCVEGCSA-N 1 0 290.794 3.642 20 10 CHCDRO CS[C@@H]1CC[C@@H]([NH2+]Cc2cc(Cl)c(C)cc2O)C1 ZINC000825320949 1131506630 /nfs/dbraw/zinc/50/66/30/1131506630.db2.gz QPISMYVCNIKGHP-VXGBXAGGSA-N 1 0 285.840 3.728 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(Cl)c(C)cc1O)C1CCOCC1 ZINC000825332066 1131507319 /nfs/dbraw/zinc/50/73/19/1131507319.db2.gz VZLZFIXJKIKNJZ-HNNXBMFYSA-N 1 0 297.826 3.649 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H]2CCO[C@@H](C(C)C)C2)cc1Cl ZINC000825406797 1131511369 /nfs/dbraw/zinc/51/13/69/1131511369.db2.gz YZNRRCVCYWKMOB-CZUORRHYSA-N 1 0 297.826 3.647 20 10 CHCDRO CCC[N@H+](Cc1ccc(N2CCOCC2)cc1)[C@@H](C)CC ZINC001138495624 1131513811 /nfs/dbraw/zinc/51/38/11/1131513811.db2.gz ZWKUDZSAGLWMMQ-INIZCTEOSA-N 1 0 290.451 3.534 20 10 CHCDRO Cc1cc(NCc2ccc(N(C)C)cc2)c2ccccc2[nH+]1 ZINC000844161846 1131535834 /nfs/dbraw/zinc/53/58/34/1131535834.db2.gz CQMLEEZHQOTVND-UHFFFAOYSA-N 1 0 291.398 3.643 20 10 CHCDRO Cc1cccc(Cl)c1C[N@@H+]1CCc2cccc(O)c2C1 ZINC001138721737 1131542029 /nfs/dbraw/zinc/54/20/29/1131542029.db2.gz HRXMVUGPHJYLQA-UHFFFAOYSA-N 1 0 287.790 3.912 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CCC[C@]3(CC3(F)F)C2)cc1 ZINC000844442461 1131566173 /nfs/dbraw/zinc/56/61/73/1131566173.db2.gz YJHXRWYUFPJVOA-INIZCTEOSA-N 1 0 294.389 3.764 20 10 CHCDRO CCCOc1ccc(C[NH2+][C@@H](CO)C[C@@H](C)CC)cc1C ZINC001202922907 1131602677 /nfs/dbraw/zinc/60/26/77/1131602677.db2.gz VFHURSQBJGDPTP-WMLDXEAASA-N 1 0 293.451 3.671 20 10 CHCDRO Cc1cc(C[N@@H+]2CCc3ccc(F)cc3C2)ccc1N(C)C ZINC001139673141 1131627618 /nfs/dbraw/zinc/62/76/18/1131627618.db2.gz QFCPJAWYUOWEDA-UHFFFAOYSA-N 1 0 298.405 3.758 20 10 CHCDRO CC[N@H+](Cc1ccccc1F)Cc1cc(F)ccc1O ZINC001140058998 1131660027 /nfs/dbraw/zinc/66/00/27/1131660027.db2.gz SMCPYEWJXSLTMN-UHFFFAOYSA-N 1 0 277.314 3.693 20 10 CHCDRO CC[N@H+](Cc1ccc(C)c(OC)c1)Cc1ccccc1O ZINC001140160158 1131670484 /nfs/dbraw/zinc/67/04/84/1131670484.db2.gz QGPQRWBWAAEITN-UHFFFAOYSA-N 1 0 285.387 3.731 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCc3c(C)cccc3C2)c1O ZINC001140178212 1131673216 /nfs/dbraw/zinc/67/32/16/1131673216.db2.gz CTEAOISMRJCMSE-UHFFFAOYSA-N 1 0 281.399 3.876 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)CCC(F)(F)F)c1 ZINC000845970866 1131673440 /nfs/dbraw/zinc/67/34/40/1131673440.db2.gz DUWRINQLHSTIFN-NXEZZACHSA-N 1 0 291.313 3.782 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cscc2Cl)c1 ZINC000845972731 1131673635 /nfs/dbraw/zinc/67/36/35/1131673635.db2.gz TWZSIKSQDJCTHB-SECBINFHSA-N 1 0 297.807 3.967 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cccc3c2CCC3)c1 ZINC000845971559 1131673786 /nfs/dbraw/zinc/67/37/86/1131673786.db2.gz LLNSUMXDWKJVPW-CYBMUJFWSA-N 1 0 297.398 3.740 20 10 CHCDRO Cc1ccc(C)c(C[NH+]2CC3CCC(CC3)C2)c1O ZINC001140184487 1131674429 /nfs/dbraw/zinc/67/44/29/1131674429.db2.gz WFTKXLQAJISOGT-UHFFFAOYSA-N 1 0 259.393 3.631 20 10 CHCDRO CC[C@H]([NH2+][C@H](COC)CC(C)(C)C)c1ccccc1O ZINC000845993350 1131679261 /nfs/dbraw/zinc/67/92/61/1131679261.db2.gz YGPOALJTIORNFW-ZFWWWQNUSA-N 1 0 279.424 3.884 20 10 CHCDRO COc1ccc(C)cc1CC[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000834496497 1131681091 /nfs/dbraw/zinc/68/10/91/1131681091.db2.gz LHFLDGDIHDLSCK-MRXNPFEDSA-N 1 0 297.398 3.529 20 10 CHCDRO C[C@H]([NH2+]Cc1cc(Cl)ccc1O)C1CCSCC1 ZINC000846055876 1131685675 /nfs/dbraw/zinc/68/56/75/1131685675.db2.gz RBTBGLODWYNRFV-JTQLQIEISA-N 1 0 285.840 3.667 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]C1CCC2(CCCO2)CC1 ZINC000846056655 1131685690 /nfs/dbraw/zinc/68/56/90/1131685690.db2.gz WAZZXUKVKUOITR-UHFFFAOYSA-N 1 0 295.810 3.627 20 10 CHCDRO CC[C@@H]([NH2+]CCCSc1nccs1)c1ccncc1 ZINC000834595245 1131686508 /nfs/dbraw/zinc/68/65/08/1131686508.db2.gz WMHXLBJYZHBAGM-CYBMUJFWSA-N 1 0 293.461 3.761 20 10 CHCDRO C[C@@H](C[NH2+][C@@H]1CCc2cccc(O)c21)Cc1cccs1 ZINC000834603233 1131687777 /nfs/dbraw/zinc/68/77/77/1131687777.db2.gz XEGWGRMGZGWWON-IUODEOHRSA-N 1 0 287.428 3.909 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CC[C@]3(CC3(F)F)C2)cc1 ZINC000846118632 1131688130 /nfs/dbraw/zinc/68/81/30/1131688130.db2.gz YHTMWVBALQMOAM-INIZCTEOSA-N 1 0 294.389 3.764 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@H]1CCc3ccc(F)cc31)CC2 ZINC000834640887 1131689930 /nfs/dbraw/zinc/68/99/30/1131689930.db2.gz SAQPWIFGYPBFLC-JKSUJKDBSA-N 1 0 283.346 3.796 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1cccc(OC)c1O)c1ccncc1 ZINC000846148606 1131691437 /nfs/dbraw/zinc/69/14/37/1131691437.db2.gz RQLGMIHBHIXEOG-SWLSCSKDSA-N 1 0 286.375 3.598 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H](c2cccnc2)C2CC2)c1O ZINC000846157650 1131691941 /nfs/dbraw/zinc/69/19/41/1131691941.db2.gz NPXGVWZTQZSLSL-YVEFUNNKSA-N 1 0 298.386 3.598 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CCCCCCSC)c1O ZINC000846161679 1131692953 /nfs/dbraw/zinc/69/29/53/1131692953.db2.gz ANYYEYVBYSEZOO-ZDUSSCGKSA-N 1 0 297.464 3.975 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]C2(c3ccccc3)CC2)c1O ZINC000846164610 1131693118 /nfs/dbraw/zinc/69/31/18/1131693118.db2.gz VLXOBUISJQEGDB-CYBMUJFWSA-N 1 0 283.371 3.741 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H](C)CCC(C)C)c1O ZINC000846136182 1131694018 /nfs/dbraw/zinc/69/40/18/1131694018.db2.gz HGGOUBIUXKUPJC-OLZOCXBDSA-N 1 0 265.397 3.876 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H]2CCC[C@H](C)C2)c1O ZINC000846141834 1131694970 /nfs/dbraw/zinc/69/49/70/1131694970.db2.gz AKBASQLMMAJAIG-AVGNSLFASA-N 1 0 263.381 3.630 20 10 CHCDRO CO[C@@H]1CCCC[C@H]1[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000846200622 1131699620 /nfs/dbraw/zinc/69/96/20/1131699620.db2.gz GOWSUFYEIJDJSZ-IKVITTDRSA-N 1 0 293.382 3.627 20 10 CHCDRO Oc1cccc(Cl)c1C[N@H+]1C[C@H]2CC[C@@H](C1)C2(F)F ZINC001140338769 1131702985 /nfs/dbraw/zinc/70/29/85/1131702985.db2.gz OZPNFNVEFAONOQ-AOOOYVTPSA-N 1 0 287.737 3.523 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]C1(Cc3ccccc3)CC1)CC2 ZINC000834770781 1131704572 /nfs/dbraw/zinc/70/45/72/1131704572.db2.gz XZSSACZJDTWEEQ-INIZCTEOSA-N 1 0 279.383 3.744 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccnc(C)c1)c1ccc(N(C)C)cc1 ZINC000834859934 1131712642 /nfs/dbraw/zinc/71/26/42/1131712642.db2.gz MCIFVFZZKVSHTO-SFHVURJKSA-N 1 0 283.419 3.697 20 10 CHCDRO CO[C@H](C[NH2+][C@@H](C)c1ccc(C)cc1O)Cc1ccccc1 ZINC000834856650 1131712731 /nfs/dbraw/zinc/71/27/31/1131712731.db2.gz SVIPGLOHAGDMEO-RDJZCZTQSA-N 1 0 299.414 3.609 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)CCCCO)c1cc(Cl)ccc1O ZINC000834877169 1131716561 /nfs/dbraw/zinc/71/65/61/1131716561.db2.gz HCQUJFHAHJZINH-BXUZGUMPSA-N 1 0 285.815 3.637 20 10 CHCDRO CO[C@](C)(C[NH2+][C@@H](C)c1cc(C)ccc1O)c1ccccc1 ZINC000834884117 1131717326 /nfs/dbraw/zinc/71/73/26/1131717326.db2.gz KKLVLKPLDJRVDW-HNAYVOBHSA-N 1 0 299.414 3.913 20 10 CHCDRO CO[C@](C)(C[NH2+][C@H]1CCc2cccc(O)c21)c1ccccc1 ZINC000834885987 1131718196 /nfs/dbraw/zinc/71/81/96/1131718196.db2.gz ZCRXIGBQSLMVPI-QFBILLFUSA-N 1 0 297.398 3.531 20 10 CHCDRO Cc1ccncc1C[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000834886331 1131718382 /nfs/dbraw/zinc/71/83/82/1131718382.db2.gz CDVKYDJLBFXHTO-CQSZACIVSA-N 1 0 296.414 3.825 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2cnccc2C)cc1 ZINC000834886296 1131718471 /nfs/dbraw/zinc/71/84/71/1131718471.db2.gz BIWXOMAXVFXOAP-HNNXBMFYSA-N 1 0 283.419 3.697 20 10 CHCDRO CO[C@@H]1CCC[C@H]1[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O ZINC000834885860 1131718846 /nfs/dbraw/zinc/71/88/46/1131718846.db2.gz FSEDJXNZFYZVHH-ZLKJLUDKSA-N 1 0 283.799 3.572 20 10 CHCDRO Cc1ccncc1C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000834887219 1131719371 /nfs/dbraw/zinc/71/93/71/1131719371.db2.gz QCZGDBMUERYQBT-BXUZGUMPSA-N 1 0 286.350 3.573 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cnccc1C)c1ccc(N(C)C)cc1 ZINC000834887103 1131719390 /nfs/dbraw/zinc/71/93/90/1131719390.db2.gz HNQYJQDTZFGQMI-GOSISDBHSA-N 1 0 283.419 3.697 20 10 CHCDRO CCn1ccnc1[C@@H](C)[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000834893301 1131720268 /nfs/dbraw/zinc/72/02/68/1131720268.db2.gz FHOBCAYPTALJMO-WDEREUQCSA-N 1 0 293.798 3.674 20 10 CHCDRO CCn1ccnc1[C@@H](C)[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000834896112 1131722283 /nfs/dbraw/zinc/72/22/83/1131722283.db2.gz UQDFVXSPCNFEHV-UONOGXRCSA-N 1 0 287.407 3.637 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)Cc2ccc3c(c2)CCC3)cc1 ZINC001203035248 1131726532 /nfs/dbraw/zinc/72/65/32/1131726532.db2.gz XASUXPMKQVIRFB-UHFFFAOYSA-N 1 0 294.442 3.873 20 10 CHCDRO Cc1cc(C)c(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)cn1 ZINC000834903736 1131726901 /nfs/dbraw/zinc/72/69/01/1131726901.db2.gz QIVXZXDWUUAOFY-HNNXBMFYSA-N 1 0 284.403 3.872 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]C1CCC(OC(F)F)CC1)CC2 ZINC000834906623 1131727986 /nfs/dbraw/zinc/72/79/86/1131727986.db2.gz YPYFTJDSLZOORY-WXRRBKDZSA-N 1 0 297.345 3.520 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H](C)[C@H](OC)C2CC2)cc1 ZINC000834904442 1131728918 /nfs/dbraw/zinc/72/89/18/1131728918.db2.gz OEBQLHBVZGMQPP-IYOUNJFTSA-N 1 0 290.451 3.607 20 10 CHCDRO CC[C@H]([NH2+]CCC1CC(F)(F)C1)c1ccccc1O ZINC000834908154 1131730332 /nfs/dbraw/zinc/73/03/32/1131730332.db2.gz HGHVVCMFAUXEDK-ZDUSSCGKSA-N 1 0 269.335 3.868 20 10 CHCDRO Cc1ccc(CC[NH2+][C@@H](C)c2ccc(C)c(C)c2O)nc1 ZINC000834909470 1131730373 /nfs/dbraw/zinc/73/03/73/1131730373.db2.gz ODWNAXLVJAIJLZ-HNNXBMFYSA-N 1 0 284.403 3.606 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccc(C)cn1)c1ccc(N(C)C)cc1 ZINC000834909004 1131730378 /nfs/dbraw/zinc/73/03/78/1131730378.db2.gz ICUNNEACKKSSAM-IBGZPJMESA-N 1 0 297.446 3.739 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1CCOC(C)(C)C1)c1ccc(C)cc1O ZINC000834909129 1131730723 /nfs/dbraw/zinc/73/07/23/1131730723.db2.gz JHSCJEXSVLFWJI-GOEBONIOSA-N 1 0 291.435 3.947 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCOC(C)(C)C2)c(O)c1C ZINC000834910330 1131730737 /nfs/dbraw/zinc/73/07/37/1131730737.db2.gz OEFGBMQIGUOEHV-CABCVRRESA-N 1 0 291.435 3.865 20 10 CHCDRO CCO[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000834913656 1131731575 /nfs/dbraw/zinc/73/15/75/1131731575.db2.gz QHVJNYAUIYATDA-YSVLISHTSA-N 1 0 277.408 3.699 20 10 CHCDRO Oc1cc(Cl)ccc1C[N@@H+]1CCCc2ccccc2C1 ZINC001140467289 1131752184 /nfs/dbraw/zinc/75/21/84/1131752184.db2.gz USJXFYWZGRMAAU-UHFFFAOYSA-N 1 0 287.790 3.994 20 10 CHCDRO C[C@@H](CCc1ccco1)[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC000835033685 1131760959 /nfs/dbraw/zinc/76/09/59/1131760959.db2.gz WRALLKSOLTXLLK-LEXSJLIMSA-N 1 0 298.430 3.970 20 10 CHCDRO C[C@H](CCc1ccco1)[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC000835033686 1131761020 /nfs/dbraw/zinc/76/10/20/1131761020.db2.gz WRALLKSOLTXLLK-MQDFFIGUSA-N 1 0 298.430 3.970 20 10 CHCDRO COc1cccc(C[NH2+]C/C=C/c2ccc(N(C)C)cc2)c1 ZINC000835032720 1131761506 /nfs/dbraw/zinc/76/15/06/1131761506.db2.gz ITGUUZCTCASTBT-FNORWQNLSA-N 1 0 296.414 3.564 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+][C@@H]2CCC(F)(F)C2)cc1 ZINC000835042912 1131762023 /nfs/dbraw/zinc/76/20/23/1131762023.db2.gz LVOINSAXMLNDPH-RDFMZFSFSA-N 1 0 280.362 3.543 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+][C@H]2CCC(F)(F)C2)cc1 ZINC000835042914 1131762689 /nfs/dbraw/zinc/76/26/89/1131762689.db2.gz LVOINSAXMLNDPH-XGACYXMMSA-N 1 0 280.362 3.543 20 10 CHCDRO C[C@H](c1ccncc1)[N@H+](C)C/C=C\c1ccc(N(C)C)cc1 ZINC000835046971 1131763441 /nfs/dbraw/zinc/76/34/41/1131763441.db2.gz AZQDGUXOEXAWBV-OGZRUICASA-N 1 0 295.430 3.854 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]CCCC(C)(F)F)cc1 ZINC000835053940 1131766256 /nfs/dbraw/zinc/76/62/56/1131766256.db2.gz GDPNMNXPESOYFP-XQRVVYSFSA-N 1 0 282.378 3.791 20 10 CHCDRO C[C@@H]1C[N@H+](C/C=C/c2ccc(N(C)C)cc2)CCC1(F)F ZINC000835052564 1131767239 /nfs/dbraw/zinc/76/72/39/1131767239.db2.gz HGIPBKOSEGXUTD-ISZGNANSSA-N 1 0 294.389 3.743 20 10 CHCDRO C[C@@H]1CC[C@@H](C[NH2+]Cc2cc(-c3ccccc3)ccc2O)O1 ZINC000835088830 1131771476 /nfs/dbraw/zinc/77/14/76/1131771476.db2.gz VIPOMLSSWNAOCV-KDOFPFPSSA-N 1 0 297.398 3.716 20 10 CHCDRO COc1cccc([C@@H]2CC[N@H+](Cc3cc(C)ccc3O)C2)c1 ZINC001140623181 1131830818 /nfs/dbraw/zinc/83/08/18/1131830818.db2.gz IRIFABLQKZGZKQ-MRXNPFEDSA-N 1 0 297.398 3.699 20 10 CHCDRO Cc1ccc(O)c(C[NH+]2CCC3(CCC(C)(C)O3)CC2)c1 ZINC001140623663 1131832169 /nfs/dbraw/zinc/83/21/69/1131832169.db2.gz OMXCNWMBKWOSQL-UHFFFAOYSA-N 1 0 289.419 3.624 20 10 CHCDRO Cc1c(O)ccc(C[N@@H+]2Cc3ccccc3C(C)(C)C2)c1O ZINC001140748132 1131906825 /nfs/dbraw/zinc/90/68/25/1131906825.db2.gz RQRVFSDFSCVGDP-UHFFFAOYSA-N 1 0 297.398 3.700 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H](C)CC2)c(O)c1 ZINC001140850785 1131947777 /nfs/dbraw/zinc/94/77/77/1131947777.db2.gz UKJRAAZEYZEYEF-OAHLLOKOSA-N 1 0 290.451 3.860 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)C[C@@H]2CC2(C)C)c(O)c1 ZINC001140855607 1131949620 /nfs/dbraw/zinc/94/96/20/1131949620.db2.gz FIRZPOBWHPFFTP-HNNXBMFYSA-N 1 0 290.451 3.716 20 10 CHCDRO CC1CC[NH+](Cc2ccc(N(C)C)cc2Cl)CC1 ZINC001140921980 1131963190 /nfs/dbraw/zinc/96/31/90/1131963190.db2.gz YUCNXQSGUFURLV-UHFFFAOYSA-N 1 0 266.816 3.638 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CC3CCC2CC3)c(Cl)c1 ZINC001140925239 1131965786 /nfs/dbraw/zinc/96/57/86/1131965786.db2.gz QBAOIXZUVGCLBJ-UHFFFAOYSA-N 1 0 278.827 3.780 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)CCC2CC2)c(Cl)c1 ZINC001140926107 1131966194 /nfs/dbraw/zinc/96/61/94/1131966194.db2.gz ZOFQHRDYHSIYAX-UHFFFAOYSA-N 1 0 266.816 3.638 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1ccns1)c1ccccc1O ZINC000715968418 1132000041 /nfs/dbraw/zinc/00/00/41/1132000041.db2.gz VKPYEYKNWFLKFY-CMPLNLGQSA-N 1 0 262.378 3.651 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]CC1C[C@H]2CC[C@@H](C1)S2 ZINC000716042690 1132003994 /nfs/dbraw/zinc/00/39/94/1132003994.db2.gz VLAGTYMPKXAYPR-YOGCLGLASA-N 1 0 297.851 3.809 20 10 CHCDRO c1c(C[N@@H+](CC2CC2)C2CC2)cc2c3c1CCCN3CCC2 ZINC001141078229 1132006849 /nfs/dbraw/zinc/00/68/49/1132006849.db2.gz PNWGFWKIYJUWKD-UHFFFAOYSA-N 1 0 296.458 3.760 20 10 CHCDRO C[C@H]1C[N@H+](Cc2cc3c4c(c2)CCCN4CCC3)C2(CC2)C1 ZINC001141078249 1132006899 /nfs/dbraw/zinc/00/68/99/1132006899.db2.gz QKYIJJDUPRAWOY-OAHLLOKOSA-N 1 0 296.458 3.760 20 10 CHCDRO CCC[N@H+](Cc1ccc2c(c1)OCCN2C)[C@H](C)CC ZINC001141138902 1132026932 /nfs/dbraw/zinc/02/69/32/1132026932.db2.gz CORLEXJXCPITAX-CQSZACIVSA-N 1 0 276.424 3.526 20 10 CHCDRO Cc1cccc([C@H]2CCC[N@@H+]2Cc2cc(O)ccc2O)c1 ZINC001141156035 1132029622 /nfs/dbraw/zinc/02/96/22/1132029622.db2.gz OTXBYBVPBBKWJJ-QGZVFWFLSA-N 1 0 283.371 3.743 20 10 CHCDRO Oc1ccc(O)c(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)c1 ZINC001141159468 1132030735 /nfs/dbraw/zinc/03/07/35/1132030735.db2.gz GVXIDZIHONNCJZ-MRXNPFEDSA-N 1 0 287.334 3.574 20 10 CHCDRO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(O)ccc2O)cc1 ZINC001141158977 1132030803 /nfs/dbraw/zinc/03/08/03/1132030803.db2.gz UJHHPRQBFKDFDX-KRWDZBQOSA-N 1 0 283.371 3.743 20 10 CHCDRO Cc1cccc(C[NH2+][C@H]2CCc3c(C)cccc3C2)c1O ZINC001171559780 1132055566 /nfs/dbraw/zinc/05/55/66/1132055566.db2.gz MYNIJVSBTVNENK-KRWDZBQOSA-N 1 0 281.399 3.656 20 10 CHCDRO Cc1ccc(CC[C@@H](C)[NH2+]Cc2ccc(O)c(O)c2)cc1 ZINC001171660713 1132071144 /nfs/dbraw/zinc/07/11/44/1132071144.db2.gz OWVHJPNUIJOTDC-CQSZACIVSA-N 1 0 285.387 3.517 20 10 CHCDRO Cc1ccc(CC[C@@H](C)[NH2+]Cc2cccc(O)c2O)cc1 ZINC001171664075 1132072591 /nfs/dbraw/zinc/07/25/91/1132072591.db2.gz REOZTTWDHGVNJZ-CQSZACIVSA-N 1 0 285.387 3.517 20 10 CHCDRO Cc1ccc(/C=C/c2ccc(N3CC[NH2+]CC3)cc2)cc1 ZINC001206161757 1132143085 /nfs/dbraw/zinc/14/30/85/1132143085.db2.gz XCJBXMCOWIRJSW-VOTSOKGWSA-N 1 0 278.399 3.575 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)c2ccccc2O)c(Cl)n1 ZINC000838915996 1132157721 /nfs/dbraw/zinc/15/77/21/1132157721.db2.gz DNVNCNJCMZFBKC-LLVKDONJSA-N 1 0 276.767 3.600 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H](C)CCCc2cccnc2)c1O ZINC000839151511 1132185800 /nfs/dbraw/zinc/18/58/00/1132185800.db2.gz WQTFMQQRVOMONX-HNNXBMFYSA-N 1 0 284.403 3.597 20 10 CHCDRO CCOc1ccc(C[NH2+]C2(C3CCC3)CCC2)c(O)c1 ZINC000839187343 1132189592 /nfs/dbraw/zinc/18/95/92/1132189592.db2.gz VSKNPOYPOZFXKB-UHFFFAOYSA-N 1 0 275.392 3.603 20 10 CHCDRO Cc1cc(O)c(CNc2ccc(C[NH+](C)C)c(C)c2)cc1C ZINC000839188206 1132190016 /nfs/dbraw/zinc/19/00/16/1132190016.db2.gz DNAXPKIMVRHIJU-UHFFFAOYSA-N 1 0 298.430 3.991 20 10 CHCDRO C[C@@H](O)CC[N@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000839530945 1132221132 /nfs/dbraw/zinc/22/11/32/1132221132.db2.gz GLYYFYOYIHLZKV-CVEARBPZSA-N 1 0 299.414 3.726 20 10 CHCDRO Oc1ccc(C[NH2+][C@@H]2CCC[C@@H](c3ccccc3)C2)cc1O ZINC001172541263 1132276964 /nfs/dbraw/zinc/27/69/64/1132276964.db2.gz VWZMTCJHFKFCMQ-IAGOWNOFSA-N 1 0 297.398 3.914 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H]2C[C@@H](OC(C)C)C2)c(O)c1C ZINC000840762384 1132284488 /nfs/dbraw/zinc/28/44/88/1132284488.db2.gz ABQDVTAQTBNWNN-KFWWJZLASA-N 1 0 277.408 3.616 20 10 CHCDRO CCO[C@H]1C[C@@H]([NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)C1 ZINC000840765546 1132285720 /nfs/dbraw/zinc/28/57/20/1132285720.db2.gz WUPADWCTQPIVCE-WCFLWFBJSA-N 1 0 283.799 3.572 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCO[C@H]1CC)c1cc(Cl)ccc1O ZINC000840820015 1132290359 /nfs/dbraw/zinc/29/03/59/1132290359.db2.gz FKMFHEZWIFJFMN-GUTXKFCHSA-N 1 0 283.799 3.654 20 10 CHCDRO CO[C@@H]1C[C@@H]([NH2+][C@H](C)c2cc(Cl)ccc2O)C12CCC2 ZINC000840807284 1132290371 /nfs/dbraw/zinc/29/03/71/1132290371.db2.gz SCCZATCKSRTBJJ-VCTAVGKDSA-N 1 0 295.810 3.654 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)[C@](C)(OC)C1CC1)c1ccccc1O ZINC000840860506 1132296341 /nfs/dbraw/zinc/29/63/41/1132296341.db2.gz VHOYJMWIYJVNNU-PVUWLOKVSA-N 1 0 277.408 3.637 20 10 CHCDRO COC1([C@H](C)[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)CCC1 ZINC000840882702 1132303385 /nfs/dbraw/zinc/30/33/85/1132303385.db2.gz ACNGYGJQJAAFHN-GVXVVHGQSA-N 1 0 293.382 3.627 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+]C1CCCC1 ZINC000840892440 1132304368 /nfs/dbraw/zinc/30/43/68/1132304368.db2.gz SFWGTHTZNNRBPQ-CQSZACIVSA-N 1 0 260.425 3.524 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCC[C@@H](CO)C1)c1cc(Cl)ccc1O ZINC000840893274 1132306128 /nfs/dbraw/zinc/30/61/28/1132306128.db2.gz FSDZKGRFEWRTDQ-KYOSRNDESA-N 1 0 297.826 3.637 20 10 CHCDRO CS[C@H]1CC[C@H]([NH2+]Cc2c(O)cc(C)cc2Cl)C1 ZINC000840906182 1132308616 /nfs/dbraw/zinc/30/86/16/1132308616.db2.gz VUBZQPUFMKRIKF-QWRGUYRKSA-N 1 0 285.840 3.728 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CCCCOC(C)C)c(Cl)c1 ZINC000840938217 1132309878 /nfs/dbraw/zinc/30/98/78/1132309878.db2.gz ZHVQEFCMRVFCTM-UHFFFAOYSA-N 1 0 285.815 3.649 20 10 CHCDRO Cc1noc(C)c1[C@@H](C)[NH2+]Cc1ccc(N(C)C)cc1C ZINC000840934651 1132310602 /nfs/dbraw/zinc/31/06/02/1132310602.db2.gz UNHJTCVCSVMOBH-GFCCVEGCSA-N 1 0 287.407 3.517 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@@H]2CCC(F)(F)C2)c(Cl)c1 ZINC000840942020 1132311399 /nfs/dbraw/zinc/31/13/99/1132311399.db2.gz ZEYBEZKYTLGRHO-SNVBAGLBSA-N 1 0 289.753 3.879 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+](C)[C@H](C)c1cccnc1 ZINC000840939943 1132312219 /nfs/dbraw/zinc/31/22/19/1132312219.db2.gz RTUGMKBWMSPIOB-OAHLLOKOSA-N 1 0 283.419 3.649 20 10 CHCDRO C[C@@H]([NH3+])c1ccc(NCc2ccc(N(C)C)c(F)c2)cc1 ZINC000841028778 1132321651 /nfs/dbraw/zinc/32/16/51/1132321651.db2.gz RTXGRQWSDOGXFH-GFCCVEGCSA-N 1 0 287.382 3.524 20 10 CHCDRO Nc1ccc(CC[NH2+][C@@H]2CCC[C@@H]2c2ccc(F)cc2)cc1 ZINC000841034611 1132321687 /nfs/dbraw/zinc/32/16/87/1132321687.db2.gz IDWTWYRUZOZVPX-RTBURBONSA-N 1 0 298.405 3.876 20 10 CHCDRO Cc1cc(Cl)cc(C)c1C[NH2+]CCc1ccc(N)cc1 ZINC000841036551 1132321914 /nfs/dbraw/zinc/32/19/14/1132321914.db2.gz VBFZECTWMHBTJU-UHFFFAOYSA-N 1 0 288.822 3.871 20 10 CHCDRO C[C@@H]1[C@H]([NH2+]CCc2ccc(N)cc2)C[C@@H]1c1ccccc1 ZINC000841037151 1132322845 /nfs/dbraw/zinc/32/28/45/1132322845.db2.gz YLUYCNXIGDYYIB-ZOCIIQOWSA-N 1 0 280.415 3.593 20 10 CHCDRO CC[NH2+]Cc1ccccc1NCc1cc(Cl)ccc1O ZINC000841043810 1132324622 /nfs/dbraw/zinc/32/46/22/1132324622.db2.gz VHQSNPNRRWESKW-UHFFFAOYSA-N 1 0 290.794 3.767 20 10 CHCDRO C[NH2+]Cc1ccccc1NC/C=C\c1ccc(N(C)C)cc1 ZINC000841043833 1132324664 /nfs/dbraw/zinc/32/46/64/1132324664.db2.gz VTGRJXFACSYEBN-SREVYHEPSA-N 1 0 295.430 3.597 20 10 CHCDRO Cc1cc(N)cc(C[NH2+]Cc2c(O)cc(C)cc2Cl)c1 ZINC000841071605 1132327028 /nfs/dbraw/zinc/32/70/28/1132327028.db2.gz QUBGESPEXFTRPJ-UHFFFAOYSA-N 1 0 290.794 3.534 20 10 CHCDRO Cc1ccc2c(c1)C[C@@H]([NH2+][C@H](C)c1ccccc1O)CC2 ZINC001172835652 1132327524 /nfs/dbraw/zinc/32/75/24/1132327524.db2.gz ONGDMDLTXDGTHJ-PBHICJAKSA-N 1 0 281.399 3.909 20 10 CHCDRO Cc1ccc2c(c1)C[C@H]([N@H+](C)Cc1ccccc1O)CC2 ZINC001172840387 1132333235 /nfs/dbraw/zinc/33/32/35/1132333235.db2.gz BFVPHIVMQCBNOQ-GOSISDBHSA-N 1 0 281.399 3.690 20 10 CHCDRO CC[C@H]1CCCC[N@@H+]1Cc1ccc(N(C)C)cc1OC ZINC001231855433 1132378628 /nfs/dbraw/zinc/37/86/28/1132378628.db2.gz UGXSXPRYLCRBDJ-HNNXBMFYSA-N 1 0 276.424 3.526 20 10 CHCDRO COc1cccc(C[N@H+](C)Cc2c(C)cc(C)cc2O)c1 ZINC001231845919 1132379270 /nfs/dbraw/zinc/37/92/70/1132379270.db2.gz UNXBRVRUTYXFAT-UHFFFAOYSA-N 1 0 285.387 3.650 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCc3c(F)cccc3C2)c(O)c1 ZINC001231846136 1132379397 /nfs/dbraw/zinc/37/93/97/1132379397.db2.gz BXDMQSXRTAXZNK-UHFFFAOYSA-N 1 0 285.362 3.706 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)c1cccnc1 ZINC000841743428 1132387305 /nfs/dbraw/zinc/38/73/05/1132387305.db2.gz GFZDCCWMDQNEOX-MNOVXSKESA-N 1 0 276.767 3.852 20 10 CHCDRO C[C@H]([NH2+]CCOC(C)(C)C)c1ccc(Cl)cc1O ZINC000841749925 1132389626 /nfs/dbraw/zinc/38/96/26/1132389626.db2.gz JYUGGZUWRCVEKG-JTQLQIEISA-N 1 0 271.788 3.511 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2ccc3ccccc3c2O)cn1 ZINC001231883251 1132390701 /nfs/dbraw/zinc/39/07/01/1132390701.db2.gz NBXDKQQURLFAFL-UHFFFAOYSA-N 1 0 292.382 3.881 20 10 CHCDRO COC1([C@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2O)CCC1 ZINC000841755871 1132391241 /nfs/dbraw/zinc/39/12/41/1132391241.db2.gz MXMJHJIXPOTCIG-QWRGUYRKSA-N 1 0 283.799 3.654 20 10 CHCDRO COC[C@H]1CCCC[N@@H+]1Cc1ccc2ccccc2c1O ZINC001231879713 1132391236 /nfs/dbraw/zinc/39/12/36/1132391236.db2.gz PIHIDEYKOJAULQ-MRXNPFEDSA-N 1 0 285.387 3.546 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1cncc(F)c1)c1ccc(Cl)cc1O ZINC000841752764 1132391526 /nfs/dbraw/zinc/39/15/26/1132391526.db2.gz HRZDLWUVEIUBNI-VHSXEESVSA-N 1 0 294.757 3.992 20 10 CHCDRO Cc1cc(C)c(C[NH2+][C@H](C)c2ccc(Cl)cc2O)cn1 ZINC000841753208 1132392736 /nfs/dbraw/zinc/39/27/36/1132392736.db2.gz DVSWETIRKZNEHW-GFCCVEGCSA-N 1 0 290.794 3.908 20 10 CHCDRO C[C@H]([NH2+][C@H]1C[C@H](C)n2ccnc21)c1ccc(Cl)cc1O ZINC000841759243 1132393734 /nfs/dbraw/zinc/39/37/34/1132393734.db2.gz XSDTWPFEIRBTOC-KWBADKCTSA-N 1 0 291.782 3.599 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2COCc3ccccc32)c(O)c1 ZINC000841759842 1132393833 /nfs/dbraw/zinc/39/38/33/1132393833.db2.gz IUVMASVQXHQDOB-GUYCJALGSA-N 1 0 283.371 3.623 20 10 CHCDRO C[C@H]1CCCCC[N@@H+]1Cc1cc(Cl)c(O)cc1O ZINC001232261780 1132445113 /nfs/dbraw/zinc/44/51/13/1132445113.db2.gz PGOISXOQGKDPOF-JTQLQIEISA-N 1 0 269.772 3.516 20 10 CHCDRO COc1cc(C)cc(C[N@H+](C)CCC(C)(C)C)c1O ZINC000842631100 1132445951 /nfs/dbraw/zinc/44/59/51/1132445951.db2.gz KUKGJIWEJHVYSF-UHFFFAOYSA-N 1 0 265.397 3.577 20 10 CHCDRO COc1cc(O)c(C[NH+]2[C@@H](C)CCC[C@@H]2C)cc1Cl ZINC001232266051 1132446921 /nfs/dbraw/zinc/44/69/21/1132446921.db2.gz QBVHTKFLJPCYBR-QWRGUYRKSA-N 1 0 283.799 3.817 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H]2C[C@@H](OC(C)(C)C)C2)c(O)c1 ZINC000842922911 1132476205 /nfs/dbraw/zinc/47/62/05/1132476205.db2.gz ZEINNIVLROWQKB-MCIONIFRSA-N 1 0 277.408 3.697 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CC[C@H]2C[C@H]2C1)c1cc(Cl)ccc1O ZINC000842927638 1132476565 /nfs/dbraw/zinc/47/65/65/1132476565.db2.gz FMVCUPOPTKNQOI-MRBYEJRBSA-N 1 0 265.784 3.885 20 10 CHCDRO C[C@H]([NH2+]CC1CCC(F)CC1)c1ccccc1O ZINC000842929697 1132478063 /nfs/dbraw/zinc/47/80/63/1132478063.db2.gz RKXXSLZDRNBFDE-HIFPTAJRSA-N 1 0 251.345 3.571 20 10 CHCDRO C[N@H+](Cc1cccnc1)Cc1cccc(C(C)(C)C)c1O ZINC001143103725 1132502421 /nfs/dbraw/zinc/50/24/21/1132502421.db2.gz JJCFUXPSBAPANA-UHFFFAOYSA-N 1 0 284.403 3.717 20 10 CHCDRO CN(Cc1nccs1)Cc1cccc(C(C)(C)C)c1O ZINC001143111890 1132503981 /nfs/dbraw/zinc/50/39/81/1132503981.db2.gz HVIMHACICFCTEZ-UHFFFAOYSA-N 1 0 290.432 3.778 20 10 CHCDRO C[N@H+](Cc1cccc2ncsc21)Cc1ccccc1O ZINC001232736112 1132513012 /nfs/dbraw/zinc/51/30/12/1132513012.db2.gz IZSCWNUSQSRQAS-UHFFFAOYSA-N 1 0 284.384 3.634 20 10 CHCDRO CC[N@H+](Cc1ccc(C)cc1)Cc1ccc(N(C)C)cc1O ZINC001232840938 1132529480 /nfs/dbraw/zinc/52/94/80/1132529480.db2.gz NKUMFFGRHBLRTD-UHFFFAOYSA-N 1 0 298.430 3.789 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H]3CCCC[C@H]32)c(O)c1 ZINC001232840453 1132529510 /nfs/dbraw/zinc/52/95/10/1132529510.db2.gz XOSMRRLOCKPUFL-WMLDXEAASA-N 1 0 288.435 3.613 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+]C[C@@H](C)CC(F)F)c1O ZINC000843419578 1132530905 /nfs/dbraw/zinc/53/09/05/1132530905.db2.gz ZBGBDOUOIJSFKV-QMMMGPOBSA-N 1 0 277.742 3.735 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]C1(c2ccccc2F)CCC1 ZINC000843424596 1132532368 /nfs/dbraw/zinc/53/23/68/1132532368.db2.gz DCLCELUGPGMHRS-UHFFFAOYSA-N 1 0 289.325 3.839 20 10 CHCDRO C[N@H+](Cc1c([O-])cc(Br)cc1F)C(C)(C)C ZINC001233030839 1132566044 /nfs/dbraw/zinc/56/60/44/1132566044.db2.gz OVRDPFPATOZSPE-UHFFFAOYSA-N 1 0 290.176 3.524 20 10 CHCDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CCc3ccncc3C2)c1 ZINC001233286191 1132595723 /nfs/dbraw/zinc/59/57/23/1132595723.db2.gz JGWVGKJSBGDCKZ-UHFFFAOYSA-N 1 0 296.414 3.643 20 10 CHCDRO C[N@H+](CCC1CC1)Cc1cccc(C(F)(F)F)c1[O-] ZINC001233419503 1132621754 /nfs/dbraw/zinc/62/17/54/1132621754.db2.gz ZWEIGLYAACWYKE-UHFFFAOYSA-N 1 0 273.298 3.643 20 10 CHCDRO CC(C)C[NH2+]Cc1ccc(Nc2ccc(N)cc2)cc1 ZINC001159484894 1132853596 /nfs/dbraw/zinc/85/35/96/1132853596.db2.gz DVOGQAMPJMMQAE-UHFFFAOYSA-N 1 0 269.392 3.758 20 10 CHCDRO Cc1c[nH+]ccc1Nc1ccc(Cc2ccc(N)cc2)cc1 ZINC001174539300 1132899669 /nfs/dbraw/zinc/89/96/69/1132899669.db2.gz BMOCNOFYKOITLZ-UHFFFAOYSA-N 1 0 289.382 3.729 20 10 CHCDRO CNc1ccc(Nc2ccc(C(C)(C)[NH3+])cc2)cc1 ZINC001159827756 1132913658 /nfs/dbraw/zinc/91/36/58/1132913658.db2.gz UTAUADYAYGJHRP-UHFFFAOYSA-N 1 0 255.365 3.666 20 10 CHCDRO c1cc2c(cc1C[NH2+]CCCC1CCC1)CCCO2 ZINC001203168250 1133304368 /nfs/dbraw/zinc/30/43/68/1133304368.db2.gz HEOGPQHLNLXSIC-UHFFFAOYSA-N 1 0 259.393 3.682 20 10 CHCDRO CCC(C)(C)CC[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001203352126 1133315950 /nfs/dbraw/zinc/31/59/50/1133315950.db2.gz QOXBRFHOVCTQND-UHFFFAOYSA-N 1 0 261.409 3.928 20 10 CHCDRO CCOc1cccc(C[N@H+](C)C/C=C/c2ccccc2)c1O ZINC001203614029 1133344258 /nfs/dbraw/zinc/34/42/58/1133344258.db2.gz NKSITEQZCZVTBU-DHZHZOJOSA-N 1 0 297.398 3.936 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCCC3(CCC3)C2)c1O ZINC001203614640 1133344814 /nfs/dbraw/zinc/34/48/14/1133344814.db2.gz CQCZACBADUAZNK-UHFFFAOYSA-N 1 0 275.392 3.557 20 10 CHCDRO CCC[N@H+](Cc1ccccc1)Cc1ccc(OC)cc1O ZINC001203629990 1133345869 /nfs/dbraw/zinc/34/58/69/1133345869.db2.gz PTLHQNZBOBRMQP-UHFFFAOYSA-N 1 0 285.387 3.813 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CC[C@](C)(CF)C2)cc1 ZINC001203940627 1133385830 /nfs/dbraw/zinc/38/58/30/1133385830.db2.gz RTGDFWQCMWOKEU-QGZVFWFLSA-N 1 0 278.415 3.714 20 10 CHCDRO CCN(CC)c1ccc(CN2CC[C@](C)(F)[C@H](F)C2)cc1 ZINC001203939954 1133385901 /nfs/dbraw/zinc/38/59/01/1133385901.db2.gz GUSXOEQCQBWSMQ-SJORKVTESA-N 1 0 296.405 3.805 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)CCc2cccc(F)c2)cc1 ZINC001203937083 1133386330 /nfs/dbraw/zinc/38/63/30/1133386330.db2.gz JXBJAWNWZBLICT-UHFFFAOYSA-N 1 0 286.394 3.566 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)C2CC2)c2ccccc21 ZINC001204232608 1133423231 /nfs/dbraw/zinc/42/32/31/1133423231.db2.gz GFBDVADDHZDMAP-UHFFFAOYSA-N 1 0 254.377 3.500 20 10 CHCDRO CCC[N@H+](C)Cc1ccc(N(C)C)c2ccccc12 ZINC001204232832 1133423305 /nfs/dbraw/zinc/42/33/05/1133423305.db2.gz JXIZOKXDMYESOM-UHFFFAOYSA-N 1 0 256.393 3.748 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[N@@H+]1CC[C@H]2CCC[C@@H]2C1 ZINC001204323773 1133436679 /nfs/dbraw/zinc/43/66/79/1133436679.db2.gz JAJPKDRZANNJNH-QZTJIDSGSA-N 1 0 284.447 3.909 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2ccc(N3CCCC3)cc2)[C@H](C)C1 ZINC001204321163 1133437299 /nfs/dbraw/zinc/43/72/99/1133437299.db2.gz HHQZIIRPZPFCKS-HZPDHXFCSA-N 1 0 272.436 3.907 20 10 CHCDRO CC[N@H+](Cc1ccc(N2CCCC2)cc1)Cc1cccnc1 ZINC001204327233 1133438439 /nfs/dbraw/zinc/43/84/39/1133438439.db2.gz MLWMJLWGXZFIIS-UHFFFAOYSA-N 1 0 295.430 3.704 20 10 CHCDRO CC(C)c1ccc(O)c(C[NH2+][C@@H](CO)CCC(C)(C)C)c1 ZINC001205530944 1133586443 /nfs/dbraw/zinc/58/64/43/1133586443.db2.gz SNOYEJWCHQPJEY-MRXNPFEDSA-N 1 0 293.451 3.792 20 10 CHCDRO Cc1ccc(C[NH2+]CCc2nc3ccccc3s2)c(O)c1 ZINC001205708726 1133604821 /nfs/dbraw/zinc/60/48/21/1133604821.db2.gz HRIWKESFUYSANP-UHFFFAOYSA-N 1 0 298.411 3.643 20 10 CHCDRO CC[N@H+](C/C=C/c1ccc(N(C)C)cc1)C(C)(C)C ZINC001205998159 1133640274 /nfs/dbraw/zinc/64/02/74/1133640274.db2.gz JTTXSGLFDFIATK-CMDGGOBGSA-N 1 0 260.425 3.886 20 10 CHCDRO C[C@@H]1CC[C@H](C)[C@H]([NH2+]Cc2cc(Cl)ccc2O)C1 ZINC001206517428 1133713322 /nfs/dbraw/zinc/71/33/22/1133713322.db2.gz SYJPATMLBHDLKH-UHIISALHSA-N 1 0 267.800 3.960 20 10 CHCDRO Nc1ccc(Cc2ccccc2Nc2cc[nH+]c(N)c2)cc1 ZINC001206568193 1133719484 /nfs/dbraw/zinc/71/94/84/1133719484.db2.gz KQBZZXNVGHCZDE-UHFFFAOYSA-N 1 0 290.370 3.580 20 10 CHCDRO CC1(C)C[C@@]1(C[NH2+]Cc1cc(F)ccc1O)c1ccccc1 ZINC001206753906 1133742126 /nfs/dbraw/zinc/74/21/26/1133742126.db2.gz TXTGNLYCTVORIF-LJQANCHMSA-N 1 0 299.389 3.989 20 10 CHCDRO CCc1cccc(C[NH2+]Cc2ccc3c(c2)C[C@H](C)O3)c1O ZINC001207486344 1133806147 /nfs/dbraw/zinc/80/61/47/1133806147.db2.gz YTGKWJBRACGBMI-ZDUSSCGKSA-N 1 0 297.398 3.568 20 10 CHCDRO CC[N@@H+](Cc1ccc(N(C)C)cc1)CC1CCSCC1 ZINC001207756648 1133845984 /nfs/dbraw/zinc/84/59/84/1133845984.db2.gz KTTWMGWCUFCGDG-UHFFFAOYSA-N 1 0 292.492 3.718 20 10 CHCDRO Cc1ccc(C[NH2+]C2(C3CCCCC3)CC2)c(O)c1 ZINC001207758141 1133846568 /nfs/dbraw/zinc/84/65/68/1133846568.db2.gz SXICDDDNDULTEO-UHFFFAOYSA-N 1 0 259.393 3.903 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(OC)ccc1O)c1ccc(F)cc1 ZINC000089726394 1133917346 /nfs/dbraw/zinc/91/73/46/1133917346.db2.gz UNAJPWINHWIVAQ-INIZCTEOSA-N 1 0 289.350 3.781 20 10 CHCDRO CC[N@H+](CCCc1ccc(F)cc1)Cc1ccccc1O ZINC001208775973 1133943311 /nfs/dbraw/zinc/94/33/11/1133943311.db2.gz XHWVXGGMTPYZEG-UHFFFAOYSA-N 1 0 287.378 3.986 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(C[N@@H+]2C[C@@H]3C[C@@H]3C2)cc1 ZINC001209517007 1134032174 /nfs/dbraw/zinc/03/21/74/1134032174.db2.gz WKIFWMWXKZWGND-CALCHBBNSA-N 1 0 266.388 3.546 20 10 CHCDRO C[N@H+](Cc1c[nH]c2cc(F)ccc12)Cc1ccccc1O ZINC001209693933 1134052423 /nfs/dbraw/zinc/05/24/23/1134052423.db2.gz FGWQLMMSVKKXSS-UHFFFAOYSA-N 1 0 284.334 3.645 20 10 CHCDRO Cc1cc(Nc2c(F)ccc(C)c2O)c2ccccc2[nH+]1 ZINC001215735989 1134669857 /nfs/dbraw/zinc/66/98/57/1134669857.db2.gz LRWGRZOZTHXFST-UHFFFAOYSA-N 1 0 282.318 3.862 20 10 CHCDRO CCC[C@H](Oc1ccc(N2CC[NH2+]CC2)cc1)[C@@H](C)CC ZINC001218290764 1135078858 /nfs/dbraw/zinc/07/88/58/1135078858.db2.gz CKXWFERNXVNGFM-YJBOKZPZSA-N 1 0 290.451 3.690 20 10 CHCDRO O=C1C=CC(=NNc2ccc(O[C@H]3CCC[NH2+]C3)cc2)C=C1 ZINC001218285850 1135079391 /nfs/dbraw/zinc/07/93/91/1135079391.db2.gz OCJCPMYLGBOKIK-KRWDZBQOSA-N 1 0 297.358 3.938 20 10 CHCDRO CC[C@H](C)C[C@H](CC)Oc1ccc(N2CC[NH2+]CC2)cc1 ZINC001218295539 1135081159 /nfs/dbraw/zinc/08/11/59/1135081159.db2.gz ODCDGIMKGZRDFE-RDJZCZTQSA-N 1 0 290.451 3.690 20 10 CHCDRO C[C@@H]([NH2+]CCCOc1ccccc1)c1ccc(N(C)C)cc1 ZINC000315671547 1135158373 /nfs/dbraw/zinc/15/83/73/1135158373.db2.gz WKKLVHUZKVOXGU-MRXNPFEDSA-N 1 0 298.430 3.872 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H](CO)c1ccccc1 ZINC000318946869 1135181023 /nfs/dbraw/zinc/18/10/23/1135181023.db2.gz HXPGPUQQEXMJIB-KBMXLJTQSA-N 1 0 297.398 3.572 20 10 CHCDRO COc1ccc(O)c(C[NH+]2CCCCCCCC2)c1 ZINC000322013071 1135585165 /nfs/dbraw/zinc/58/51/65/1135585165.db2.gz BEEFONNDIPIVID-UHFFFAOYSA-N 1 0 263.381 3.557 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2cccnc2)c(O)c1 ZINC000020127993 171013830 /nfs/dbraw/zinc/01/38/30/171013830.db2.gz YNWWYPKVRNJELE-CHWSQXEVSA-N 1 0 256.349 3.507 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCc3ccccc32)c1 ZINC000020129853 171018662 /nfs/dbraw/zinc/01/86/62/171018662.db2.gz MYPSNNIXSKSHCD-PXAZEXFGSA-N 1 0 283.371 3.739 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2CCCc3ccccc32)cc1 ZINC000020133399 171021045 /nfs/dbraw/zinc/02/10/45/171021045.db2.gz KSRGIKKXIOEGEM-LJQANCHMSA-N 1 0 280.415 3.920 20 10 CHCDRO C[C@H](CCc1ccco1)[NH2+][C@H](C)c1ccccc1O ZINC000020144730 171030299 /nfs/dbraw/zinc/03/02/99/171030299.db2.gz XJTOQXRKKKWXJF-CHWSQXEVSA-N 1 0 259.349 3.657 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCCc2occc21)c1ccccc1O ZINC000020204253 171069793 /nfs/dbraw/zinc/06/97/93/171069793.db2.gz YTLCKFNSHLBJDU-BXUZGUMPSA-N 1 0 257.333 3.713 20 10 CHCDRO Cc1cc(C[NH2+][C@@H](C)C2CC2)c(C)n1-c1ccccc1 ZINC000035136597 172003721 /nfs/dbraw/zinc/00/37/21/172003721.db2.gz RDJVZAPSOVERSF-AWEZNQCLSA-N 1 0 268.404 3.982 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)C1CC1)c1ccc2ccccc2c1O ZINC000035733326 172384567 /nfs/dbraw/zinc/38/45/67/172384567.db2.gz KISHOLLKQCIINH-RYUDHWBXSA-N 1 0 255.361 3.995 20 10 CHCDRO CCOc1cccc(C[NH2+][C@H]2CCCc3ccccc32)c1O ZINC000074335941 260165379 /nfs/dbraw/zinc/16/53/79/260165379.db2.gz NUULBERGHCXUQD-KRWDZBQOSA-N 1 0 297.398 3.958 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCO[C@H](c2ccccc2)C1)c1ccccc1O ZINC000158168985 261159745 /nfs/dbraw/zinc/15/97/45/261159745.db2.gz OYSGCKZZGIGBKB-GMBSWORKSA-N 1 0 297.398 3.963 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cccnc1Cl ZINC000160536872 261217582 /nfs/dbraw/zinc/21/75/82/261217582.db2.gz FIDJTQITOFFCIQ-LBPRGKRZSA-N 1 0 289.810 3.652 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CCCC(C)(C)CO)cc1 ZINC000163187271 261308665 /nfs/dbraw/zinc/30/86/65/261308665.db2.gz RROIGDJSPAGBBX-HNNXBMFYSA-N 1 0 292.467 3.592 20 10 CHCDRO CC[C@H]([NH2+]CCCC(C)(C)CO)c1ccc(N(C)C)cc1 ZINC000163224397 261309588 /nfs/dbraw/zinc/30/95/88/261309588.db2.gz PUZDFYZYSZFLSM-KRWDZBQOSA-N 1 0 292.467 3.592 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(Cl)nc1)c1ccc(N(C)C)cc1 ZINC000165486607 261371638 /nfs/dbraw/zinc/37/16/38/261371638.db2.gz JGYBUOVBASXMBF-GFCCVEGCSA-N 1 0 289.810 3.652 20 10 CHCDRO COc1cc(Cl)cc(C[N@H+](C)[C@@H](C)c2ccco2)c1O ZINC000184679027 262026315 /nfs/dbraw/zinc/02/63/15/262026315.db2.gz YKQRWCIZUFIMMM-JTQLQIEISA-N 1 0 295.766 3.840 20 10 CHCDRO CO[C@H](C[NH2+][C@@H](C)c1ccc(C)cc1O)c1ccccc1 ZINC000185102059 262041148 /nfs/dbraw/zinc/04/11/48/262041148.db2.gz NCKDFIKUZPOZOO-KBXCAEBGSA-N 1 0 285.387 3.739 20 10 CHCDRO CO[C@@H](C[NH2+][C@H](C)c1cc(F)ccc1O)c1ccccc1 ZINC000185102182 262041462 /nfs/dbraw/zinc/04/14/62/262041462.db2.gz BBQZMUPZEDMHGQ-PXAZEXFGSA-N 1 0 289.350 3.570 20 10 CHCDRO CCc1cnc(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)s1 ZINC000185584115 262060774 /nfs/dbraw/zinc/06/07/74/262060774.db2.gz CBDZFPITLRPYIF-VIFPVBQESA-N 1 0 296.823 3.915 20 10 CHCDRO C[C@H]([NH2+]CC1(CCO)CCCCC1)c1cc(F)ccc1O ZINC000185669622 262064539 /nfs/dbraw/zinc/06/45/39/262064539.db2.gz QMIBMOGLSAPHHX-ZDUSSCGKSA-N 1 0 295.398 3.515 20 10 CHCDRO CCOCCC1(C[NH2+][C@H](C)c2ccc(C)cc2O)CC1 ZINC000186155541 262081888 /nfs/dbraw/zinc/08/18/88/262081888.db2.gz YNISFAWPRBAHSP-CQSZACIVSA-N 1 0 277.408 3.558 20 10 CHCDRO CCOCCC1(C[NH2+][C@H](C)c2cc(C)ccc2O)CC1 ZINC000186155274 262082003 /nfs/dbraw/zinc/08/20/03/262082003.db2.gz JHWCCNIMYBBJFA-CQSZACIVSA-N 1 0 277.408 3.558 20 10 CHCDRO COc1cc(F)cc(C[NH2+][C@@H](C)c2cc(C)ccc2O)c1 ZINC000186216519 262084564 /nfs/dbraw/zinc/08/45/64/262084564.db2.gz DWHUDZKMSQHOLU-LBPRGKRZSA-N 1 0 289.350 3.699 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCCCOC(C)C)c(O)c1 ZINC000186530092 262316237 /nfs/dbraw/zinc/31/62/37/262316237.db2.gz RRLFOEDDCUTMCR-AWEZNQCLSA-N 1 0 265.397 3.556 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CN(C)Cc3ccccc32)c1 ZINC000370372736 267313613 /nfs/dbraw/zinc/31/36/13/267313613.db2.gz CYTPNGANDHPGCV-KBXCAEBGSA-N 1 0 296.414 3.538 20 10 CHCDRO COC[C@H]([NH2+][C@H](C)c1cc(C)ccc1O)c1ccc(C)o1 ZINC000185630201 327841711 /nfs/dbraw/zinc/84/17/11/327841711.db2.gz XAZXRGUITUJXOT-HIFRSBDPSA-N 1 0 289.375 3.640 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H](C)C[C@H](O)c2ccccc2)c(O)c1 ZINC000185834333 327847296 /nfs/dbraw/zinc/84/72/96/327847296.db2.gz LPTKGYVGNBFFBR-VKJFTORMSA-N 1 0 299.414 3.863 20 10 CHCDRO CC(C)c1cccc(N(C)C(=O)c2ccccc2CC[NH3+])c1 ZINC000571174634 328090831 /nfs/dbraw/zinc/09/08/31/328090831.db2.gz LNUSWSBCVQZWAY-UHFFFAOYSA-N 1 0 296.414 3.588 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@H](C)c2nccs2)c(O)c1 ZINC000285128808 328247223 /nfs/dbraw/zinc/24/72/23/328247223.db2.gz LKPJSVROZRMMAZ-STQMWFEESA-N 1 0 290.432 3.920 20 10 CHCDRO CCCc1nc(C)c(C[NH2+]Cc2c(O)cccc2Cl)o1 ZINC000291681773 328265644 /nfs/dbraw/zinc/26/56/44/328265644.db2.gz HVAQYEVHRSYRRV-UHFFFAOYSA-N 1 0 294.782 3.584 20 10 CHCDRO COc1cccc(C[NH2+][C@@H](C)c2ccc(C)cc2)c1O ZINC000037770032 326861039 /nfs/dbraw/zinc/86/10/39/326861039.db2.gz JGHSCASIJSJKCV-ZDUSSCGKSA-N 1 0 271.360 3.560 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCOC[C@@H]1C)c1ccc2ccccc2c1O ZINC000278611195 327176965 /nfs/dbraw/zinc/17/69/65/327176965.db2.gz RGPKQDDKPNZFFY-DCGLDWPTSA-N 1 0 285.387 3.621 20 10 CHCDRO CCC[N@H+](Cc1ccnc(C)c1)Cc1ccccc1O ZINC000527535754 330263171 /nfs/dbraw/zinc/26/31/71/330263171.db2.gz SSULHDWTAIAOHA-UHFFFAOYSA-N 1 0 270.376 3.508 20 10 CHCDRO CC[C@H]([NH2+]CC[C@H]1CCCOC1)c1cc(Cl)ccc1O ZINC000527923633 330296021 /nfs/dbraw/zinc/29/60/21/330296021.db2.gz DDBFKPMACOTNFV-DOMZBBRYSA-N 1 0 297.826 3.903 20 10 CHCDRO CC[C@H]([NH2+]CC[C@@H]1CCCOC1)c1ccc(C)cc1O ZINC000527935765 330298078 /nfs/dbraw/zinc/29/80/78/330298078.db2.gz ZAMULROARGXSMU-HOCLYGCPSA-N 1 0 277.408 3.558 20 10 CHCDRO Cc1ncccc1C[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000527986174 330298772 /nfs/dbraw/zinc/29/87/72/330298772.db2.gz JLYWXNKRKOJYHO-LLVKDONJSA-N 1 0 276.767 3.600 20 10 CHCDRO C[C@@H]([NH2+][C@@H](c1ccccn1)C1CCC1)c1ccccc1O ZINC000527969829 330301615 /nfs/dbraw/zinc/30/16/15/330301615.db2.gz RUWQXENOIGXSBL-FZKQIMNGSA-N 1 0 282.387 3.979 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1[C@H](C)O[C@@H](C)[C@H]1C)c1ccc(C)cc1O ZINC000528008984 330303824 /nfs/dbraw/zinc/30/38/24/330303824.db2.gz UWXLVSPUGDMGAA-IYSBERIVSA-N 1 0 277.408 3.553 20 10 CHCDRO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1cc(F)ccc1O ZINC000226583005 333265370 /nfs/dbraw/zinc/26/53/70/333265370.db2.gz NECLQHIGIZYABD-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO CC[C@H]([NH2+]Cc1sc(C)nc1C)c1ccccc1O ZINC000271737218 334746075 /nfs/dbraw/zinc/74/60/75/334746075.db2.gz UKXMZQHRQSDKKT-ZDUSSCGKSA-N 1 0 276.405 3.706 20 10 CHCDRO CC(C)=CCC[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1 ZINC000276602677 519415677 /nfs/dbraw/zinc/41/56/77/519415677.db2.gz BLIQBUUKXSKOEB-MRXNPFEDSA-N 1 0 288.435 3.530 20 10 CHCDRO CC(C)n1ncc2c1[C@@H]([NH2+][C@H](C)c1ccccc1O)CCC2 ZINC000364882160 520076455 /nfs/dbraw/zinc/07/64/55/520076455.db2.gz KNAYBMFJKVPRCI-CJNGLKHVSA-N 1 0 299.418 3.898 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CC2(C)CCOCC2)cc1 ZINC000271563642 520285555 /nfs/dbraw/zinc/28/55/55/520285555.db2.gz YALMFPZYRLPZDW-OAHLLOKOSA-N 1 0 290.451 3.610 20 10 CHCDRO CCC[C@@H](CCO)C[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000280224669 520702676 /nfs/dbraw/zinc/70/26/76/520702676.db2.gz UYVYKWDNNNPRMT-HOCLYGCPSA-N 1 0 279.424 3.540 20 10 CHCDRO CCC[C@H]([NH2+][C@@H](C)c1ccccc1O)[C@H](O)c1ccccc1 ZINC000279999931 521169482 /nfs/dbraw/zinc/16/94/82/521169482.db2.gz FXIVTEMKRQUFPM-UCLAIMLFSA-N 1 0 299.414 3.945 20 10 CHCDRO CC[N@H+](Cc1cc(C)c(C)cc1O)[C@H](C)c1cccnc1 ZINC000290656207 521286046 /nfs/dbraw/zinc/28/60/46/521286046.db2.gz ZJAIZEKOEOIVQA-OAHLLOKOSA-N 1 0 284.403 3.987 20 10 CHCDRO CCSCC[C@@H](C)[NH2+][C@H]1CCc2cccc(O)c21 ZINC000297909357 521713721 /nfs/dbraw/zinc/71/37/21/521713721.db2.gz WPELOYYUNPNNMW-YPMHNXCESA-N 1 0 265.422 3.501 20 10 CHCDRO CCc1cnc(C[NH2+][C@H](CC)c2ccc(C)cc2O)s1 ZINC000279950041 522041690 /nfs/dbraw/zinc/04/16/90/522041690.db2.gz BTDYPUKYOBDQNJ-CQSZACIVSA-N 1 0 290.432 3.960 20 10 CHCDRO CC[C@H]([NH2+]CCCc1ccccn1)c1ccc(C)cc1O ZINC000280130236 522587257 /nfs/dbraw/zinc/58/72/57/522587257.db2.gz OWVACXFWYLZUAC-KRWDZBQOSA-N 1 0 284.403 3.769 20 10 CHCDRO CC[C@H]([NH2+]CC[C@H]1CCO[C@H](C)C1)c1ccc(C)cc1O ZINC000280288066 522599831 /nfs/dbraw/zinc/59/98/31/522599831.db2.gz ZATOHAIZAJOIRU-VYDXJSESSA-N 1 0 291.435 3.947 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1cnn(CC)c1)c1ccc(C)cc1O ZINC000296116684 522703077 /nfs/dbraw/zinc/70/30/77/522703077.db2.gz ZWUGFMTUZQZIAV-BBRMVZONSA-N 1 0 287.407 3.719 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCC[C@H]2OCC[C@@H]21)c1ccc(C)cc1O ZINC000280036855 522716975 /nfs/dbraw/zinc/71/69/75/522716975.db2.gz IOLQICUMMHZGQI-KYHPRHEASA-N 1 0 289.419 3.699 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)[C@@H](O)c1ccccc1)c1ccc(C)cc1O ZINC000290161498 522737109 /nfs/dbraw/zinc/73/71/09/522737109.db2.gz DETHPXILTXEBIK-DKSSEZFCSA-N 1 0 299.414 3.863 20 10 CHCDRO CC[C@@H]([NH2+]CCCOC(C)C)c1ccc(C)cc1O ZINC000280032398 522829304 /nfs/dbraw/zinc/82/93/04/522829304.db2.gz ICZRRSIJHIDDCB-OAHLLOKOSA-N 1 0 265.397 3.556 20 10 CHCDRO CC[C@@H]([NH2+]Cc1nc(C)cs1)c1ccc(N(C)C)cc1 ZINC000126244517 522892580 /nfs/dbraw/zinc/89/25/80/522892580.db2.gz TXOZVIYSVBUHKC-OAHLLOKOSA-N 1 0 289.448 3.758 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1cccnc1)c1ccc(C)cc1O ZINC000280099216 522913471 /nfs/dbraw/zinc/91/34/71/522913471.db2.gz MYRYKLNYKRNJKF-XJKSGUPXSA-N 1 0 270.376 3.898 20 10 CHCDRO CCn1cc([C@H](C)[NH2+][C@@H](C)c2ccc(C)c(C)c2O)cn1 ZINC000295990669 523475900 /nfs/dbraw/zinc/47/59/00/523475900.db2.gz PMRJKAIDOGCRMI-KBPBESRZSA-N 1 0 287.407 3.637 20 10 CHCDRO CCn1ccnc1[C@H]1CCCC[N@@H+]1Cc1cccc(C)c1O ZINC000280888831 523558986 /nfs/dbraw/zinc/55/89/86/523558986.db2.gz DEBLYLWUXRSTEG-MRXNPFEDSA-N 1 0 299.418 3.644 20 10 CHCDRO COc1ccc(C[NH2+]Cc2ccc(C)s2)cc1C ZINC000048068805 524073073 /nfs/dbraw/zinc/07/30/73/524073073.db2.gz XZQQBXJVHAXNGP-UHFFFAOYSA-N 1 0 261.390 3.663 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@@H](C)c2cc(F)ccc2O)c1 ZINC000094617666 524092711 /nfs/dbraw/zinc/09/27/11/524092711.db2.gz GSNCQJDQDNJLDY-NEPJUHHUSA-N 1 0 289.350 3.952 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2cn3ccccc3n2)c(O)c1 ZINC000293278942 524331810 /nfs/dbraw/zinc/33/18/10/524331810.db2.gz CRYAKCRXYDDMQS-CQSZACIVSA-N 1 0 295.386 3.508 20 10 CHCDRO Cc1cccc(C[NH2+][C@H](C)c2cc(F)ccc2O)c1 ZINC000094616896 524439225 /nfs/dbraw/zinc/43/92/25/524439225.db2.gz GCRBGSRUBVPTFJ-GFCCVEGCSA-N 1 0 259.324 3.691 20 10 CHCDRO C[C@@H](CCc1ccc(O)cc1)[NH2+][C@@H](C)c1ccccc1O ZINC000037140276 524525515 /nfs/dbraw/zinc/52/55/15/524525515.db2.gz KVFOKGGRXHSFIB-KBPBESRZSA-N 1 0 285.387 3.770 20 10 CHCDRO COc1ccccc1[C@H](C)[NH2+]Cc1cc(C)ccc1O ZINC000071406335 524779702 /nfs/dbraw/zinc/77/97/02/524779702.db2.gz VYBPOEBXLTVIML-ZDUSSCGKSA-N 1 0 271.360 3.560 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C(C)(C)c2ccccc2F)c1 ZINC000291659163 525346841 /nfs/dbraw/zinc/34/68/41/525346841.db2.gz DVYGEDRNVOTHOK-UHFFFAOYSA-N 1 0 273.351 3.865 20 10 CHCDRO C[C@@H]([NH2+]CCCOc1ccccc1)c1ccccc1O ZINC000052092010 525441868 /nfs/dbraw/zinc/44/18/68/525441868.db2.gz ZSFWCVROKDXNDA-CQSZACIVSA-N 1 0 271.360 3.512 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccsc1 ZINC000050339194 525446710 /nfs/dbraw/zinc/44/67/10/525446710.db2.gz BFVXUVJZRJMCST-LBPRGKRZSA-N 1 0 260.406 3.665 20 10 CHCDRO C[C@H]([NH2+]Cc1ccsc1)c1ccc(N(C)C)cc1 ZINC000063152436 525474094 /nfs/dbraw/zinc/47/40/94/525474094.db2.gz AZORHGPKZSCQSK-LBPRGKRZSA-N 1 0 260.406 3.665 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(OC(F)F)cc1)c1ccccc1O ZINC000020145317 525529030 /nfs/dbraw/zinc/52/90/30/525529030.db2.gz DCZOBUGCHSDJGN-LLVKDONJSA-N 1 0 293.313 3.844 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCCN3C)o1 ZINC000050286561 525733040 /nfs/dbraw/zinc/73/30/40/525733040.db2.gz ZUMGZNTWBRIKGU-CQSZACIVSA-N 1 0 284.403 3.821 20 10 CHCDRO CSCc1cccc(C[NH2+]Cc2ccccc2O)c1 ZINC000189491332 525738683 /nfs/dbraw/zinc/73/86/83/525738683.db2.gz QUDUBKIXGFSDOI-UHFFFAOYSA-N 1 0 273.401 3.545 20 10 CHCDRO Cc1cnc(C2CC[NH+](Cc3ccccc3O)CC2)s1 ZINC000277309529 525988110 /nfs/dbraw/zinc/98/81/10/525988110.db2.gz BMWQFJIHQDOIPR-UHFFFAOYSA-N 1 0 288.416 3.537 20 10 CHCDRO COc1cccc(C[NH2+]C(C)(C)c2ccccc2C)c1O ZINC000293051042 526011521 /nfs/dbraw/zinc/01/15/21/526011521.db2.gz RMUWJSWBURMASF-UHFFFAOYSA-N 1 0 285.387 3.734 20 10 CHCDRO COc1cccc(C[NH2+]C[C@@H]2CCCCC(F)(F)C2)c1O ZINC000291755412 526020210 /nfs/dbraw/zinc/02/02/10/526020210.db2.gz QSMYXQHJCWSFES-GFCCVEGCSA-N 1 0 299.361 3.706 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]Cc1ccc(C2CC2)cc1F ZINC000292723662 526351837 /nfs/dbraw/zinc/35/18/37/526351837.db2.gz FPPPHZBFNMMUDI-UHFFFAOYSA-N 1 0 289.325 3.838 20 10 CHCDRO Cc1csc(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)n1 ZINC000273394085 526359610 /nfs/dbraw/zinc/35/96/10/526359610.db2.gz LOZHOLMSHWLXMO-LBPRGKRZSA-N 1 0 276.405 3.625 20 10 CHCDRO Oc1ccccc1C[NH2+][C@H]1C[C@H](c2ccc(F)cc2)C1 ZINC000292753937 526374410 /nfs/dbraw/zinc/37/44/10/526374410.db2.gz RMVSPYMRWKXRHG-KOMQPUFPSA-N 1 0 271.335 3.567 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]C(CC)(CC)CC)c1 ZINC000236865662 1121368934 /nfs/dbraw/zinc/36/89/34/1121368934.db2.gz KNQJALHFYPEPKM-UHFFFAOYSA-N 1 0 265.397 3.849 20 10 CHCDRO CN(C)c1cc(F)c(C[NH2+]C(C)(C)/C=C/Cl)cc1F ZINC001179626396 1121897324 /nfs/dbraw/zinc/89/73/24/1121897324.db2.gz IUBHKGSYBVEBFR-AATRIKPKSA-N 1 0 288.769 3.652 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCCCOC(C)C)c(O)c1C ZINC000273404359 1122231536 /nfs/dbraw/zinc/23/15/36/1122231536.db2.gz GZDGIXSEPBMWQG-OAHLLOKOSA-N 1 0 279.424 3.865 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2C(C)(C)C2(F)F)c1 ZINC000850552887 1123289708 /nfs/dbraw/zinc/28/97/08/1123289708.db2.gz QHCKVEMVXPXCTM-ZWNOBZJWSA-N 1 0 269.335 3.643 20 10 CHCDRO C[C@H]([NH2+]CC1=CCCC1)c1cc(Cl)ccc1O ZINC000850556805 1123290842 /nfs/dbraw/zinc/29/08/42/1123290842.db2.gz JPUFEEZWYOVTSA-JTQLQIEISA-N 1 0 251.757 3.807 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1ccns1)c1ccc(C)cc1O ZINC000858578290 1123665006 /nfs/dbraw/zinc/66/50/06/1123665006.db2.gz YEPHYHGAYADSFR-DGCLKSJQSA-N 1 0 276.405 3.959 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCC(F)(F)C1)c1cc(F)ccc1O ZINC000281273114 1123692178 /nfs/dbraw/zinc/69/21/78/1123692178.db2.gz YRHQLFBFJBIFOS-UWVGGRQHSA-N 1 0 273.298 3.617 20 10 CHCDRO CC[C@H](CC(F)(F)F)[NH2+]Cc1ccc(C)cc1O ZINC000877353735 1125024885 /nfs/dbraw/zinc/02/48/85/1125024885.db2.gz UUAKXVJXOJXUOE-LLVKDONJSA-N 1 0 261.287 3.521 20 10 CHCDRO COc1cc(O)c(C[N@H+](C)Cc2ccsc2)cc1Cl ZINC001232269617 1132447822 /nfs/dbraw/zinc/44/78/22/1132447822.db2.gz HFASVPVQVXFJQT-UHFFFAOYSA-N 1 0 297.807 3.748 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCS[C@@H]1C)c1cc(Cl)ccc1O ZINC000842927889 1132477751 /nfs/dbraw/zinc/47/77/51/1132477751.db2.gz GOAOHEAGTICRAJ-SBMIAAHKSA-N 1 0 271.813 3.590 20 10 CHCDRO COc1ccc(C2([NH2+]Cc3ccccc3O)CCCC2)cc1 ZINC000116348254 1125508708 /nfs/dbraw/zinc/50/87/08/1125508708.db2.gz UYQVEHKZZALDIJ-UHFFFAOYSA-N 1 0 297.398 3.960 20 10 CHCDRO Cc1ccc(O)c(C[NH+]2CCC3(CCCC3)CC2)c1 ZINC000133986139 1125517008 /nfs/dbraw/zinc/51/70/08/1125517008.db2.gz GEYLXHLXAIMVSE-UHFFFAOYSA-N 1 0 259.393 3.857 20 10 CHCDRO C[C@@H]1CC[C@H]([NH2+]Cc2ccc3c(c2)CCCN3C)C[C@H]1C ZINC000251950493 1125527369 /nfs/dbraw/zinc/52/73/69/1125527369.db2.gz WTHPTFSTBZQOCU-RKVPGOIHSA-N 1 0 286.463 3.983 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CC[C@H](C)C2)cc1 ZINC000135152311 1125579866 /nfs/dbraw/zinc/57/98/66/1125579866.db2.gz WTGAYCIZQXMNFF-GOEBONIOSA-N 1 0 260.425 3.811 20 10 CHCDRO CCOC[C@H]([NH2+][C@H](C)c1ccc(Cl)cc1O)C(C)C ZINC000841753802 1125592181 /nfs/dbraw/zinc/59/21/81/1125592181.db2.gz WOAYGEAGYPUBBR-RISCZKNCSA-N 1 0 285.815 3.757 20 10 CHCDRO C[N@H+](C/C=C/c1ccccc1)Cc1ccccc1O ZINC000220114880 1125699130 /nfs/dbraw/zinc/69/91/30/1125699130.db2.gz SAIXOUIWFJLWOV-JXMROGBWSA-N 1 0 253.345 3.537 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc(C2CC2)no1)c1ccc(N(C)C)cc1 ZINC000886682946 1125706729 /nfs/dbraw/zinc/70/67/29/1125706729.db2.gz SPQXHLCKPKRZQK-QGZVFWFLSA-N 1 0 299.418 3.859 20 10 CHCDRO CC[N@H+](Cc1cc(OC)c(C)cc1O)[C@@H](C)C(C)C ZINC000768439024 1129856242 /nfs/dbraw/zinc/85/62/42/1129856242.db2.gz DGQFLWNFHMAEHF-ZDUSSCGKSA-N 1 0 265.397 3.576 20 10 CHCDRO CC[C@H](C)C[C@H](C)[NH2+][C@@H](C)c1cc(OC)ccc1O ZINC000088293787 1129202867 /nfs/dbraw/zinc/20/28/67/1129202867.db2.gz VXJAGCRRFLBDPC-AVGNSLFASA-N 1 0 265.397 3.876 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)Cc2ccccc2F)cc1 ZINC000302735346 1126740874 /nfs/dbraw/zinc/74/08/74/1126740874.db2.gz GPUMEPXLQSDDOO-UHFFFAOYSA-N 1 0 272.367 3.524 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cccc(C)c1O)c1ccc(OC)cc1 ZINC000158067179 1126745568 /nfs/dbraw/zinc/74/55/68/1126745568.db2.gz UYOADIHXTYVTQW-QGZVFWFLSA-N 1 0 285.387 3.950 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](C)c2ccccn2)cc1 ZINC000152337560 1126756913 /nfs/dbraw/zinc/75/69/13/1126756913.db2.gz XGIFCUZZXLMOAI-CABCVRRESA-N 1 0 283.419 3.950 20 10 CHCDRO CC[C@](C)([NH2+]Cc1cc(C)c(C)cc1O)c1nccs1 ZINC000174419917 1126770282 /nfs/dbraw/zinc/77/02/82/1126770282.db2.gz QBHWNTCFCCUPDH-INIZCTEOSA-N 1 0 290.432 3.881 20 10 CHCDRO Cc1cccc(NC2CC[NH+](Cc3ccccc3O)CC2)c1 ZINC000179578759 1126830851 /nfs/dbraw/zinc/83/08/51/1126830851.db2.gz QYRVMJVKRAWFOE-UHFFFAOYSA-N 1 0 296.414 3.777 20 10 CHCDRO CC1(C)C[N@H+](Cc2c(O)cccc2Cl)[C@@H]1C1CC1 ZINC000811513992 1130619677 /nfs/dbraw/zinc/61/96/77/1130619677.db2.gz YWWKIGLCNKZTFL-CQSZACIVSA-N 1 0 265.784 3.666 20 10 CHCDRO C[C@@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1ccccc1O ZINC000179891998 1126836191 /nfs/dbraw/zinc/83/61/91/1126836191.db2.gz KEOATADWNSQFOU-LLVKDONJSA-N 1 0 290.432 3.997 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+](C)CCC2CCOCC2)c1O ZINC000180380143 1126843146 /nfs/dbraw/zinc/84/31/46/1126843146.db2.gz CAWIRBSYSWDFME-UHFFFAOYSA-N 1 0 297.826 3.603 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]C2CCSCC2)cc1 ZINC000180513008 1126845333 /nfs/dbraw/zinc/84/53/33/1126845333.db2.gz BHZILOJNMFITOT-CYBMUJFWSA-N 1 0 278.465 3.689 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCCOc2ccccc21)c1ccccc1O ZINC000183475600 1126887959 /nfs/dbraw/zinc/88/79/59/1126887959.db2.gz FVTLYRJLIXAYPS-BBRMVZONSA-N 1 0 283.371 3.957 20 10 CHCDRO C[C@H]([NH2+]CCC[C@@H]1CCCCO1)c1ccc(N(C)C)cc1 ZINC000183992706 1126894345 /nfs/dbraw/zinc/89/43/45/1126894345.db2.gz LTCOOPPPHADYOX-YJBOKZPZSA-N 1 0 290.451 3.753 20 10 CHCDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]Cc1cccnc1C ZINC001118808565 1131238404 /nfs/dbraw/zinc/23/84/04/1131238404.db2.gz RZYMONMLTFNMEA-SWLSCSKDSA-N 1 0 282.387 3.742 20 10 CHCDRO CSCc1cccc(C[NH2+]Cc2ccc3c(c2)CCO3)c1 ZINC000189482136 1126932300 /nfs/dbraw/zinc/93/23/00/1126932300.db2.gz MVKJYIOTVXUAOD-UHFFFAOYSA-N 1 0 299.439 3.774 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CC[C@H]2C)cc1F ZINC000783239042 1130805401 /nfs/dbraw/zinc/80/54/01/1130805401.db2.gz JDMVRVKYIUUUHH-IUODEOHRSA-N 1 0 264.388 3.560 20 10 CHCDRO C[C@@H]([NH2+][C@H]1C[C@H]1c1cccc(F)c1)c1ccccc1O ZINC000906594271 1126961152 /nfs/dbraw/zinc/96/11/52/1126961152.db2.gz CTSXMOLYWGBIOE-RLCCDNCMSA-N 1 0 271.335 3.738 20 10 CHCDRO CCOc1ccc(C[NH2+]C[C@@H](SC)C(C)(C)C)c(O)c1 ZINC000784626412 1130913237 /nfs/dbraw/zinc/91/32/37/1130913237.db2.gz SVVPGXIKDCAWJX-OAHLLOKOSA-N 1 0 297.464 3.658 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(Cl)o2)c1 ZINC000698077359 1127039085 /nfs/dbraw/zinc/03/90/85/1127039085.db2.gz ZPEMQEQJLQUENK-SNVBAGLBSA-N 1 0 265.740 3.798 20 10 CHCDRO C[C@H]1c2ccsc2CC[N@H+]1Cc1ccccc1O ZINC000271235795 1127073586 /nfs/dbraw/zinc/07/35/86/1127073586.db2.gz CJMCEKWHJKSWOQ-NSHDSACASA-N 1 0 259.374 3.573 20 10 CHCDRO CCc1ccc(C[N@@H+]2CCCC(F)(F)CC2)c(O)c1 ZINC001236783955 1131005641 /nfs/dbraw/zinc/00/56/41/1131005641.db2.gz PWGQDRWXTWMRPW-UHFFFAOYSA-N 1 0 269.335 3.576 20 10 CHCDRO CCc1ccc(C[NH+]2CC3(C2)CCCCC3)c(O)c1 ZINC001236789670 1131006231 /nfs/dbraw/zinc/00/62/31/1131006231.db2.gz CZCKWWDHNMDVMN-UHFFFAOYSA-N 1 0 259.393 3.721 20 10 CHCDRO CCc1ccc(C[NH+]2CCC(C(C)C)CC2)c(O)c1 ZINC001236791730 1131008745 /nfs/dbraw/zinc/00/87/45/1131008745.db2.gz JCMJRWOSNJSICQ-UHFFFAOYSA-N 1 0 261.409 3.823 20 10 CHCDRO C[C@@H]1C[C@@H](F)CN1Cc1cc(Cl)c(Cl)cc1O ZINC001236794836 1131008076 /nfs/dbraw/zinc/00/80/76/1131008076.db2.gz VGXBGHBGXYPJEY-VXNVDRBHSA-N 1 0 278.154 3.631 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CC[C@@H](c3ccccc3)C2)c1O ZINC000156006650 1127093320 /nfs/dbraw/zinc/09/33/20/1127093320.db2.gz JFSRRRJONGAJNE-MRXNPFEDSA-N 1 0 297.398 3.780 20 10 CHCDRO Oc1cccc(Br)c1C[NH2+]C1(C2CC2)CCC1 ZINC000717838337 1127094840 /nfs/dbraw/zinc/09/48/40/1127094840.db2.gz YXJLHJNVPTYTNJ-UHFFFAOYSA-N 1 0 296.208 3.577 20 10 CHCDRO C[C@]1(CF)CC[N@H+](Cc2cc(C(F)(F)F)ccc2O)C1 ZINC001237135524 1131054067 /nfs/dbraw/zinc/05/40/67/1131054067.db2.gz JGUQVRAZASRHRI-CYBMUJFWSA-N 1 0 291.288 3.593 20 10 CHCDRO C[C@H]1CCC[N@H+](Cc2c(O)ccc(F)c2Cl)CC1 ZINC001237121279 1131054097 /nfs/dbraw/zinc/05/40/97/1131054097.db2.gz AQKUMRFWRAEFFV-JTQLQIEISA-N 1 0 271.763 3.807 20 10 CHCDRO Oc1ccccc1CNc1cc[nH+]c2ccccc12 ZINC000163774891 1127144325 /nfs/dbraw/zinc/14/43/25/1127144325.db2.gz NSGBWVGBOVOZIT-UHFFFAOYSA-N 1 0 250.301 3.553 20 10 CHCDRO CCOC[C@H](C)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000044688695 1127155136 /nfs/dbraw/zinc/15/51/36/1127155136.db2.gz BCMSXMJWMBZVSL-STQMWFEESA-N 1 0 273.376 3.621 20 10 CHCDRO Cc1cc(C)c(O)c(C[NH+]2Cc3ccccc3C2)c1 ZINC000164299956 1127161124 /nfs/dbraw/zinc/16/11/24/1127161124.db2.gz BYKFXZQTIJMPAI-UHFFFAOYSA-N 1 0 253.345 3.525 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2cccs2)c(O)c1 ZINC000283880771 1127161816 /nfs/dbraw/zinc/16/18/16/1127161816.db2.gz CDIHLMSYCKKFEK-GFCCVEGCSA-N 1 0 261.390 3.921 20 10 CHCDRO C[C@H]1C[N@@H+](Cc2cccc(Cl)c2[O-])CC[C@@H]1C ZINC000164383242 1127162341 /nfs/dbraw/zinc/16/23/41/1127162341.db2.gz FCWFAEUQTAHYHO-QWRGUYRKSA-N 1 0 253.773 3.524 20 10 CHCDRO Oc1ccccc1C[N@H+](Cc1cncnc1)C1CCCCC1 ZINC000156774342 1127183707 /nfs/dbraw/zinc/18/37/07/1127183707.db2.gz GKGJPOMEERFMKG-UHFFFAOYSA-N 1 0 297.402 3.517 20 10 CHCDRO COc1cc(C)cc(C[N@H+](Cc2ccccc2)C2CC2)c1O ZINC000124272377 1127359587 /nfs/dbraw/zinc/35/95/87/1127359587.db2.gz JPLIAPWGUWFDET-UHFFFAOYSA-N 1 0 297.398 3.874 20 10 CHCDRO CC1(C)C[C@H]1C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000226257299 1127387893 /nfs/dbraw/zinc/38/78/93/1127387893.db2.gz PHRTYEQLLMKVDW-INIZCTEOSA-N 1 0 272.436 3.813 20 10 CHCDRO CCCC[C@H](CCC)[NH2+]Cc1cccc(OC)c1O ZINC000226269734 1127389288 /nfs/dbraw/zinc/38/92/88/1127389288.db2.gz QHWVFFCUCMEKEO-AWEZNQCLSA-N 1 0 265.397 3.849 20 10 CHCDRO C[C@H](CC[NH2+]Cc1cc(F)ccc1O)c1ccccc1 ZINC000226589522 1127412643 /nfs/dbraw/zinc/41/26/43/1127412643.db2.gz CDLXQCDKXMUMAR-CYBMUJFWSA-N 1 0 273.351 3.815 20 10 CHCDRO CCc1ccc(C[NH2+]Cc2cc(C)ccc2O)cc1 ZINC000226647083 1127415281 /nfs/dbraw/zinc/41/52/81/1127415281.db2.gz CTJJYEXRCXHUJC-UHFFFAOYSA-N 1 0 255.361 3.553 20 10 CHCDRO COc1ccc([C@H](C)[NH2+]Cc2cccc(C)c2O)cc1F ZINC000158080968 1127436786 /nfs/dbraw/zinc/43/67/86/1127436786.db2.gz CNVPUJVSNASXRT-LBPRGKRZSA-N 1 0 289.350 3.699 20 10 CHCDRO COc1ccc([C@H](C)[NH2+]Cc2cccc(C)c2O)cc1 ZINC000158123919 1127452008 /nfs/dbraw/zinc/45/20/08/1127452008.db2.gz XMKUOFZUXHDCJR-ZDUSSCGKSA-N 1 0 271.360 3.560 20 10 CHCDRO COC(C)(C)C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000168824169 1127471346 /nfs/dbraw/zinc/47/13/46/1127471346.db2.gz XHLLHUPAFGTNAS-GFCCVEGCSA-N 1 0 273.376 3.621 20 10 CHCDRO CCOc1cccc(C[NH2+]C[C@H]2CCC[C@H](C)C2)c1O ZINC000227439799 1127478149 /nfs/dbraw/zinc/47/81/49/1127478149.db2.gz LAXUEEANEQXDLN-KBPBESRZSA-N 1 0 277.408 3.707 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@H]2CSCCS2)c(O)c1 ZINC000294566251 1127582404 /nfs/dbraw/zinc/58/24/04/1127582404.db2.gz BSCNKLMHQVDAEX-OLZOCXBDSA-N 1 0 297.489 3.508 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+][C@H]2CCCC2(C)C)c1O ZINC000228675903 1127585798 /nfs/dbraw/zinc/58/57/98/1127585798.db2.gz FBQSLMDYEVTNHK-ZDUSSCGKSA-N 1 0 283.799 3.723 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@H]2CCCSC2)c(O)c1 ZINC000294895845 1127606701 /nfs/dbraw/zinc/60/67/01/1127606701.db2.gz VQKBUQUBSZHJEB-STQMWFEESA-N 1 0 265.422 3.555 20 10 CHCDRO Cc1cccc(C[NH2+][C@H](c2ccccc2)[C@H]2CCOC2)c1O ZINC000362043346 1127607498 /nfs/dbraw/zinc/60/74/98/1127607498.db2.gz WVFCTHQQUHUESH-ZWKOTPCHSA-N 1 0 297.398 3.568 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H](c2ccccc2)[C@@H]2CCOC2)c1O ZINC000362043337 1127607715 /nfs/dbraw/zinc/60/77/15/1127607715.db2.gz WVFCTHQQUHUESH-MSOLQXFVSA-N 1 0 297.398 3.568 20 10 CHCDRO C[C@@H](CC(C)(C)O)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000295059324 1127617268 /nfs/dbraw/zinc/61/72/68/1127617268.db2.gz OCGXQXWBGLLTAJ-AWEZNQCLSA-N 1 0 299.414 3.698 20 10 CHCDRO C[C@@H]1[C@@H](CC(F)(F)F)C[C@H](C)[N@H+]1Cc1ccccc1O ZINC000295021422 1127614153 /nfs/dbraw/zinc/61/41/53/1127614153.db2.gz CHCXHIZSFFOLDW-DMDPSCGWSA-N 1 0 287.325 3.944 20 10 CHCDRO CCOc1cccc(C[NH2+]CC2CCC(C)CC2)c1O ZINC000060942166 1127624820 /nfs/dbraw/zinc/62/48/20/1127624820.db2.gz OPAUGSAEZMKXAO-UHFFFAOYSA-N 1 0 277.408 3.707 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(F)cnc1Cl)c1ccccc1O ZINC000295176977 1127625503 /nfs/dbraw/zinc/62/55/03/1127625503.db2.gz VCZLXVXVRGOEHL-ZDUSSCGKSA-N 1 0 294.757 3.821 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]Cc1cc(C2CC2)ccc1F ZINC000295188951 1127625869 /nfs/dbraw/zinc/62/58/69/1127625869.db2.gz WYQAHPDQNYPWHG-UHFFFAOYSA-N 1 0 289.325 3.838 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]C[C@@H]1CCCC(F)(F)C1)CC2 ZINC000296422997 1127671423 /nfs/dbraw/zinc/67/14/23/1127671423.db2.gz LNVKOIUQONEBCY-DGCLKSJQSA-N 1 0 281.346 3.795 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]C[C@H]1CCCC(F)(F)C1)CC2 ZINC000296422988 1127671642 /nfs/dbraw/zinc/67/16/42/1127671642.db2.gz LNVKOIUQONEBCY-AAEUAGOBSA-N 1 0 281.346 3.795 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CCC(C)(F)F)c(O)c1 ZINC000297416368 1127696405 /nfs/dbraw/zinc/69/64/05/1127696405.db2.gz UJFMVGCWFHISAV-NSHDSACASA-N 1 0 257.324 3.705 20 10 CHCDRO CS[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000230663510 1127771885 /nfs/dbraw/zinc/77/18/85/1127771885.db2.gz AMZYEYRCACDFGT-PSOPSSQASA-N 1 0 283.412 3.856 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2[C@@H]3CCCO[C@H]3C2(C)C)c(O)c1 ZINC000371870200 1127782791 /nfs/dbraw/zinc/78/27/91/1127782791.db2.gz OCKZUCCVJNIPNW-GUDXXQAFSA-N 1 0 289.419 3.555 20 10 CHCDRO Cc1ccc2c(c1)[C@H]([NH2+][C@@H](C)c1ccc(C)cc1O)CO2 ZINC000373263969 1127830618 /nfs/dbraw/zinc/83/06/18/1127830618.db2.gz ALZQDANLCCULLR-XJKSGUPXSA-N 1 0 283.371 3.793 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@]2(C)CCO[C@H]2C2CC2)c1 ZINC000373344498 1127835557 /nfs/dbraw/zinc/83/55/57/1127835557.db2.gz BAABVPALLSJTMR-KKXDTOCCSA-N 1 0 289.419 3.556 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCCc2cn[nH]c21)c1ccc(C)cc1O ZINC000373559703 1127849196 /nfs/dbraw/zinc/84/91/96/1127849196.db2.gz CPXRPEVAYCWMQT-GJZGRUSLSA-N 1 0 285.391 3.542 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1cc(Br)ccc1O)C1CC1 ZINC000134911275 1128115497 /nfs/dbraw/zinc/11/54/97/1128115497.db2.gz ODLPJSHVCBVSKT-BDAKNGLRSA-N 1 0 284.197 3.604 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCc3cccc(O)c3C2)c1C ZINC001205096208 1128136347 /nfs/dbraw/zinc/13/63/47/1128136347.db2.gz XAWQKVGBRBYNFE-UHFFFAOYSA-N 1 0 267.372 3.567 20 10 CHCDRO CC[C@](C)([NH2+]Cc1cc(Cl)ccc1O)c1nccs1 ZINC000152664743 1128144986 /nfs/dbraw/zinc/14/49/86/1128144986.db2.gz UNUIHSHGURNTDA-AWEZNQCLSA-N 1 0 296.823 3.917 20 10 CHCDRO c1cc(N2CCCCC2)ccc1C[N@@H+]1CCC[C@@H]2C[C@@H]21 ZINC001138220613 1128148034 /nfs/dbraw/zinc/14/80/34/1128148034.db2.gz IWDLKKYJJOYHDH-AEFFLSMTSA-N 1 0 270.420 3.661 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc2c(c1)C[C@@H](C)O2)c1ccccc1O ZINC000926922539 1128202984 /nfs/dbraw/zinc/20/29/84/1128202984.db2.gz ZTMDGEGCEZGORM-DYVFJYSZSA-N 1 0 297.398 3.957 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1C[C@H]1C(F)(F)F)c1ccccc1O ZINC000926946251 1128204424 /nfs/dbraw/zinc/20/44/24/1128204424.db2.gz AOHSJTQRMUSNTM-MVWJERBFSA-N 1 0 273.298 3.631 20 10 CHCDRO C[C@@H]([N@H+](C)Cc1cc2c(cc1O)CCC2)C(C)(C)C ZINC000914568108 1128211910 /nfs/dbraw/zinc/21/19/10/1128211910.db2.gz AJUKVMATHOVMFD-GFCCVEGCSA-N 1 0 261.409 3.747 20 10 CHCDRO CC[C@@H]1CCC[N@H+](Cc2cc3c(cc2O)CCC3)C1 ZINC000915205269 1128291051 /nfs/dbraw/zinc/29/10/51/1128291051.db2.gz AESGSXURNUVIMI-CYBMUJFWSA-N 1 0 259.393 3.503 20 10 CHCDRO CCCC[N@H+](Cc1cnc(CC)o1)Cc1ccccc1O ZINC000930352899 1128315518 /nfs/dbraw/zinc/31/55/18/1128315518.db2.gz ZQPDUXRHBFOYFC-UHFFFAOYSA-N 1 0 288.391 3.745 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCc2ccccc2F)c1 ZINC000035628597 1128319205 /nfs/dbraw/zinc/31/92/05/1128319205.db2.gz ZZQIIOCDGZAIJP-CYBMUJFWSA-N 1 0 273.351 3.733 20 10 CHCDRO C[C@H]1[N@H+](Cc2c(O)ccc3ccccc32)CCOC1(C)C ZINC000763204487 1128376108 /nfs/dbraw/zinc/37/61/08/1128376108.db2.gz KPOVTLAWKUMORN-CYBMUJFWSA-N 1 0 285.387 3.545 20 10 CHCDRO Cc1nc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)sc1C ZINC000153863452 1128408086 /nfs/dbraw/zinc/40/80/86/1128408086.db2.gz QXVAUIFQJJXQNM-LBPRGKRZSA-N 1 0 289.448 3.677 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]CCCc2cccc(C)c2)c1 ZINC000778231095 1128455176 /nfs/dbraw/zinc/45/51/76/1128455176.db2.gz DDRIKOOWLRTWPL-OAHLLOKOSA-N 1 0 299.414 3.993 20 10 CHCDRO CC[C@@H]([NH2+]CCOc1ccccc1)c1ccccc1O ZINC000042895507 1128589386 /nfs/dbraw/zinc/58/93/86/1128589386.db2.gz ZRFYWCGCCQFETD-MRXNPFEDSA-N 1 0 271.360 3.512 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CC[C@@H]3CCCC[C@@H]32)c1O ZINC000156101432 1128625711 /nfs/dbraw/zinc/62/57/11/1128625711.db2.gz ZJVHKDXCYSXTCL-ZFWWWQNUSA-N 1 0 275.392 3.555 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](C)C2CCCCC2)c1 ZINC000157507227 1128655850 /nfs/dbraw/zinc/65/58/50/1128655850.db2.gz VRDZXHDULQAWNY-UHFFFAOYSA-N 1 0 263.381 3.555 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)Cc2cccc3[nH]ccc32)cc1 ZINC000155187430 1128664982 /nfs/dbraw/zinc/66/49/82/1128664982.db2.gz KREULBICKKVDMU-UHFFFAOYSA-N 1 0 293.414 3.866 20 10 CHCDRO CCOCCC[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000158637125 1128669868 /nfs/dbraw/zinc/66/98/68/1128669868.db2.gz DULPPXPZVSEDDI-UHFFFAOYSA-N 1 0 290.451 3.535 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CC2C[C@@H]3CC1C[C@H](C2)C3 ZINC000778998924 1128675327 /nfs/dbraw/zinc/67/53/27/1128675327.db2.gz FNCFFEWHLGLSCY-ZAQWFSBCSA-N 1 0 275.367 3.542 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000779014951 1128679473 /nfs/dbraw/zinc/67/94/73/1128679473.db2.gz MMJKWKSVMJBVHO-CYBMUJFWSA-N 1 0 289.325 3.660 20 10 CHCDRO CC(C)[C@H]1CCC[N@@H+]1Cc1cc2c(cc1O)CCC2 ZINC000920484962 1128684239 /nfs/dbraw/zinc/68/42/39/1128684239.db2.gz LLRYEZKHHWJQIX-MRXNPFEDSA-N 1 0 259.393 3.501 20 10 CHCDRO Oc1ccccc1C[NH2+][C@@H]1CCSc2c(F)cccc21 ZINC000134226401 1128706080 /nfs/dbraw/zinc/70/60/80/1128706080.db2.gz HSRIQNVMMCTUKQ-CQSZACIVSA-N 1 0 289.375 3.858 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]Cc2ccccc2O)cc1 ZINC000134226727 1128705936 /nfs/dbraw/zinc/70/59/36/1128705936.db2.gz XSYSHDLZRVRSKD-UHFFFAOYSA-N 1 0 284.403 3.528 20 10 CHCDRO CC(C)([NH2+]Cc1cc(F)ccc1O)c1cccs1 ZINC000779077362 1128721474 /nfs/dbraw/zinc/72/14/74/1128721474.db2.gz GWDBRCZNCPUACL-UHFFFAOYSA-N 1 0 265.353 3.618 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)c2cc(F)ccc2O)c(C)c1 ZINC000185066852 1117759700 /nfs/dbraw/zinc/75/97/00/1117759700.db2.gz IAAFPWXNFMUXMS-CYBMUJFWSA-N 1 0 273.351 3.999 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)C1CC1 ZINC000035136647 1117782709 /nfs/dbraw/zinc/78/27/09/1117782709.db2.gz OVBRKTICAUKCSR-AWEZNQCLSA-N 1 0 258.409 3.565 20 10 CHCDRO Cc1nc(C)c(CC[NH2+][C@H](C)c2ccc(C)cc2O)s1 ZINC000185402996 1117819378 /nfs/dbraw/zinc/81/93/78/1117819378.db2.gz CEYNUSBTNOGAHU-LLVKDONJSA-N 1 0 290.432 3.667 20 10 CHCDRO CCS[C@H]1CCC[C@H]1[NH2+]Cc1ccc(N(C)C)cc1 ZINC000233848344 1128737344 /nfs/dbraw/zinc/73/73/44/1128737344.db2.gz GNJKVTOCQWEYEN-CVEARBPZSA-N 1 0 278.465 3.516 20 10 CHCDRO C[C@H]([NH2+]CCCNc1ccccc1)c1cc(F)ccc1O ZINC000185489582 1117829014 /nfs/dbraw/zinc/82/90/14/1117829014.db2.gz GNSUMTYSJDWQQL-ZDUSSCGKSA-N 1 0 288.366 3.684 20 10 CHCDRO CSC[C@@H](C)[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000185495004 1117830692 /nfs/dbraw/zinc/83/06/92/1117830692.db2.gz AEYMVKWRHXRZLZ-NEPJUHHUSA-N 1 0 279.449 3.673 20 10 CHCDRO CCO[C@H](CC[NH2+][C@H](C)c1ccc(C)cc1O)C(C)C ZINC000185625710 1117859754 /nfs/dbraw/zinc/85/97/54/1117859754.db2.gz NQLAJFCRNSUABY-RHSMWYFYSA-N 1 0 279.424 3.802 20 10 CHCDRO CSc1ccc([C@@H](C)[NH2+]Cc2ccccc2O)cc1 ZINC000036994322 1117954572 /nfs/dbraw/zinc/95/45/72/1117954572.db2.gz HJQMPFUOFSCMAA-GFCCVEGCSA-N 1 0 273.401 3.965 20 10 CHCDRO C[C@H](C[NH2+][C@@H](C)c1cc(F)ccc1O)Oc1ccccc1 ZINC000186041256 1117974113 /nfs/dbraw/zinc/97/41/13/1117974113.db2.gz SUEZFCDEPYAQKV-OLZOCXBDSA-N 1 0 289.350 3.649 20 10 CHCDRO CC[C@H]([NH2+]CCSC(F)(F)F)c1ccccc1O ZINC000186121328 1118003156 /nfs/dbraw/zinc/00/31/56/1118003156.db2.gz VZPUFWRHZJIGSS-JTQLQIEISA-N 1 0 279.327 3.686 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCSC2(CCCCC2)C1 ZINC000179581029 1128749260 /nfs/dbraw/zinc/74/92/60/1128749260.db2.gz FXQOCLQKZQZNFB-UHFFFAOYSA-N 1 0 277.433 3.644 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CCC[C@H](C(C)C)CC2)c1 ZINC000211391347 1118024154 /nfs/dbraw/zinc/02/41/54/1118024154.db2.gz XLJTVNPEDFEVDM-AWEZNQCLSA-N 1 0 277.408 3.659 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCC[C@H](C)C1)c1ccc(N(C)C)cc1 ZINC000037510435 1118028036 /nfs/dbraw/zinc/02/80/36/1118028036.db2.gz VKXALDADRKGCGY-DZKIICNBSA-N 1 0 260.425 3.982 20 10 CHCDRO Oc1ccccc1C[NH2+]Cc1ccccc1N1CCCCC1 ZINC000779151923 1128752155 /nfs/dbraw/zinc/75/21/55/1128752155.db2.gz ZJUDQMNKDHYJEI-UHFFFAOYSA-N 1 0 296.414 3.672 20 10 CHCDRO CCC[C@H](C)[NH2+][C@H](C)c1ccc(N2CCOCC2)c(F)c1 ZINC000764435455 1118092687 /nfs/dbraw/zinc/09/26/87/1118092687.db2.gz NGHFHPFTYZHFQJ-UONOGXRCSA-N 1 0 294.414 3.502 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1ccccc1 ZINC000039152008 1118124917 /nfs/dbraw/zinc/12/49/17/1118124917.db2.gz DRFYWBXOVUIBRS-IUODEOHRSA-N 1 0 253.345 3.730 20 10 CHCDRO CC[C@H](C)[C@@H](C)[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000765080172 1118133959 /nfs/dbraw/zinc/13/39/59/1118133959.db2.gz LMGXPORZTGLHCT-LSDHHAIUSA-N 1 0 292.492 3.764 20 10 CHCDRO C[C@H]([NH2+]CCC(C)(C)C)c1ccc(N2CCOCC2)cc1 ZINC000765335720 1118145026 /nfs/dbraw/zinc/14/50/26/1118145026.db2.gz XAAIJHKZCBWSQV-HNNXBMFYSA-N 1 0 290.451 3.610 20 10 CHCDRO COc1ccccc1C1([NH2+][C@@H](C)c2ccccc2O)CC1 ZINC000842902245 1118163388 /nfs/dbraw/zinc/16/33/88/1118163388.db2.gz MPWLOSNYVCNKQZ-ZDUSSCGKSA-N 1 0 283.371 3.741 20 10 CHCDRO Clc1ccc2c(c1)C[C@@H]([NH2+]Cc1ccc3c(c1)CCO3)C2 ZINC000765610456 1118182457 /nfs/dbraw/zinc/18/24/57/1118182457.db2.gz VDTKQNTVXSCIHY-KRWDZBQOSA-N 1 0 299.801 3.532 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]CC2(C3CC3)CCC2)c1 ZINC000186156540 1118198203 /nfs/dbraw/zinc/19/82/03/1118198203.db2.gz BVWYJPGJADDKDY-LBPRGKRZSA-N 1 0 275.392 3.632 20 10 CHCDRO CS[C@H](C)C[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000186156922 1118199389 /nfs/dbraw/zinc/19/93/89/1118199389.db2.gz IUHJRRNQKVEAJK-NEPJUHHUSA-N 1 0 279.449 3.673 20 10 CHCDRO CC(C)=CC[NH2+][C@@H](C)c1cc(Br)ccc1O ZINC000188446986 1128762624 /nfs/dbraw/zinc/76/26/24/1128762624.db2.gz OFTVBKBGVZQVKI-JTQLQIEISA-N 1 0 284.197 3.772 20 10 CHCDRO Fc1ccc(C[NH2+]Cc2ccc3c(c2)CCCO3)c(F)c1 ZINC000921620157 1118225895 /nfs/dbraw/zinc/22/58/95/1118225895.db2.gz JTQUXGJASSRFKR-UHFFFAOYSA-N 1 0 289.325 3.580 20 10 CHCDRO Cc1ccc(C)c(C[NH+]2CCC(C(F)(F)F)CC2)c1O ZINC001140178737 1118243194 /nfs/dbraw/zinc/24/31/94/1118243194.db2.gz VZNLOZKFYMFZIX-UHFFFAOYSA-N 1 0 287.325 3.783 20 10 CHCDRO Cc1ccc(CC[NH2+][C@@H](C)c2ccccc2O)cc1 ZINC000179877653 1128765094 /nfs/dbraw/zinc/76/50/94/1128765094.db2.gz GYKSTNHOMAUSNY-AWEZNQCLSA-N 1 0 255.361 3.594 20 10 CHCDRO COc1ccc([C@H](C)[N@H+](C)Cc2cc(F)ccc2O)cc1 ZINC000179910250 1128765910 /nfs/dbraw/zinc/76/59/10/1128765910.db2.gz GATLHGGQSMOWPC-LBPRGKRZSA-N 1 0 289.350 3.733 20 10 CHCDRO Cc1cccc(NCc2cc(Cl)cc(F)c2O)n1 ZINC001648856079 1118261328 /nfs/dbraw/zinc/26/13/28/1118261328.db2.gz SIDTWJPROMYUBN-UHFFFAOYSA-N 1 0 266.703 3.500 20 10 CHCDRO CC[C@@H](C)C[NH2+][C@@H](C)Cc1ccc(N(C)C)cc1C ZINC001651228324 1118265124 /nfs/dbraw/zinc/26/51/24/1118265124.db2.gz VAXNMZWUVIHICM-HIFRSBDPSA-N 1 0 262.441 3.628 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](C)CN(CC)CC)cc1 ZINC000765765571 1118267683 /nfs/dbraw/zinc/26/76/83/1118267683.db2.gz GWVDUNGJCPIVRN-HOTGVXAUSA-N 1 0 291.483 3.524 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)cn1 ZINC000062050915 1118347713 /nfs/dbraw/zinc/34/77/13/1118347713.db2.gz YYPGKJZIHFRPHS-SWLSCSKDSA-N 1 0 282.387 3.742 20 10 CHCDRO COc1ccc(CC(C)(C)[NH2+]Cc2ccccc2O)cc1 ZINC000189455945 1128773629 /nfs/dbraw/zinc/77/36/29/1128773629.db2.gz UDHJCKCMMRWAAG-UHFFFAOYSA-N 1 0 285.387 3.512 20 10 CHCDRO Oc1ccccc1C[NH+]1CCC(Cc2ccc(F)cc2)CC1 ZINC001203556533 1118386764 /nfs/dbraw/zinc/38/67/64/1118386764.db2.gz RQBKAHSQUAGNFU-UHFFFAOYSA-N 1 0 299.389 3.986 20 10 CHCDRO Oc1c(C[NH2+][C@@H]2CCCC23CC3)ccc2ccccc21 ZINC001207066797 1118400592 /nfs/dbraw/zinc/40/05/92/1118400592.db2.gz JKKGOJCTNQJFFJ-MRXNPFEDSA-N 1 0 267.372 3.968 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2ccc3c(c2)CCCN3C)s1 ZINC000050266794 1118470464 /nfs/dbraw/zinc/47/04/64/1118470464.db2.gz MBKKZEIVPKLRRF-UHFFFAOYSA-N 1 0 286.444 3.729 20 10 CHCDRO C[N@@H+](Cc1ccc(Br)cc1O)C[C@@H]1CC1(C)C ZINC001659739848 1118487791 /nfs/dbraw/zinc/48/77/91/1118487791.db2.gz UXNYDEXEIQOWCE-NSHDSACASA-N 1 0 298.224 3.633 20 10 CHCDRO CCc1ccc(C[NH2+][C@@H]2CCc3cccc(O)c32)s1 ZINC000295826744 1118549218 /nfs/dbraw/zinc/54/92/18/1118549218.db2.gz DSSKZJSYICRQIX-CQSZACIVSA-N 1 0 273.401 3.793 20 10 CHCDRO CSCC1CCC([NH2+][C@H](C)c2ccccc2O)CC1 ZINC000296335478 1118575341 /nfs/dbraw/zinc/57/53/41/1118575341.db2.gz HNXKBHXAUUGBHZ-IYXRBSQSSA-N 1 0 279.449 3.965 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)[C@@H](OC)C1CC1)c1ccc(N(C)C)cc1 ZINC000834904929 1118623214 /nfs/dbraw/zinc/62/32/14/1118623214.db2.gz QZXXHRZHPKDHIA-DOPJRALCSA-N 1 0 290.451 3.607 20 10 CHCDRO CC[C@H]([NH2+]CCC[C@H]1CCOC1)c1cc(Cl)ccc1O ZINC000834906591 1118623661 /nfs/dbraw/zinc/62/36/61/1118623661.db2.gz XVRJOZNSBJUGIQ-WFASDCNBSA-N 1 0 297.826 3.903 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)cc1 ZINC000283689223 1118642566 /nfs/dbraw/zinc/64/25/66/1118642566.db2.gz AAYTXOZAECWPSW-CQSZACIVSA-N 1 0 285.387 3.868 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2c(O)cccc2Br)[C@H](C)C1 ZINC000707145792 1118648074 /nfs/dbraw/zinc/64/80/74/1118648074.db2.gz HJJZHDSLWDVUJY-GHMZBOCLSA-N 1 0 298.224 3.775 20 10 CHCDRO C[C@H]1CCCCC[N@@H+]1Cc1ccc(Cl)cc1O ZINC001140465267 1118740425 /nfs/dbraw/zinc/74/04/25/1118740425.db2.gz LZSLHUZGJPRPKT-NSHDSACASA-N 1 0 253.773 3.810 20 10 CHCDRO COc1ccccc1C(C)(C)[NH2+]Cc1cc(F)ccc1O ZINC000180617234 1128800302 /nfs/dbraw/zinc/80/03/02/1128800302.db2.gz UNIRUCMRZNPTDY-UHFFFAOYSA-N 1 0 289.350 3.565 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000386462294 1118850288 /nfs/dbraw/zinc/85/02/88/1118850288.db2.gz GCKYHFHYFOKYRB-TXEJJXNPSA-N 1 0 265.784 3.668 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+]([C@H](C)C2CC2)C2CC2)c1 ZINC000092009952 1119050355 /nfs/dbraw/zinc/05/03/55/1119050355.db2.gz FWCFHPGHRSZBJZ-GFCCVEGCSA-N 1 0 275.392 3.554 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(OC)ccc1O)c1ccccc1F ZINC000180900453 1128818737 /nfs/dbraw/zinc/81/87/37/1128818737.db2.gz NQFKHELCIKWRIC-INIZCTEOSA-N 1 0 289.350 3.781 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2Cc3ccccc3C(C)(C)C2)c1 ZINC001140622824 1119293936 /nfs/dbraw/zinc/29/39/36/1119293936.db2.gz AJIXXFJQCGEKPW-UHFFFAOYSA-N 1 0 281.399 3.994 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCC2SCCS2)c(O)c1 ZINC000693775493 1119333583 /nfs/dbraw/zinc/33/35/83/1119333583.db2.gz DYTRISRYOLNZJQ-LLVKDONJSA-N 1 0 283.462 3.547 20 10 CHCDRO CC[C@@H](C)[NH2+]Cc1ccc(N(CC)CC)c(F)c1 ZINC000236899800 1119354434 /nfs/dbraw/zinc/35/44/34/1119354434.db2.gz MTUCMEOSPZQXPU-GFCCVEGCSA-N 1 0 252.377 3.560 20 10 CHCDRO Cc1cnc(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)s1 ZINC000230664070 1119413066 /nfs/dbraw/zinc/41/30/66/1119413066.db2.gz VEOXKQXTQDYYJK-CMPLNLGQSA-N 1 0 288.416 3.804 20 10 CHCDRO CSCCCC[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C ZINC000168784735 1119478069 /nfs/dbraw/zinc/47/80/69/1119478069.db2.gz OKHCJWBSMICFNK-QWHCGFSZSA-N 1 0 279.449 3.982 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]CC[C@@H]1CCCCO1 ZINC000230672128 1119541473 /nfs/dbraw/zinc/54/14/73/1119541473.db2.gz UFILLDSDJLSVEF-QLFBSQMISA-N 1 0 289.419 3.798 20 10 CHCDRO CC[C@@H]([NH2+]CC(C)(C)C[C@H](C)O)c1ccc(N(C)C)cc1 ZINC000090086222 1119545270 /nfs/dbraw/zinc/54/52/70/1119545270.db2.gz JTDSZYIGUSTHQZ-WMLDXEAASA-N 1 0 292.467 3.590 20 10 CHCDRO C[C@@H]1[C@H](c2ccccc2)CC[N@@H+]1Cc1ccccc1O ZINC000179580489 1119751613 /nfs/dbraw/zinc/75/16/13/1119751613.db2.gz XEHIIQGXXJSQSB-RHSMWYFYSA-N 1 0 267.372 3.770 20 10 CHCDRO CCC[N@H+](Cc1cnn(C(C)C)c1)Cc1ccccc1O ZINC000179745382 1119759136 /nfs/dbraw/zinc/75/91/36/1119759136.db2.gz WXUKJXWZIZENNN-UHFFFAOYSA-N 1 0 287.407 3.582 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCCOc2ccccc2)c1 ZINC000052092053 1119781458 /nfs/dbraw/zinc/78/14/58/1119781458.db2.gz RBKROHKNCKBFIE-OAHLLOKOSA-N 1 0 285.387 3.820 20 10 CHCDRO C[C@H]([NH2+]Cc1coc(-c2ccccc2)n1)c1ccccc1O ZINC000179894537 1119790907 /nfs/dbraw/zinc/79/09/07/1119790907.db2.gz QVUWEMISRQYZPA-ZDUSSCGKSA-N 1 0 294.354 3.898 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CCCOC(C)C)cc1 ZINC000178191817 1119945199 /nfs/dbraw/zinc/94/51/99/1119945199.db2.gz WQNSPFNLWHVBAP-HNNXBMFYSA-N 1 0 278.440 3.608 20 10 CHCDRO C[C@H]([NH2+]CCOCC1CCC1)c1cc(Cl)ccc1O ZINC000765811666 1120050798 /nfs/dbraw/zinc/05/07/98/1120050798.db2.gz VELMUHBZHXFBDH-NSHDSACASA-N 1 0 283.799 3.513 20 10 CHCDRO C[C@H]([NH2+][C@@H]1C[C@H]2CCC[C@H]21)c1cc(F)cc(F)c1[O-] ZINC000903315650 1120081652 /nfs/dbraw/zinc/08/16/52/1120081652.db2.gz FZGRZAFMRZVMNH-AUDJIGTPSA-N 1 0 267.319 3.510 20 10 CHCDRO C[C@H]([NH2+][C@@H]1C[C@@H]2CCC[C@H]12)c1cc(F)cc(F)c1[O-] ZINC000903315651 1120082255 /nfs/dbraw/zinc/08/22/55/1120082255.db2.gz FZGRZAFMRZVMNH-FIRSBJHFSA-N 1 0 267.319 3.510 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCCC(F)(F)C1)c1ccccc1O ZINC000695066083 1120100653 /nfs/dbraw/zinc/10/06/53/1120100653.db2.gz MWTCILQVVPLUTA-MNOVXSKESA-N 1 0 255.308 3.621 20 10 CHCDRO CCC(C)(C)[C@H](C)[NH2+][C@H](C)c1cc(OC)ccc1O ZINC000695107866 1120108489 /nfs/dbraw/zinc/10/84/89/1120108489.db2.gz PHWCAKPHOSFEJM-NEPJUHHUSA-N 1 0 265.397 3.876 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CC3CCC2CC3)c(O)c1 ZINC000311858321 1120113624 /nfs/dbraw/zinc/11/36/24/1120113624.db2.gz JZWCFEQPSUPJAP-USPMSXPRSA-N 1 0 259.393 3.930 20 10 CHCDRO Clc1ccsc1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000785448253 1120128452 /nfs/dbraw/zinc/12/84/52/1120128452.db2.gz MVFLSVCZMMLUJK-UHFFFAOYSA-N 1 0 279.792 3.626 20 10 CHCDRO Oc1ccccc1C[NH2+]C1CC(c2ccc(F)cc2F)C1 ZINC000892792241 1120142575 /nfs/dbraw/zinc/14/25/75/1120142575.db2.gz SBRZJWBLXBPAMR-UHFFFAOYSA-N 1 0 289.325 3.706 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@H]1CCc3ccccc3C1)CC2 ZINC000314450152 1120210483 /nfs/dbraw/zinc/21/04/83/1120210483.db2.gz DOEXVVPKXARMAS-DLBZAZTESA-N 1 0 279.383 3.527 20 10 CHCDRO Cc1cc(C[NH2+]C[C@@H]2CCCOC2)c(C)n1-c1ccccc1 ZINC000314486944 1120219741 /nfs/dbraw/zinc/21/97/41/1120219741.db2.gz QKMFGOKONNKPSB-KRWDZBQOSA-N 1 0 298.430 3.610 20 10 CHCDRO CN(C)c1cccc([C@H]2CCC[N@@H+]2Cc2ccccc2O)c1 ZINC000179577451 1120250434 /nfs/dbraw/zinc/25/04/34/1120250434.db2.gz FROFYSOOXBEHHE-GOSISDBHSA-N 1 0 296.414 3.795 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCS[C@H]2C)cc1 ZINC000312089293 1120293187 /nfs/dbraw/zinc/29/31/87/1120293187.db2.gz PADPFUFABFCFAK-BBRMVZONSA-N 1 0 278.465 3.516 20 10 CHCDRO c1cncc([C@@H]([NH2+]Cc2ccc3c(c2)CCCO3)C2CC2)c1 ZINC000921939451 1120293954 /nfs/dbraw/zinc/29/39/54/1120293954.db2.gz BMRFLMAJTGZWJJ-IBGZPJMESA-N 1 0 294.398 3.648 20 10 CHCDRO C[C@H]1C[C@@H](CF)[N@H+](Cc2cccc(C(C)(C)C)c2O)C1 ZINC001143104691 1120350264 /nfs/dbraw/zinc/35/02/64/1120350264.db2.gz XGMSMPJJENNEHF-JSGCOSHPSA-N 1 0 279.399 3.870 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCO[C@@H]2CCCC[C@H]2C)c1 ZINC000756440599 1120351732 /nfs/dbraw/zinc/35/17/32/1120351732.db2.gz FPMYOOAKINEARP-RVKKMQEKSA-N 1 0 291.435 3.947 20 10 CHCDRO Cc1noc(C)c1[C@H](C)[NH2+][C@H](C)c1ccc(C)cc1O ZINC000092327735 1120356581 /nfs/dbraw/zinc/35/65/81/1120356581.db2.gz GBFHXWGIOKBZDM-MNOVXSKESA-N 1 0 274.364 3.717 20 10 CHCDRO CC(=O)Nc1ccc(C[NH2+][C@@H](C)c2cc(C)ccc2O)cc1 ZINC000184916090 1120366525 /nfs/dbraw/zinc/36/65/25/1120366525.db2.gz BFWRZBTYPHOCPV-ZDUSSCGKSA-N 1 0 298.386 3.510 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCSC(F)(F)F)c1 ZINC000185086292 1120371077 /nfs/dbraw/zinc/37/10/77/1120371077.db2.gz ZHGBBUGGGDSHDN-SECBINFHSA-N 1 0 279.327 3.604 20 10 CHCDRO C[C@H](C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F)C1CC1 ZINC000756483700 1120372564 /nfs/dbraw/zinc/37/25/64/1120372564.db2.gz VJVUJXODGHUSDO-GIPNMCIBSA-N 1 0 263.356 3.715 20 10 CHCDRO C[C@@H]([NH2+]CCc1cc(F)ccc1F)c1cc(F)ccc1O ZINC000185633948 1120380205 /nfs/dbraw/zinc/38/02/05/1120380205.db2.gz RIRZSVSJHCDEPU-SNVBAGLBSA-N 1 0 295.304 3.703 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]C1CCC2(CC2)CC1 ZINC000695700102 1120391495 /nfs/dbraw/zinc/39/14/95/1120391495.db2.gz VIFUTQYPXNLOKB-UHFFFAOYSA-N 1 0 265.784 3.858 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]C2CCC3(CC3)CC2)c1 ZINC000695758566 1120440768 /nfs/dbraw/zinc/44/07/68/1120440768.db2.gz GKDUCEJERXUSMG-GFCCVEGCSA-N 1 0 275.392 3.774 20 10 CHCDRO Cc1cnc(Cl)c(C[NH2+][C@@H](C)c2ccccc2O)c1 ZINC000922328276 1120515415 /nfs/dbraw/zinc/51/54/15/1120515415.db2.gz ALIUWBRUOUSKTC-NSHDSACASA-N 1 0 276.767 3.600 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(C)cc1)c1ccccc1O ZINC000019962601 1120553606 /nfs/dbraw/zinc/55/36/06/1120553606.db2.gz FBRZEGQRBREKRX-MRXNPFEDSA-N 1 0 255.361 3.942 20 10 CHCDRO C=Cn1cc(C[N@@H+](Cc2ccccc2O)C2CCCC2)cn1 ZINC000193932712 1120587269 /nfs/dbraw/zinc/58/72/69/1120587269.db2.gz DZHXINMYEZVCBF-UHFFFAOYSA-N 1 0 297.402 3.634 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+][C@@H]2CC[C@@H](C)[C@@H](C)C2)c1O ZINC000229052315 1120594562 /nfs/dbraw/zinc/59/45/62/1120594562.db2.gz VQVWJFITFULGKA-UHIISALHSA-N 1 0 297.826 3.969 20 10 CHCDRO C[C@@H]1C[C@@H]([NH2+]C/C=C/c2ccc(N(C)C)cc2)CCS1 ZINC000922837244 1120607784 /nfs/dbraw/zinc/60/77/84/1120607784.db2.gz GNPVDTCRZDIJMF-SBAHZNLJSA-N 1 0 290.476 3.640 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CCc2sccc2C1 ZINC000124290576 1120655757 /nfs/dbraw/zinc/65/57/57/1120655757.db2.gz JFPJFMQNNZGRQR-UHFFFAOYSA-N 1 0 279.792 3.665 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCCC23CCOCC3)c1 ZINC000282433103 1120661161 /nfs/dbraw/zinc/66/11/61/1120661161.db2.gz DIFXBECJSGXGDL-YOEHRIQHSA-N 1 0 289.419 3.701 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)Cc1cccs1 ZINC000766027964 1120671212 /nfs/dbraw/zinc/67/12/12/1120671212.db2.gz BSXLFXZIMGKFAR-AWEZNQCLSA-N 1 0 288.460 3.843 20 10 CHCDRO CCC[NH2+][C@@H](C)c1cc(Br)cc(C)c1O ZINC000186903303 1120691057 /nfs/dbraw/zinc/69/10/57/1120691057.db2.gz JVGAMFFDTDPHHF-VIFPVBQESA-N 1 0 272.186 3.524 20 10 CHCDRO CCC[NH2+][C@H](C)c1cc(Br)cc(C)c1O ZINC000186903320 1120691380 /nfs/dbraw/zinc/69/13/80/1120691380.db2.gz JVGAMFFDTDPHHF-SECBINFHSA-N 1 0 272.186 3.524 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCOCC2CCCC2)c1 ZINC000313312622 1120706160 /nfs/dbraw/zinc/70/61/60/1120706160.db2.gz YMAIBXBFDHFVLY-CQSZACIVSA-N 1 0 277.408 3.558 20 10 CHCDRO C[N@H+](CCC1CC1)Cc1cc(C(C)(C)C)cc(O)c1O ZINC000162898980 1120925164 /nfs/dbraw/zinc/92/51/64/1120925164.db2.gz KAJKSUVNDKSEAF-UHFFFAOYSA-N 1 0 277.408 3.627 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCc2ccccc2C)c(O)c1 ZINC000094182845 1120980367 /nfs/dbraw/zinc/98/03/67/1120980367.db2.gz ZOILZAWCGDDQGZ-OAHLLOKOSA-N 1 0 269.388 3.902 20 10 CHCDRO CC[C@@H]1C[C@@H](C)C[N@@H+]1Cc1c(O)cccc1Cl ZINC000399564285 1121039459 /nfs/dbraw/zinc/03/94/59/1121039459.db2.gz HDYNPRYLMMFESM-GHMZBOCLSA-N 1 0 253.773 3.666 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@H]2CCC[C@H]21 ZINC000228172140 1121184122 /nfs/dbraw/zinc/18/41/22/1121184122.db2.gz MTUKZRQVZJZBKJ-BXUZGUMPSA-N 1 0 265.784 3.810 20 10 CHCDRO CC(C)O[C@H]1C[C@@H]([NH2+]Cc2c(O)cccc2Cl)C1(C)C ZINC000766089314 1121208845 /nfs/dbraw/zinc/20/88/45/1121208845.db2.gz QAPKBNUDGCWRSH-CABCVRRESA-N 1 0 297.826 3.727 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](OC)C1CCCC1)c1ccccc1O ZINC000703128691 1121236321 /nfs/dbraw/zinc/23/63/21/1121236321.db2.gz PDWOULSTTKCVPD-WBVHZDCISA-N 1 0 277.408 3.638 20 10 CHCDRO Cc1cccc(C[NH2+][C@H](C)c2ccccc2C)c1O ZINC000124656953 1121310972 /nfs/dbraw/zinc/31/09/72/1121310972.db2.gz NFCJXEPHOAWAHW-CQSZACIVSA-N 1 0 255.361 3.860 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2cccc(C)c2O)cc1 ZINC000124716427 1121316215 /nfs/dbraw/zinc/31/62/15/1121316215.db2.gz LXBYVXCERUISHN-AWEZNQCLSA-N 1 0 255.361 3.860 20 10 CHCDRO Oc1ccc(F)c(Cl)c1C[NH+]1C[C@@H]2CCCC[C@H]2C1 ZINC001237122775 1128979182 /nfs/dbraw/zinc/97/91/82/1128979182.db2.gz YQBWMLCDGHROFS-QWRGUYRKSA-N 1 0 283.774 3.807 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N2CCC(C)CC2)cc1)C1CC1 ZINC000236679958 1121363909 /nfs/dbraw/zinc/36/39/09/1121363909.db2.gz MSGOXTPVIQYVGX-OAHLLOKOSA-N 1 0 272.436 3.811 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2CCCC23CC3)c1 ZINC000707043745 1121449037 /nfs/dbraw/zinc/44/90/37/1121449037.db2.gz PUVYQDSSYBTGGJ-OLZOCXBDSA-N 1 0 275.392 3.632 20 10 CHCDRO COc1cc(Cl)cc(C[NH+]2C3CCCC2CCC3)c1O ZINC000707159405 1121450451 /nfs/dbraw/zinc/45/04/51/1121450451.db2.gz FZHNSRNVOKHNNT-UHFFFAOYSA-N 1 0 295.810 3.961 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CC(C)(C)OC1(C)C)c1ccccc1O ZINC000709662005 1121468731 /nfs/dbraw/zinc/46/87/31/1121468731.db2.gz HGBKLWSGVCRMPH-QWHCGFSZSA-N 1 0 277.408 3.637 20 10 CHCDRO Cc1cccc(C[NH2+]C2(c3ccccc3C)CC2)c1O ZINC000843418301 1121479140 /nfs/dbraw/zinc/47/91/40/1121479140.db2.gz ATNLQSNUBGLVJH-UHFFFAOYSA-N 1 0 267.372 3.788 20 10 CHCDRO Cc1cc(Nc2ccc(C(F)(F)F)cc2O)cc(C)[nH+]1 ZINC001176055542 1121542176 /nfs/dbraw/zinc/54/21/76/1121542176.db2.gz GUURVRVHLXIUEC-UHFFFAOYSA-N 1 0 282.265 3.588 20 10 CHCDRO C[C@H]1CCCC[C@H]1C[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001177575488 1121740369 /nfs/dbraw/zinc/74/03/69/1121740369.db2.gz JNJTYXJXXSBFST-STQMWFEESA-N 1 0 296.405 3.947 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C[C@@H](C)SC)cc1F ZINC001178276442 1121776226 /nfs/dbraw/zinc/77/62/26/1121776226.db2.gz RQVCPVBLTLZPMC-GFCCVEGCSA-N 1 0 284.444 3.513 20 10 CHCDRO CCOCc1cc(C[NH2+][C@@H](C)C2CCC2)ccc1OC ZINC001178425570 1121787699 /nfs/dbraw/zinc/78/76/99/1121787699.db2.gz CMAXMGYAIQPASO-ZDUSSCGKSA-N 1 0 277.408 3.510 20 10 CHCDRO CCN(C)c1ccc(C[N@H+](C)[C@@H](C)C2(C)CC2)cc1 ZINC000773766756 1121807999 /nfs/dbraw/zinc/80/79/99/1121807999.db2.gz VHPIIYCYRCELOW-AWEZNQCLSA-N 1 0 260.425 3.763 20 10 CHCDRO CN(C)c1cc(F)c(C[NH2+][C@H]2CC3CCC2CC3)cc1F ZINC001178782401 1121815683 /nfs/dbraw/zinc/81/56/83/1121815683.db2.gz GEUOFLVQVQRDQO-PPUFBPAQSA-N 1 0 294.389 3.699 20 10 CHCDRO C[C@@H]1CCCC[C@@]1(C)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC001178868734 1121824972 /nfs/dbraw/zinc/82/49/72/1121824972.db2.gz UZPDSNZBLPFBFV-CXAGYDPISA-N 1 0 278.415 3.950 20 10 CHCDRO Cc1ccc(CC[NH2+]Cc2ccc3c(c2)CCCO3)cc1C ZINC001179110308 1121852009 /nfs/dbraw/zinc/85/20/09/1121852009.db2.gz GXEHGDAKPYSOOF-UHFFFAOYSA-N 1 0 295.426 3.961 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CCc2ccoc2)cc1F ZINC001179165302 1121855450 /nfs/dbraw/zinc/85/54/50/1121855450.db2.gz PAXRIYAEMDJLQM-UHFFFAOYSA-N 1 0 290.382 3.597 20 10 CHCDRO COc1ccc2c(c1)C[C@H]([NH2+][C@H](C)c1ccccc1O)CC2 ZINC001179489519 1121882788 /nfs/dbraw/zinc/88/27/88/1121882788.db2.gz RTBHRJYTXZZDMD-CZUORRHYSA-N 1 0 297.398 3.609 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@H+]1CCC[C@H](C)[C@H]1C ZINC001179858350 1121917098 /nfs/dbraw/zinc/91/70/98/1121917098.db2.gz DBJLRRYTVWTFNH-DZGCQCFKSA-N 1 0 260.425 3.681 20 10 CHCDRO CC(C)[C@](C)(O)C[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000732818175 1121939172 /nfs/dbraw/zinc/93/91/72/1121939172.db2.gz ZKVXUEDWBTXQTM-LJQANCHMSA-N 1 0 299.414 3.556 20 10 CHCDRO Cc1ccc(C[N@H+](C2CC2)C2CCCCC2)c(O)c1 ZINC001180064219 1121945487 /nfs/dbraw/zinc/94/54/87/1121945487.db2.gz DASWVQHSHBMDRV-UHFFFAOYSA-N 1 0 259.393 3.998 20 10 CHCDRO CCOC[C@@H]1CCC[N@H+](Cc2cc(C(C)C)ccc2O)C1 ZINC001180235073 1121967829 /nfs/dbraw/zinc/96/78/29/1121967829.db2.gz VALCMSUQWNKIJK-OAHLLOKOSA-N 1 0 291.435 3.764 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CC[C@H](C(C)(C)C)C1 ZINC001180317491 1121973795 /nfs/dbraw/zinc/97/37/95/1121973795.db2.gz GZHLBNIXTDVKPR-INIZCTEOSA-N 1 0 274.452 3.929 20 10 CHCDRO C[C@@H]1CCC[C@H]([NH2+]Cc2ccc(N(C)C)c(F)c2)C1 ZINC000733323966 1121975756 /nfs/dbraw/zinc/97/57/56/1121975756.db2.gz BDBCWFFPHJTDDH-OCCSQVGLSA-N 1 0 264.388 3.560 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C(C)(C)c2ccccc2)cc1F ZINC000733325521 1121976004 /nfs/dbraw/zinc/97/60/04/1121976004.db2.gz IMQYWCSZUXMBOR-UHFFFAOYSA-N 1 0 286.394 3.917 20 10 CHCDRO Oc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)c(O)c1 ZINC001204277265 1122008496 /nfs/dbraw/zinc/00/84/96/1122008496.db2.gz XMLXTRAEDYJVPL-MRXNPFEDSA-N 1 0 287.334 3.574 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC001181861542 1122087535 /nfs/dbraw/zinc/08/75/35/1122087535.db2.gz VPPQNHVKFVTVBW-CALCHBBNSA-N 1 0 272.436 3.683 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]C2CCC(F)(F)CC2)c1 ZINC000688525563 1129032044 /nfs/dbraw/zinc/03/20/44/1129032044.db2.gz WBOKDKJDQGCASK-JTQLQIEISA-N 1 0 285.334 3.629 20 10 CHCDRO CC[N@H+](Cc1occc1C)Cc1c(C)cc(OC)cc1O ZINC001182424608 1122151885 /nfs/dbraw/zinc/15/18/85/1122151885.db2.gz VKEOWMKAYWAJLH-UHFFFAOYSA-N 1 0 289.375 3.633 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1[O-])C(C)(C)O ZINC000774284335 1122153395 /nfs/dbraw/zinc/15/33/95/1122153395.db2.gz FDUOHGNAMGTGBI-JGVFFNPUSA-N 1 0 292.206 3.509 20 10 CHCDRO CCc1cccc(C[NH2+]Cc2c(C)cc(OC)cc2O)c1 ZINC001182684126 1122182620 /nfs/dbraw/zinc/18/26/20/1122182620.db2.gz KENSIIJGNLEBGN-UHFFFAOYSA-N 1 0 285.387 3.561 20 10 CHCDRO [O-]c1cc(Cl)ccc1C[NH2+]CC1CCC(F)CC1 ZINC001182704958 1122183676 /nfs/dbraw/zinc/18/36/76/1122183676.db2.gz RYRRORFWZXFCJX-UHFFFAOYSA-N 1 0 271.763 3.664 20 10 CHCDRO CC(C)c1ccc(O)c(C[N@@H+]2CC[C@@]3(C2)CCCOC3)c1 ZINC001182872881 1122192589 /nfs/dbraw/zinc/19/25/89/1122192589.db2.gz HDXIJBIUUJLREI-GOSISDBHSA-N 1 0 289.419 3.518 20 10 CHCDRO CC[C@@H]1[C@@H](C)CC[N@@H+]1Cc1cc2c(cc1O)CCC2 ZINC000774618485 1122218457 /nfs/dbraw/zinc/21/84/57/1122218457.db2.gz LNRUGYBZQLRVPI-BLLLJJGKSA-N 1 0 259.393 3.501 20 10 CHCDRO C[C@H]([NH2+]CC[C@@H]1CCO[C@H](C)C1)c1ccc(N(C)C)cc1 ZINC000273294379 1122226618 /nfs/dbraw/zinc/22/66/18/1122226618.db2.gz SSKCERQIVACCIY-OWCLPIDISA-N 1 0 290.451 3.608 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCc2ccccc2O)c(O)c1C ZINC000273361094 1122230629 /nfs/dbraw/zinc/23/06/29/1122230629.db2.gz AKUBIIUIMCBRHS-CQSZACIVSA-N 1 0 285.387 3.608 20 10 CHCDRO Cc1ccn2cc(C[NH2+][C@@H](C)c3cc(C)ccc3O)nc2c1 ZINC000273366822 1122230845 /nfs/dbraw/zinc/23/08/45/1122230845.db2.gz BRJQXQNQICYWSW-AWEZNQCLSA-N 1 0 295.386 3.508 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC[C@H]2CCO[C@H](C)C2)c(O)c1C ZINC000273402682 1122231735 /nfs/dbraw/zinc/23/17/35/1122231735.db2.gz GQAHHJTYNIYUKP-KBMXLJTQSA-N 1 0 291.435 3.865 20 10 CHCDRO CCOCCC1(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)CC1 ZINC000273449256 1122234465 /nfs/dbraw/zinc/23/44/65/1122234465.db2.gz FRENWAUBRKHOFL-OAHLLOKOSA-N 1 0 291.435 3.866 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](C)c2nccs2)c(O)c1C ZINC000273471418 1122235011 /nfs/dbraw/zinc/23/50/11/1122235011.db2.gz SAYTWTQZCZBJED-DGCLKSJQSA-N 1 0 290.432 3.920 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C2CCSCC2)c(O)c1C ZINC000273528079 1122237662 /nfs/dbraw/zinc/23/76/62/1122237662.db2.gz VRJNCLWRZIXDMW-GFCCVEGCSA-N 1 0 265.422 3.555 20 10 CHCDRO CCC1(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)CCOCC1 ZINC000273552640 1122238864 /nfs/dbraw/zinc/23/88/64/1122238864.db2.gz GFJVLWAYAQZOTO-HNNXBMFYSA-N 1 0 291.435 3.866 20 10 CHCDRO CCC1(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)CCOCC1 ZINC000273552645 1122238957 /nfs/dbraw/zinc/23/89/57/1122238957.db2.gz GFJVLWAYAQZOTO-OAHLLOKOSA-N 1 0 291.435 3.866 20 10 CHCDRO Cc1ncc(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)s1 ZINC000273563802 1122238963 /nfs/dbraw/zinc/23/89/63/1122238963.db2.gz IUKTVUGQFOVGGE-QMMMGPOBSA-N 1 0 282.796 3.661 20 10 CHCDRO Cc1ccc(C[N@@H+]2CCO[C@@H](c3ccccc3)CC2)c(O)c1 ZINC001184351655 1122272752 /nfs/dbraw/zinc/27/27/52/1122272752.db2.gz RIWXNDVSDIRZJI-LJQANCHMSA-N 1 0 297.398 3.664 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc(F)ccc1OC)c1ccccc1O ZINC000183331091 1129045365 /nfs/dbraw/zinc/04/53/65/1129045365.db2.gz LCFWQVUSXNLTNU-OAHLLOKOSA-N 1 0 289.350 3.781 20 10 CHCDRO C[C@H]1CCC[C@H]1[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000071205985 1129045911 /nfs/dbraw/zinc/04/59/11/1129045911.db2.gz JOMHWVSPUWTPTI-MAUKXSAKSA-N 1 0 272.436 3.955 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCC[C@@H]2C)cc1 ZINC000071205990 1129045920 /nfs/dbraw/zinc/04/59/20/1129045920.db2.gz ILMJYGSBMUZUDR-WMLDXEAASA-N 1 0 260.425 3.811 20 10 CHCDRO CC1(C)CCC([NH2+]Cc2ccc3c(c2)CCO3)CC1 ZINC000079676509 1129048482 /nfs/dbraw/zinc/04/84/82/1129048482.db2.gz VAVGFSVATMSKEB-UHFFFAOYSA-N 1 0 259.393 3.680 20 10 CHCDRO CCc1ccccc1C[NH2+]Cc1cc(C)cc(OC)c1O ZINC000894300463 1122400372 /nfs/dbraw/zinc/40/03/72/1122400372.db2.gz UMJZGOUNBFMLOJ-UHFFFAOYSA-N 1 0 285.387 3.561 20 10 CHCDRO C[C@H]([NH2+]Cc1cccc(F)c1F)c1ccccc1O ZINC000775130824 1122432659 /nfs/dbraw/zinc/43/26/59/1122432659.db2.gz PGDCETMGKZWJGH-JTQLQIEISA-N 1 0 263.287 3.521 20 10 CHCDRO Cc1cc(C)cc(OCC[NH2+][C@H](C)c2ccccc2O)c1 ZINC000775136620 1122437353 /nfs/dbraw/zinc/43/73/53/1122437353.db2.gz LZGLYODUGQNHOA-OAHLLOKOSA-N 1 0 285.387 3.739 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)C1Cc2ccccc2C1 ZINC000775140690 1122439172 /nfs/dbraw/zinc/43/91/72/1122439172.db2.gz QEYIBLOKBSQQAJ-UHFFFAOYSA-N 1 0 280.415 3.529 20 10 CHCDRO COc1cccc(O)c1C[N@H+](C)Cc1cc(C)cc(C)c1 ZINC000775152741 1122446029 /nfs/dbraw/zinc/44/60/29/1122446029.db2.gz RWZUYLLNECCRJI-UHFFFAOYSA-N 1 0 285.387 3.650 20 10 CHCDRO Cc1ccc([C@H](C[NH2+][C@@H](C)c2ccccc2O)N(C)C)cc1 ZINC000183467995 1129056854 /nfs/dbraw/zinc/05/68/54/1129056854.db2.gz AVRFXKXFWHGBBT-YJBOKZPZSA-N 1 0 298.430 3.654 20 10 CHCDRO C[C@H](C[NH2+][C@@H](C)c1ccccc1O)N(C)Cc1ccccc1 ZINC000183506609 1129058417 /nfs/dbraw/zinc/05/84/17/1129058417.db2.gz JRMVWLVLLHTXJL-CVEARBPZSA-N 1 0 298.430 3.563 20 10 CHCDRO COc1ccc(C[NH2+]C2(Cc3ccccc3)CC2)cc1C ZINC000775325145 1122516687 /nfs/dbraw/zinc/51/66/87/1122516687.db2.gz NQFNWAYAWMIPFR-UHFFFAOYSA-N 1 0 281.399 3.869 20 10 CHCDRO CCc1ccc(CC[NH2+][C@H](C)c2cc(OC)ccc2O)cc1 ZINC000775363455 1122528655 /nfs/dbraw/zinc/52/86/55/1122528655.db2.gz LHYIUQXKUCSWGW-CQSZACIVSA-N 1 0 299.414 3.857 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CCCO[C@H]2CC(C)C)cc1C ZINC000775367609 1122530253 /nfs/dbraw/zinc/53/02/53/1122530253.db2.gz ALYMGDVCLPANHC-AEFFLSMTSA-N 1 0 291.435 3.687 20 10 CHCDRO C[C@@H]([NH2+]CC1(c2cccc(F)c2)CC1)c1ccccc1O ZINC000183523987 1129060814 /nfs/dbraw/zinc/06/08/14/1129060814.db2.gz AAVPGDMJVIOQGA-CYBMUJFWSA-N 1 0 285.362 3.914 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H](C)Cc1cccs1)c1ccccc1O ZINC000183531637 1129061557 /nfs/dbraw/zinc/06/15/57/1129061557.db2.gz ISXQVXIEVWROQI-QWHCGFSZSA-N 1 0 275.417 3.983 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CC)CSC)c1ccc(N(C)C)cc1 ZINC000775424704 1122562405 /nfs/dbraw/zinc/56/24/05/1122562405.db2.gz XLJHFXUZIICTRV-GOEBONIOSA-N 1 0 280.481 3.935 20 10 CHCDRO CC[C@@H]1C[C@H](C)C[N@@H+]1Cc1ccc(N(C)CC)cc1 ZINC001191232477 1122586662 /nfs/dbraw/zinc/58/66/62/1122586662.db2.gz IAEMVYMARYNBJA-GOEBONIOSA-N 1 0 260.425 3.763 20 10 CHCDRO CC[C@@H]([NH2+]CC1(C)CC1)c1cc(Cl)ccc1O ZINC000775524480 1122642877 /nfs/dbraw/zinc/64/28/77/1122642877.db2.gz ADWQQADKAZWSPO-GFCCVEGCSA-N 1 0 253.773 3.886 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1CCCN1CC)c1cc(Cl)ccc1O ZINC000775482812 1122615157 /nfs/dbraw/zinc/61/51/57/1122615157.db2.gz CCIOFTJAYDIHGF-DZGCQCFKSA-N 1 0 296.842 3.571 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCCN1CC)c1cc(Cl)ccc1O ZINC000775482813 1122615707 /nfs/dbraw/zinc/61/57/07/1122615707.db2.gz CCIOFTJAYDIHGF-HIFRSBDPSA-N 1 0 296.842 3.571 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)C1CC1)c1cc(Cl)ccc1O ZINC000775485393 1122616731 /nfs/dbraw/zinc/61/67/31/1122616731.db2.gz SPNNFWLIYVTGIG-ZANVPECISA-N 1 0 253.773 3.885 20 10 CHCDRO CC[C@@H]([NH2+]CCCC(C)(C)CO)c1cc(Cl)ccc1O ZINC000775508604 1122630003 /nfs/dbraw/zinc/63/00/03/1122630003.db2.gz DJKUZILHXYLRAV-CQSZACIVSA-N 1 0 299.842 3.885 20 10 CHCDRO CC[C@@H]([NH2+]CCN1CCCC[C@@H]1CC)c1ccccc1O ZINC000775504088 1122630864 /nfs/dbraw/zinc/63/08/64/1122630864.db2.gz SCHKSXLEZPJRMR-DOTOQJQBSA-N 1 0 290.451 3.697 20 10 CHCDRO Cc1cc(C[N@H+]2CC[C@H](C)[C@H](C)C2)ccc1N(C)C ZINC001192261693 1122636581 /nfs/dbraw/zinc/63/65/81/1122636581.db2.gz FYJMTLGRARWPNT-DZGCQCFKSA-N 1 0 260.425 3.539 20 10 CHCDRO CC[C@@H]([NH2+]CC(CC)(CC)CO)c1cc(Cl)ccc1O ZINC000775523533 1122640916 /nfs/dbraw/zinc/64/09/16/1122640916.db2.gz JVUZGHLXFZIQHP-CQSZACIVSA-N 1 0 299.842 3.885 20 10 CHCDRO CC[C@H](O)CCC[NH2+][C@@H](CC)c1cc(Cl)ccc1O ZINC000775524927 1122641882 /nfs/dbraw/zinc/64/18/82/1122641882.db2.gz CTXHIXYCCDHGLL-JSGCOSHPSA-N 1 0 285.815 3.637 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cncc(C)c1)c1cc(Cl)ccc1O ZINC000775526372 1122643733 /nfs/dbraw/zinc/64/37/33/1122643733.db2.gz RSAUMYUFLBFTMD-OAHLLOKOSA-N 1 0 290.794 3.990 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCSC1)c1cc(Cl)ccc1O ZINC000775527348 1122644739 /nfs/dbraw/zinc/64/47/39/1122644739.db2.gz QZLQYHFIEGCUBD-JQWIXIFHSA-N 1 0 271.813 3.592 20 10 CHCDRO CC[C@H]1CC[C@@H](C)[N@@H+]1Cc1ccc(N(C)CC)cc1 ZINC001192645542 1122655020 /nfs/dbraw/zinc/65/50/20/1122655020.db2.gz OJSPZLDCYYXLOD-ZBFHGGJFSA-N 1 0 260.425 3.906 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1nc(C)cs1)c1ccccc1O ZINC000080274520 1129080108 /nfs/dbraw/zinc/08/01/08/1129080108.db2.gz KQAWFOGNMUGMMF-DGCLKSJQSA-N 1 0 276.405 3.959 20 10 CHCDRO Cc1csc([C@H](C)[NH2+][C@@H](C)c2ccc(N(C)C)cc2)n1 ZINC000080272821 1129080146 /nfs/dbraw/zinc/08/01/46/1129080146.db2.gz DDHUNIYPNQKNLI-STQMWFEESA-N 1 0 289.448 3.929 20 10 CHCDRO C[N@H+](Cc1cccc(O)c1)Cc1cc(Cl)cc(F)c1[O-] ZINC000775633832 1122839311 /nfs/dbraw/zinc/83/93/11/1122839311.db2.gz LVJLIGSXOSCQPP-UHFFFAOYSA-N 1 0 295.741 3.522 20 10 CHCDRO CC[C@@H](CC(F)(F)F)[NH2+]Cc1cc(C)cc(OC)c1O ZINC000894468222 1122859567 /nfs/dbraw/zinc/85/95/67/1122859567.db2.gz QYQTVSLNEKABJT-NSHDSACASA-N 1 0 291.313 3.530 20 10 CHCDRO CC[C@H](CC(F)(F)F)[NH2+]Cc1cc(C)cc(OC)c1O ZINC000894468221 1122859737 /nfs/dbraw/zinc/85/97/37/1122859737.db2.gz QYQTVSLNEKABJT-LLVKDONJSA-N 1 0 291.313 3.530 20 10 CHCDRO CCCSC[C@H](C)[NH2+][C@@H](C)c1cc(OC)ccc1O ZINC000894502278 1122865150 /nfs/dbraw/zinc/86/51/50/1122865150.db2.gz OUFAWNWNRUVGGR-RYUDHWBXSA-N 1 0 283.437 3.583 20 10 CHCDRO C[N@H+](CCc1ccccc1F)Cc1cccc(Cl)c1[O-] ZINC000775663544 1122875149 /nfs/dbraw/zinc/87/51/49/1122875149.db2.gz MUZGGBJMOMKEFF-UHFFFAOYSA-N 1 0 293.769 3.859 20 10 CHCDRO Cc1cccc(C[N@H+]2CC[C@@H](c3ccccc3C)C2)c1O ZINC000775670798 1122889401 /nfs/dbraw/zinc/88/94/01/1122889401.db2.gz OBMIBBGJROGBFZ-MRXNPFEDSA-N 1 0 281.399 3.999 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)CCC=C(C)C)c(O)c1OC ZINC000894692579 1122893710 /nfs/dbraw/zinc/89/37/10/1122893710.db2.gz WFXNCDYJMRIPLR-ZDUSSCGKSA-N 1 0 293.407 3.634 20 10 CHCDRO COc1ccc2c(c1)CCC[N@@H+](Cc1cccc(C)c1O)C2 ZINC000775678453 1122900946 /nfs/dbraw/zinc/90/09/46/1122900946.db2.gz ZOKKNJPHJOAQAW-UHFFFAOYSA-N 1 0 297.398 3.658 20 10 CHCDRO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1cc(OC)ccc1O ZINC000775698650 1122911663 /nfs/dbraw/zinc/91/16/63/1122911663.db2.gz QANLWFXKDNHVPO-GOSISDBHSA-N 1 0 297.398 3.910 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCCC23CCCCC3)c1O ZINC000775725491 1122926337 /nfs/dbraw/zinc/92/63/37/1122926337.db2.gz MKPITNXNQHZHSL-UHFFFAOYSA-N 1 0 259.393 3.999 20 10 CHCDRO CCC[C@H](C)[C@@H]1CCC[N@@H+]1Cc1cc(OC)ccc1O ZINC000775732052 1122928541 /nfs/dbraw/zinc/92/85/41/1122928541.db2.gz LORGETNJVBQSEM-BBRMVZONSA-N 1 0 277.408 3.801 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+]Cc2ccc(Cl)o2)c1O ZINC000775775472 1122957660 /nfs/dbraw/zinc/95/76/60/1122957660.db2.gz YATQJVMIIWWVMW-UHFFFAOYSA-N 1 0 286.158 3.890 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2ccc(N(C)C)cc2)Cc2ccccc21 ZINC001197552640 1122960242 /nfs/dbraw/zinc/96/02/42/1122960242.db2.gz LPVJAHPLSPWLPM-OAHLLOKOSA-N 1 0 280.415 3.872 20 10 CHCDRO [O-]c1c(F)cc(Cl)cc1C[NH2+]CCc1ccccc1 ZINC000775791212 1122970563 /nfs/dbraw/zinc/97/05/63/1122970563.db2.gz FNBLDZCLSHNSMA-UHFFFAOYSA-N 1 0 279.742 3.517 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2cc(C)cc(C)c2O)cc1 ZINC000216024266 1123021978 /nfs/dbraw/zinc/02/19/78/1123021978.db2.gz BOODFMRWYVGTRJ-UHFFFAOYSA-N 1 0 269.388 3.949 20 10 CHCDRO C[C@@H]1[C@@H](C(F)(F)F)CCC[N@@H+]1Cc1cc(F)ccc1O ZINC000776012511 1123036271 /nfs/dbraw/zinc/03/62/71/1123036271.db2.gz HFNQRRYJXWAIKQ-SKDRFNHKSA-N 1 0 291.288 3.694 20 10 CHCDRO CCC(C)(C)[NH2+]Cc1cc(OC)cc(C(C)(C)C)c1O ZINC001199916726 1123046088 /nfs/dbraw/zinc/04/60/88/1123046088.db2.gz JQMBPEPPTNPGPM-UHFFFAOYSA-N 1 0 279.424 3.977 20 10 CHCDRO COc1ccc(O)c(C[NH2+]C[C@H](C)C2CCCCC2)c1 ZINC000776078261 1123053030 /nfs/dbraw/zinc/05/30/30/1123053030.db2.gz VVXRGDWKBSCKDV-ZDUSSCGKSA-N 1 0 277.408 3.707 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)CC2CCCCC2)cc1 ZINC001201401646 1123092596 /nfs/dbraw/zinc/09/25/96/1123092596.db2.gz OQKXLHZQWJUXTK-UHFFFAOYSA-N 1 0 260.425 3.765 20 10 CHCDRO CCCC1(C[NH2+]Cc2ccc(N(C)C)c(F)c2)CC1 ZINC001201380973 1123094886 /nfs/dbraw/zinc/09/48/86/1123094886.db2.gz YIQVUYSMNJUQBP-UHFFFAOYSA-N 1 0 264.388 3.562 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H]2CC[C@H]3CCC[C@H]3C2)c1O ZINC000776174879 1123101646 /nfs/dbraw/zinc/10/16/46/1123101646.db2.gz IMUAJWNGRJYPNX-IJEWVQPXSA-N 1 0 259.393 3.759 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H]2CCCc3ccc(O)cc32)cc1 ZINC000284064535 1123145711 /nfs/dbraw/zinc/14/57/11/1123145711.db2.gz LALJAZUUMSPHBA-IBGZPJMESA-N 1 0 296.414 3.625 20 10 CHCDRO CCCOc1ccc(C[NH2+]C(CC)(CC)CCO)cc1C ZINC001202126213 1123177232 /nfs/dbraw/zinc/17/72/32/1123177232.db2.gz GWUTULQYSNGEOV-UHFFFAOYSA-N 1 0 293.451 3.815 20 10 CHCDRO CC(C)CSCCC[NH2+]Cc1c(O)cccc1Cl ZINC000776252585 1123179518 /nfs/dbraw/zinc/17/95/18/1123179518.db2.gz MFLZPNJTRUDZKH-UHFFFAOYSA-N 1 0 287.856 3.915 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]C[C@@H]1[C@@H]2Cc3ccccc3[C@H]12 ZINC000776248272 1123182023 /nfs/dbraw/zinc/18/20/23/1123182023.db2.gz LLZHBZZPIANBRJ-IYOUNJFTSA-N 1 0 299.801 3.721 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]Cc1c(F)cccc1F ZINC000776249207 1123183932 /nfs/dbraw/zinc/18/39/32/1123183932.db2.gz UKCJARCQPWEOCS-UHFFFAOYSA-N 1 0 283.705 3.614 20 10 CHCDRO Cc1cc(C[N@H+]2CC[C@H]2C)c(C)n1-c1ccccc1 ZINC001137853996 1123214043 /nfs/dbraw/zinc/21/40/43/1123214043.db2.gz DNKYANOPJAMAHZ-CYBMUJFWSA-N 1 0 254.377 3.688 20 10 CHCDRO COC[C@@H]1CCCC[N@H+](Cc2cc(Cl)c(C)cc2O)C1 ZINC000825536685 1123221417 /nfs/dbraw/zinc/22/14/17/1123221417.db2.gz LHYYMPVRSDDNLB-CYBMUJFWSA-N 1 0 297.826 3.603 20 10 CHCDRO COc1cc(C[NH2+]Cc2ccccc2)c(O)c(C(C)(C)C)c1 ZINC000850006900 1123236849 /nfs/dbraw/zinc/23/68/49/1123236849.db2.gz FGXMUDZRYYRPNW-UHFFFAOYSA-N 1 0 299.414 3.988 20 10 CHCDRO CC[C@@H]([NH2+]C1CC2(C1)COC(C)(C)C2)c1ccccc1O ZINC000895134423 1123248671 /nfs/dbraw/zinc/24/86/71/1123248671.db2.gz XNQDEZTWUNOWQG-NSWWBONSSA-N 1 0 289.419 3.781 20 10 CHCDRO CSCC1(CC[NH2+]Cc2c(O)cc(C)cc2Cl)CC1 ZINC000850355222 1123255676 /nfs/dbraw/zinc/25/56/76/1123255676.db2.gz BESIBZACGPKMAL-UHFFFAOYSA-N 1 0 299.867 3.977 20 10 CHCDRO C[C@]1(CC[NH2+]Cc2c(O)cccc2Cl)CC1(F)F ZINC000850380121 1123260462 /nfs/dbraw/zinc/26/04/62/1123260462.db2.gz BWTDZSFDSVPNIQ-LBPRGKRZSA-N 1 0 275.726 3.571 20 10 CHCDRO c1cc(N2CCCCC2)ccc1C[NH2+][C@@H]1[C@@H]2CCC[C@@H]21 ZINC000850392969 1123261724 /nfs/dbraw/zinc/26/17/24/1123261724.db2.gz OYGMLYPEKYRLHV-BCDXTJNWSA-N 1 0 270.420 3.565 20 10 CHCDRO CCSC1(C[NH2+]C/C=C/c2ccc(N(C)C)cc2)CC1 ZINC000850394302 1123261780 /nfs/dbraw/zinc/26/17/80/1123261780.db2.gz PFLJRYPSZCSRRD-AATRIKPKSA-N 1 0 290.476 3.641 20 10 CHCDRO CC(C)(C)O[C@@H]1C[C@H]([NH2+]Cc2ccccc2O)C12CCC2 ZINC000850388243 1123262028 /nfs/dbraw/zinc/26/20/28/1123262028.db2.gz KDEZOSHSZHXXNP-JKSUJKDBSA-N 1 0 289.419 3.608 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H](c2ccccc2)[C@H](O)C(C)C)c1 ZINC000850395050 1123262131 /nfs/dbraw/zinc/26/21/31/1123262131.db2.gz MTECGXCTJXCZSI-RBUKOAKNSA-N 1 0 299.414 3.548 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H](c2ccccc2)[C@@H](O)C(C)C)c1 ZINC000850395048 1123262180 /nfs/dbraw/zinc/26/21/80/1123262180.db2.gz MTECGXCTJXCZSI-MOPGFXCFSA-N 1 0 299.414 3.548 20 10 CHCDRO CC[C@H](COCC1CC1)[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000850492256 1123274541 /nfs/dbraw/zinc/27/45/41/1123274541.db2.gz CFCMKAQSEYPUDQ-SMDDNHRTSA-N 1 0 297.826 3.901 20 10 CHCDRO CC[C@@H](COCC1CC1)[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000850495265 1123274920 /nfs/dbraw/zinc/27/49/20/1123274920.db2.gz ZFHCHTHGKRBXLY-FZMZJTMJSA-N 1 0 297.826 3.901 20 10 CHCDRO CCC(O)(CC)C(C)(C)C[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000850501752 1123275371 /nfs/dbraw/zinc/27/53/71/1123275371.db2.gz OYMNAUODYDUILN-LBPRGKRZSA-N 1 0 297.414 3.759 20 10 CHCDRO CSCC1(CC[NH2+][C@@H](C)c2cc(F)ccc2O)CC1 ZINC000850505903 1123276367 /nfs/dbraw/zinc/27/63/67/1123276367.db2.gz CQDWDULTTQGCGC-NSHDSACASA-N 1 0 283.412 3.715 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H]2COC3(CCC3)C2)c1O ZINC000850523803 1123279930 /nfs/dbraw/zinc/27/99/30/1123279930.db2.gz POSWUSCFRWMVEB-DGCLKSJQSA-N 1 0 295.810 3.716 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1C[C@@H](O)c2ccccc21)c1ccccc1O ZINC000850530243 1123284813 /nfs/dbraw/zinc/28/48/13/1123284813.db2.gz XTTKWQMIMRVCPM-LZLYRXPVSA-N 1 0 283.371 3.611 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@]2(C)CC2(F)F)cc1 ZINC000850535376 1123286760 /nfs/dbraw/zinc/28/67/60/1123286760.db2.gz VSJOXUNQSPWIQD-DOMZBBRYSA-N 1 0 282.378 3.839 20 10 CHCDRO CC[C@@H]([NH2+]CC[C@@]1(C)CC1(F)F)c1ccccc1O ZINC000850536002 1123286844 /nfs/dbraw/zinc/28/68/44/1123286844.db2.gz GNKSCTXIHZZZAC-OCCSQVGLSA-N 1 0 269.335 3.868 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@]2(C)CC2(F)F)c(O)c1C ZINC000850538010 1123288194 /nfs/dbraw/zinc/28/81/94/1123288194.db2.gz ZYGOZQLISMGWJG-RISCZKNCSA-N 1 0 269.335 3.705 20 10 CHCDRO C[C@@H]([NH2+]C[C@@]1(C)CC1(F)F)c1cc(Cl)ccc1O ZINC000850537326 1123288207 /nfs/dbraw/zinc/28/82/07/1123288207.db2.gz TUQDCHFCEXEFOX-PRHODGIISA-N 1 0 275.726 3.742 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H](CO)CC1CC1)c1ccc2ccccc2c1O ZINC000850544939 1123289121 /nfs/dbraw/zinc/28/91/21/1123289121.db2.gz KRSZEYYESRKFOK-HIFRSBDPSA-N 1 0 299.414 3.605 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2C(C)(C)C2(F)F)c(O)c1 ZINC000850553587 1123289908 /nfs/dbraw/zinc/28/99/08/1123289908.db2.gz ZEXGILRLJMNFKZ-MFKMUULPSA-N 1 0 269.335 3.643 20 10 CHCDRO CC[C@H]([NH2+]CC1SCCS1)c1ccc(C)cc1O ZINC000850559995 1123291835 /nfs/dbraw/zinc/29/18/35/1123291835.db2.gz HUCVBTZZDBLEBR-LBPRGKRZSA-N 1 0 283.462 3.547 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCCc2ccco2)c1 ZINC000850569684 1123294052 /nfs/dbraw/zinc/29/40/52/1123294052.db2.gz MKJWVCCGHFOULI-CYBMUJFWSA-N 1 0 259.349 3.577 20 10 CHCDRO CO[C@H](C[NH2+][C@H]1CCc2cccc(O)c21)C1CCCCC1 ZINC000850569595 1123294308 /nfs/dbraw/zinc/29/43/08/1123294308.db2.gz KADRQYCTMDRBRO-DOTOQJQBSA-N 1 0 289.419 3.564 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccc2ccccc2c1O)c1nccn1C ZINC000850572941 1123295554 /nfs/dbraw/zinc/29/55/54/1123295554.db2.gz QTBFZWFSMINOIX-QWHCGFSZSA-N 1 0 295.386 3.691 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H](c2ccccc2)[C@@H](C)O)c(O)c1C ZINC000850585150 1123296268 /nfs/dbraw/zinc/29/62/68/1123296268.db2.gz VZHLGAICSDPFML-DAYGRLMNSA-N 1 0 299.414 3.782 20 10 CHCDRO COc1cccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)c1C ZINC000850579106 1123296605 /nfs/dbraw/zinc/29/66/05/1123296605.db2.gz RVLAQTAZWKEJJV-OAHLLOKOSA-N 1 0 298.430 3.920 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)[C@@H]2CCO[C@H](C)C2)cc1 ZINC000851716689 1123373646 /nfs/dbraw/zinc/37/36/46/1123373646.db2.gz PQPRKLPLTKJEJB-CRAIPNDOSA-N 1 0 290.451 3.532 20 10 CHCDRO CCCCN1CCCC[C@@H]1C[NH2+][C@@H](C)c1ccccc1O ZINC000783509875 1123401144 /nfs/dbraw/zinc/40/11/44/1123401144.db2.gz VHMLXFCEYFXTER-JKSUJKDBSA-N 1 0 290.451 3.697 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC2(O)CCC(C)CC2)c(O)c1C ZINC000853238989 1123429335 /nfs/dbraw/zinc/42/93/35/1123429335.db2.gz XESINYXRGDFBMC-KVIBHRHWSA-N 1 0 291.435 3.601 20 10 CHCDRO C[C@@H]([NH2+]Cc1cnccc1C(F)(F)F)c1ccccc1O ZINC000853242737 1123429918 /nfs/dbraw/zinc/42/99/18/1123429918.db2.gz RRQQRVWKIOKQLD-SNVBAGLBSA-N 1 0 296.292 3.657 20 10 CHCDRO CC(C)(CCc1ccccc1)[NH2+]Cc1ccccc1O ZINC000111387431 1123442500 /nfs/dbraw/zinc/44/25/00/1123442500.db2.gz BTSGVXLGPWWZMF-UHFFFAOYSA-N 1 0 269.388 3.893 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+][C@@H]2CCc3cc(N)ccc32)c(O)c1 ZINC000854225905 1123477917 /nfs/dbraw/zinc/47/79/17/1123477917.db2.gz HBFKKXVKAZYMFQ-CXAGYDPISA-N 1 0 296.414 3.929 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCc3cc(N)ccc32)c(O)c1 ZINC000854226894 1123478178 /nfs/dbraw/zinc/47/81/78/1123478178.db2.gz SBDJWBSGYQDJMN-YVEFUNNKSA-N 1 0 282.387 3.621 20 10 CHCDRO Oc1c(C[NH2+]C[C@H]2CC3(CCC3)CO2)ccc2ccccc21 ZINC000895790777 1123514613 /nfs/dbraw/zinc/51/46/13/1123514613.db2.gz LPXLDCAIFIEBJP-MRXNPFEDSA-N 1 0 297.398 3.594 20 10 CHCDRO Cc1nn(C(C)C)c(C)c1C[NH2+][C@@H](C)c1ccccc1O ZINC000895852142 1123522901 /nfs/dbraw/zinc/52/29/01/1123522901.db2.gz PURQQHKAKYGPCC-LBPRGKRZSA-N 1 0 287.407 3.637 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](C)C2(C)CC2)cc1 ZINC000776882970 1123558910 /nfs/dbraw/zinc/55/89/10/1123558910.db2.gz LJBILOKLEJJSST-KGLIPLIRSA-N 1 0 260.425 3.982 20 10 CHCDRO Cc1cc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)ccn1 ZINC000856722361 1123566289 /nfs/dbraw/zinc/56/62/89/1123566289.db2.gz WBHSPRVSYLUMEQ-UHFFFAOYSA-N 1 0 297.446 3.867 20 10 CHCDRO COc1ccc(C[NH2+]CC[C@H]2CC2(Cl)Cl)cc1C ZINC000856806808 1123569567 /nfs/dbraw/zinc/56/95/67/1123569567.db2.gz IUUALABODIIXDC-LBPRGKRZSA-N 1 0 288.218 3.677 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1cccc2[nH]ccc21 ZINC000115629369 1123619972 /nfs/dbraw/zinc/61/99/72/1123619972.db2.gz MGACOUKRDLFACY-UHFFFAOYSA-N 1 0 293.414 3.832 20 10 CHCDRO Cc1ccsc1C[NH2+]Cc1ccc(N(C)C)cc1C ZINC000115629592 1123620192 /nfs/dbraw/zinc/62/01/92/1123620192.db2.gz LFAVVDIOTXQLRK-UHFFFAOYSA-N 1 0 274.433 3.721 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@@H](C)c2ccc(F)cc2C)c1 ZINC000896804601 1123626948 /nfs/dbraw/zinc/62/69/48/1123626948.db2.gz ZMVCFMPOVFWRBP-LBPRGKRZSA-N 1 0 289.350 3.699 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@H](C)c2ccc(F)cc2C)c1 ZINC000896802539 1123628242 /nfs/dbraw/zinc/62/82/42/1123628242.db2.gz ZMVCFMPOVFWRBP-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H](C)c2ccc(F)cc2C)c1O ZINC000896802988 1123628643 /nfs/dbraw/zinc/62/86/43/1123628643.db2.gz IFASJPHLEBCTNY-ZDUSSCGKSA-N 1 0 273.351 3.999 20 10 CHCDRO Oc1ccccc1C[NH2+]CC1(C(F)(F)F)CCCC1 ZINC000858308310 1123642360 /nfs/dbraw/zinc/64/23/60/1123642360.db2.gz XPDIJKGXISKMHY-UHFFFAOYSA-N 1 0 273.298 3.605 20 10 CHCDRO C[C@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)c1ccns1 ZINC000858318081 1123644215 /nfs/dbraw/zinc/64/42/15/1123644215.db2.gz LIOXKFGOLPHPBS-IHVVCDCBSA-N 1 0 287.432 3.573 20 10 CHCDRO COCC(C)(C)CCC[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000287033159 1123664267 /nfs/dbraw/zinc/66/42/67/1123664267.db2.gz LYDYAXHWDZCLJY-AWEZNQCLSA-N 1 0 279.424 3.804 20 10 CHCDRO CC(C)([NH2+]Cc1cc(Cl)ccc1O)c1nccs1 ZINC000116381067 1123674494 /nfs/dbraw/zinc/67/44/94/1123674494.db2.gz UQOIXIZYUXQHIO-UHFFFAOYSA-N 1 0 282.796 3.527 20 10 CHCDRO C[N@H+](CCSc1ccccc1)Cc1ccccc1O ZINC000117881601 1123763357 /nfs/dbraw/zinc/76/33/57/1123763357.db2.gz XDBRUVUUOKITNB-UHFFFAOYSA-N 1 0 273.401 3.616 20 10 CHCDRO Cc1cccc(O)c1C[NH2+][C@H]1CCSC2(CCC2)C1 ZINC000896952172 1123792493 /nfs/dbraw/zinc/79/24/93/1123792493.db2.gz VCBCXNJZKVCBTE-ZDUSSCGKSA-N 1 0 277.433 3.609 20 10 CHCDRO C[C@H]1C[C@H]([NH2+]Cc2ccc3ccccc3c2O)CCS1 ZINC000896951650 1123792629 /nfs/dbraw/zinc/79/26/29/1123792629.db2.gz LGPSGVHUXDWRCM-SWLSCSKDSA-N 1 0 287.428 3.919 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCCN2C)C1CC(F)(F)C1 ZINC000862275144 1123797503 /nfs/dbraw/zinc/79/75/03/1123797503.db2.gz LWUOCQMXHSIXKL-LBPRGKRZSA-N 1 0 294.389 3.592 20 10 CHCDRO CCOc1cccc(C[NH+]2C[C@H](C)C(F)(F)[C@@H](C)C2)c1O ZINC000862438376 1123809952 /nfs/dbraw/zinc/80/99/52/1123809952.db2.gz ALNAHDCAKUXXLK-RYUDHWBXSA-N 1 0 299.361 3.514 20 10 CHCDRO Oc1c(C[NH2+]CC2CC=CC2)ccc2ccccc21 ZINC000862456260 1123812173 /nfs/dbraw/zinc/81/21/73/1123812173.db2.gz WQBAKQCYGFHXPI-UHFFFAOYSA-N 1 0 253.345 3.601 20 10 CHCDRO COc1cccc2c1C[N@H+](Cc1cc(C)c(C)cc1O)C2 ZINC000862529031 1123817292 /nfs/dbraw/zinc/81/72/92/1123817292.db2.gz HEVLYVXCVDEHHR-UHFFFAOYSA-N 1 0 283.371 3.533 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@H]2C[C@@H](C)O[C@@H]2C)c1O ZINC000840872998 1123871777 /nfs/dbraw/zinc/87/17/77/1123871777.db2.gz OTNKXXFAVLSNPF-XQHKEYJVSA-N 1 0 297.826 3.818 20 10 CHCDRO CCOc1cccc(C[NH2+]C2C[C@H](C)C[C@@H](C)C2)c1O ZINC000084461639 1129153148 /nfs/dbraw/zinc/15/31/48/1129153148.db2.gz TUDKGKGOYZKECU-CHWSQXEVSA-N 1 0 277.408 3.705 20 10 CHCDRO C[C@@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1cc2c(cc1O)CCC2 ZINC000794670533 1123924066 /nfs/dbraw/zinc/92/40/66/1123924066.db2.gz XRVJLMONKNLURK-YGRLFVJLSA-N 1 0 299.336 3.654 20 10 CHCDRO COc1cc(C)cc(C[N@H+](C)[C@@H]2CCC(C)(C)C2)c1O ZINC000794684947 1123927671 /nfs/dbraw/zinc/92/76/71/1123927671.db2.gz KKWHZTJELVSDSQ-CQSZACIVSA-N 1 0 277.408 3.720 20 10 CHCDRO CC[C@H]([NH2+]CCOc1ccccc1)c1ccc(C)cc1O ZINC000794797513 1123949648 /nfs/dbraw/zinc/94/96/48/1123949648.db2.gz ZOLKIMMZRBFNGN-KRWDZBQOSA-N 1 0 285.387 3.820 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccn(C(C)C)n1)c1ccc(C)cc1O ZINC000794801593 1123950401 /nfs/dbraw/zinc/95/04/01/1123950401.db2.gz JTCRFQXLJCCHJL-INIZCTEOSA-N 1 0 287.407 3.719 20 10 CHCDRO CC[C@@H]([NH2+]CC(CC)(CC)CCO)c1ccc(C)cc1O ZINC000794801923 1123950659 /nfs/dbraw/zinc/95/06/59/1123950659.db2.gz LXUZCCZVKJWGBM-MRXNPFEDSA-N 1 0 293.451 3.930 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ncc(C)s1)c1ccc(C)cc1O ZINC000794802636 1123952582 /nfs/dbraw/zinc/95/25/82/1123952582.db2.gz OMLIFLRDZKYMHG-CYBMUJFWSA-N 1 0 276.405 3.706 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCCCN1CC)c1ccc(C)cc1O ZINC000794807004 1123953866 /nfs/dbraw/zinc/95/38/66/1123953866.db2.gz JDDQLSJVUWTYGM-WBVHZDCISA-N 1 0 290.451 3.616 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@](C)(O)c1ccccc1)c1ccc(C)cc1O ZINC000794807841 1123956325 /nfs/dbraw/zinc/95/63/25/1123956325.db2.gz MBYBKNIVYVBEMV-IEBWSBKVSA-N 1 0 299.414 3.649 20 10 CHCDRO CC[C@H]([NH2+][C@H]1C[C@@H](OC)C1(C)C)c1ccc(C)cc1O ZINC000794811597 1123956551 /nfs/dbraw/zinc/95/65/51/1123956551.db2.gz RYQZJEBRNGMCRG-CWRNSKLLSA-N 1 0 277.408 3.555 20 10 CHCDRO CC[C@@H]([NH2+]CCC(O)(CC)CC)c1ccc(C)cc1O ZINC000794815418 1123958279 /nfs/dbraw/zinc/95/82/79/1123958279.db2.gz PENZSNGMMILALK-OAHLLOKOSA-N 1 0 279.424 3.683 20 10 CHCDRO CC[C@@H]([NH2+]CC(C)(C)[C@@H](O)C(C)C)c1ccc(C)cc1O ZINC000794816513 1123958287 /nfs/dbraw/zinc/95/82/87/1123958287.db2.gz NQLWQKSLRPYPTE-WBVHZDCISA-N 1 0 293.451 3.784 20 10 CHCDRO CC[C@H]([NH2+]CC(C)(C)[C@@H](O)C(C)C)c1ccc(C)cc1O ZINC000794816509 1123958321 /nfs/dbraw/zinc/95/83/21/1123958321.db2.gz NQLWQKSLRPYPTE-RDJZCZTQSA-N 1 0 293.451 3.784 20 10 CHCDRO CC[C@@H]([NH2+][C@H](CO)c1ccsc1)c1ccc(C)cc1O ZINC000794812449 1123958901 /nfs/dbraw/zinc/95/89/01/1123958901.db2.gz CZEGYROTTSVKRH-HUUCEWRRSA-N 1 0 291.416 3.536 20 10 CHCDRO COc1ccc(C[N@@H+]2CCc3ccccc3[C@H]2C)c(O)c1 ZINC000093149711 1123960899 /nfs/dbraw/zinc/96/08/99/1123960899.db2.gz VLJHOOUUJVUHIJ-CYBMUJFWSA-N 1 0 283.371 3.520 20 10 CHCDRO CC[C@H]([NH2+]CC1(CO)CCCCC1)c1ccc(C)cc1O ZINC000794819413 1123960957 /nfs/dbraw/zinc/96/09/57/1123960957.db2.gz WPCPDEFPSWPAGE-INIZCTEOSA-N 1 0 291.435 3.684 20 10 CHCDRO CC[C@H]([NH2+]CC(CC)(CC)CO)c1ccc(C)cc1O ZINC000794819767 1123961577 /nfs/dbraw/zinc/96/15/77/1123961577.db2.gz XUUSZGJAJQSEGC-HNNXBMFYSA-N 1 0 279.424 3.540 20 10 CHCDRO Cc1cc(N[C@H](C)c2ccc(N(C)C)cc2)cc[nH+]1 ZINC000302449281 1123968473 /nfs/dbraw/zinc/96/84/73/1123968473.db2.gz NHIAYMBAIDSBBA-CYBMUJFWSA-N 1 0 255.365 3.629 20 10 CHCDRO Cc1cc(N(C)Cc2ccccc2O)c2ccccc2[nH+]1 ZINC000302673655 1123977772 /nfs/dbraw/zinc/97/77/72/1123977772.db2.gz SQWGDLIHRIJPKA-UHFFFAOYSA-N 1 0 278.355 3.885 20 10 CHCDRO CCOCc1cc(C[NH2+][C@@]23C[C@@H]2CCCC3)ccc1OC ZINC000865704172 1124007063 /nfs/dbraw/zinc/00/70/63/1124007063.db2.gz RWASVRVGWCZHOM-WMZOPIPTSA-N 1 0 289.419 3.654 20 10 CHCDRO COc1cccc(C[NH2+][C@H](C)C2CCCCCC2)c1O ZINC000149932534 1124024235 /nfs/dbraw/zinc/02/42/35/1124024235.db2.gz DRDYTDIQFTXBSW-CYBMUJFWSA-N 1 0 277.408 3.849 20 10 CHCDRO CCC[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cc(C)ccn1 ZINC000866252625 1124042910 /nfs/dbraw/zinc/04/29/10/1124042910.db2.gz MIFWKAHCYPNQLA-QGZVFWFLSA-N 1 0 296.414 3.956 20 10 CHCDRO C[C@@H]1C[C@@H]([NH2+]CC[C@@H]2CCSC2)c2c1c(F)ccc2O ZINC000866402378 1124063070 /nfs/dbraw/zinc/06/30/70/1124063070.db2.gz JQWUGAGBTGJQLZ-NQBHXWOUSA-N 1 0 295.423 3.812 20 10 CHCDRO CCC[C@@H](CCO)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000866414759 1124064571 /nfs/dbraw/zinc/06/45/71/1124064571.db2.gz KKPDLQKPWVHRRL-HIFRSBDPSA-N 1 0 287.403 3.747 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2ccc(C)o2)cc1 ZINC000866478550 1124069564 /nfs/dbraw/zinc/06/95/64/1124069564.db2.gz JOWIAIXWKNDEHC-AWEZNQCLSA-N 1 0 272.392 3.895 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2cccc(F)c2F)c(O)c1 ZINC000866476133 1124069864 /nfs/dbraw/zinc/06/98/64/1124069864.db2.gz IOESEAJDYINMNF-NSHDSACASA-N 1 0 277.314 3.830 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]Cc2cccc(F)c2F)c1O ZINC000866476781 1124070356 /nfs/dbraw/zinc/07/03/56/1124070356.db2.gz SCFKKEHPIURSGL-JTQLQIEISA-N 1 0 293.313 3.530 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1ccnn1C)c1cc(Cl)ccc1O ZINC000866613877 1124088919 /nfs/dbraw/zinc/08/89/19/1124088919.db2.gz JRXYJMDZQTZVEH-ZWNOBZJWSA-N 1 0 293.798 3.581 20 10 CHCDRO CCOc1cccc(C[NH2+]Cc2cc(Cl)ccc2O)c1 ZINC000037679399 1129165695 /nfs/dbraw/zinc/16/56/95/1129165695.db2.gz XPRCPXSRFJEHRZ-UHFFFAOYSA-N 1 0 291.778 3.734 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)CCCOc2ccccc2)cc1C ZINC000071895690 1129167204 /nfs/dbraw/zinc/16/72/04/1129167204.db2.gz DWHCJEXWXDWURZ-UHFFFAOYSA-N 1 0 299.414 3.910 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]Cc1ccnc(F)c1 ZINC001118994276 1131244675 /nfs/dbraw/zinc/24/46/75/1131244675.db2.gz SCPUKTTZNZTPRF-DGCLKSJQSA-N 1 0 286.350 3.573 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C[C@H]2CCCS2)cc1 ZINC000122044864 1124461886 /nfs/dbraw/zinc/46/18/86/1124461886.db2.gz OWYWSEFPMSPKSJ-MRXNPFEDSA-N 1 0 278.465 3.518 20 10 CHCDRO COc1cc2c(NCc3ccccc3O)cc[nH+]c2cc1F ZINC000795082434 1124514931 /nfs/dbraw/zinc/51/49/31/1124514931.db2.gz YFKFBBXLPYMXIZ-UHFFFAOYSA-N 1 0 298.317 3.700 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCc2ccccc21 ZINC000122684399 1124523996 /nfs/dbraw/zinc/52/39/96/1124523996.db2.gz LMENESMZUOCHIY-LJQANCHMSA-N 1 0 280.415 3.838 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)o1 ZINC000122797562 1124534525 /nfs/dbraw/zinc/53/45/25/1124534525.db2.gz JKLUKODVBIJVPI-CQSZACIVSA-N 1 0 272.392 3.813 20 10 CHCDRO C[C@H](Cc1ccc(O)cc1)[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000122900293 1124544081 /nfs/dbraw/zinc/54/40/81/1124544081.db2.gz YFIBHIFDDLRGKY-HUUCEWRRSA-N 1 0 298.430 3.740 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)NCc2ncc(C)s2)cc1 ZINC000122884187 1124544444 /nfs/dbraw/zinc/54/44/44/1124544444.db2.gz ASXAVKXZOQKKFU-CYBMUJFWSA-N 1 0 289.448 3.758 20 10 CHCDRO CN(C)c1ccc(C2=CCC[NH2+]CC2)c2ccccc21 ZINC001238944120 1131275112 /nfs/dbraw/zinc/27/51/12/1131275112.db2.gz DVCCGUXKGDOVJL-UHFFFAOYSA-N 1 0 266.388 3.673 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)[C@@H]1CCCOC1 ZINC000872064427 1124672701 /nfs/dbraw/zinc/67/27/01/1124672701.db2.gz YSEIVTVGMZYWET-LESCRADOSA-N 1 0 290.451 3.608 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1cc(C)ccc1O)[C@H](O)c1ccccc1 ZINC000872132208 1124691743 /nfs/dbraw/zinc/69/17/43/1124691743.db2.gz FLSGKQANULUTBT-DKSSEZFCSA-N 1 0 299.414 3.863 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCC[C@H](OC3CCC3)CC2)c1O ZINC000872261325 1124699621 /nfs/dbraw/zinc/69/96/21/1124699621.db2.gz DMAHFRPWATVALZ-KRWDZBQOSA-N 1 0 289.419 3.624 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc(N)cc(F)c1)c1ccc(C)cc1O ZINC000873288862 1124761354 /nfs/dbraw/zinc/76/13/54/1124761354.db2.gz MZBWIBWATRYLMF-MRXNPFEDSA-N 1 0 288.366 3.663 20 10 CHCDRO C[C@H]([NH2+]Cc1ccccc1Cl)c1ccccc1O ZINC000019908214 1124768982 /nfs/dbraw/zinc/76/89/82/1124768982.db2.gz TWASBJJFDUNVRD-NSHDSACASA-N 1 0 261.752 3.896 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]CCc1ccccc1F ZINC000019912760 1124770579 /nfs/dbraw/zinc/77/05/79/1124770579.db2.gz PBBJUVKKOVJHQR-UHFFFAOYSA-N 1 0 279.742 3.517 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)[C@@H]2CCSC2)cc1C(C)C ZINC000125021786 1124834012 /nfs/dbraw/zinc/83/40/12/1124834012.db2.gz ZLZJVNULGSBAEK-CQSZACIVSA-N 1 0 279.449 3.761 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)CCC(C)C)c1 ZINC000020560542 1124852286 /nfs/dbraw/zinc/85/22/86/1124852286.db2.gz UYWBCQBAQFRXEK-OLZOCXBDSA-N 1 0 265.397 3.876 20 10 CHCDRO CCC[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000020595289 1124853736 /nfs/dbraw/zinc/85/37/36/1124853736.db2.gz QIZPUSWEKHMESV-CYBMUJFWSA-N 1 0 264.388 3.877 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@H](C)CCCC(C)C)c1 ZINC000021519783 1124931329 /nfs/dbraw/zinc/93/13/29/1124931329.db2.gz LTDGYHQDGRXQLP-CYBMUJFWSA-N 1 0 265.397 3.705 20 10 CHCDRO COc1ccc(O)c(C[NH2+]C2CCCCCCC2)c1 ZINC000021813175 1124972567 /nfs/dbraw/zinc/97/25/67/1124972567.db2.gz PDYIMCMFSSOTGV-UHFFFAOYSA-N 1 0 263.381 3.603 20 10 CHCDRO Oc1ccccc1C[N@H+](Cc1ccns1)C1CCCC1 ZINC000876722427 1124972862 /nfs/dbraw/zinc/97/28/62/1124972862.db2.gz UOIUELHHJNCSAV-UHFFFAOYSA-N 1 0 288.416 3.794 20 10 CHCDRO Cc1nc(C)c([C@H](C)[N@H+](C)Cc2c(C)cccc2O)s1 ZINC000876714733 1124973773 /nfs/dbraw/zinc/97/37/73/1124973773.db2.gz CNYDETLLGVLKLQ-LBPRGKRZSA-N 1 0 290.432 3.967 20 10 CHCDRO Cc1ccc(C[NH+](C)C)cc1NCc1c(C)cccc1O ZINC000876869909 1124986500 /nfs/dbraw/zinc/98/65/00/1124986500.db2.gz XLHVORCFCAVJTM-UHFFFAOYSA-N 1 0 284.403 3.683 20 10 CHCDRO COc1ccc([C@H](C)[NH2+]Cc2ccc(C)cc2O)cc1 ZINC000876988322 1124994754 /nfs/dbraw/zinc/99/47/54/1124994754.db2.gz BUKPFBCNDVMXTD-ZDUSSCGKSA-N 1 0 271.360 3.560 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](c2ccccc2)[C@H]2CCCO2)c(O)c1 ZINC000876976490 1124995486 /nfs/dbraw/zinc/99/54/86/1124995486.db2.gz QLXHYCMXEIMKHP-MOPGFXCFSA-N 1 0 297.398 3.711 20 10 CHCDRO Cc1csc(C2([NH2+]Cc3ccc(C)cc3O)CCC2)n1 ZINC000877000596 1124996674 /nfs/dbraw/zinc/99/66/74/1124996674.db2.gz TVMMYYRSDXJIRO-UHFFFAOYSA-N 1 0 288.416 3.635 20 10 CHCDRO COc1ccc([C@@H](C)[NH2+]Cc2c(C)cccc2O)cc1F ZINC000877077115 1125006577 /nfs/dbraw/zinc/00/65/77/1125006577.db2.gz XRPQWBAAGIMBJJ-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO Oc1cc(Br)ccc1C[NH+]1CC2(C1)CCCC2 ZINC000825935313 1125012680 /nfs/dbraw/zinc/01/26/80/1125012680.db2.gz QFYYDCOBRCQYMR-UHFFFAOYSA-N 1 0 296.208 3.531 20 10 CHCDRO Cc1ccc(C[NH2+][C@H]2CCO[C@@H](c3ccccc3)C2)c(O)c1 ZINC000877377140 1125025091 /nfs/dbraw/zinc/02/50/91/1125025091.db2.gz VZUREGKNLBRDQL-PKOBYXMFSA-N 1 0 297.398 3.711 20 10 CHCDRO Cc1ccc(C[N@@H+]2CC(C)(C)[C@@H]2c2cccnc2)c(O)c1 ZINC000877547095 1125043201 /nfs/dbraw/zinc/04/32/01/1125043201.db2.gz WQHLXGKGXHXZOH-KRWDZBQOSA-N 1 0 282.387 3.679 20 10 CHCDRO CSCC1CCC([NH2+]Cc2ccc(C)cc2O)CC1 ZINC000877560796 1125045392 /nfs/dbraw/zinc/04/53/92/1125045392.db2.gz AYKQGZYOHQGQFZ-UHFFFAOYSA-N 1 0 279.449 3.712 20 10 CHCDRO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1c(C)cccc1O)CC2 ZINC000877613132 1125053709 /nfs/dbraw/zinc/05/37/09/1125053709.db2.gz XUNXJOQRNISTNC-KRWDZBQOSA-N 1 0 267.372 3.786 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2cc(Cl)c(C)cc2O)o1 ZINC000877698822 1125064295 /nfs/dbraw/zinc/06/42/95/1125064295.db2.gz ZTMYTHHLCHBVMH-UHFFFAOYSA-N 1 0 265.740 3.545 20 10 CHCDRO Oc1cccc2c1C[N@H+](C[C@@H]1C[C@H]1c1ccccc1)C2 ZINC000877702920 1125066711 /nfs/dbraw/zinc/06/67/11/1125066711.db2.gz JZXKFAAQDQFZOF-HOTGVXAUSA-N 1 0 265.356 3.512 20 10 CHCDRO Cc1ccc(F)cc1C[NH2+][C@H](C)c1ccccc1O ZINC000877756540 1125071947 /nfs/dbraw/zinc/07/19/47/1125071947.db2.gz QGZLZEPTIBDCJB-GFCCVEGCSA-N 1 0 259.324 3.691 20 10 CHCDRO COc1ccc(C[C@@H](C)[NH2+][C@H](C)c2ccccc2O)cc1 ZINC000877756339 1125071983 /nfs/dbraw/zinc/07/19/83/1125071983.db2.gz IADFUTDRGZYQCX-ZIAGYGMSSA-N 1 0 285.387 3.683 20 10 CHCDRO CCO[P@](C)(=O)CC[C@@H](C)[NH2+][C@H](C)c1ccccc1O ZINC000877755919 1125072503 /nfs/dbraw/zinc/07/25/03/1125072503.db2.gz SVSVRXSGVQCLMY-IZDJOXEWSA-N 1 0 299.351 3.766 20 10 CHCDRO C[C@@H]([NH2+]Cc1ncccc1C(F)(F)F)c1ccccc1O ZINC000877756499 1125072743 /nfs/dbraw/zinc/07/27/43/1125072743.db2.gz MWHLRWVKKMFRJV-SNVBAGLBSA-N 1 0 296.292 3.657 20 10 CHCDRO C[C@@H]([NH2+]Cc1cnc(C2CCC2)s1)c1ccccc1O ZINC000877756252 1125073138 /nfs/dbraw/zinc/07/31/38/1125073138.db2.gz BNBQYUOKFVBRBH-LLVKDONJSA-N 1 0 288.416 3.967 20 10 CHCDRO Cc1ccc(F)c(C[NH2+][C@@H](C)c2ccccc2O)c1 ZINC000877757213 1125074071 /nfs/dbraw/zinc/07/40/71/1125074071.db2.gz OIEUJQQJUDXUND-LBPRGKRZSA-N 1 0 259.324 3.691 20 10 CHCDRO CC(C)[C@H]1C[C@@H]([NH2+][C@@H](C)c2ccccc2O)CS1 ZINC000877758123 1125074178 /nfs/dbraw/zinc/07/41/78/1125074178.db2.gz JRPUOBGIXFNZLH-YWPYICTPSA-N 1 0 265.422 3.573 20 10 CHCDRO CO[C@H](c1ccccc1)[C@H](C)[NH2+][C@@H](C)c1ccccc1O ZINC000877758243 1125074954 /nfs/dbraw/zinc/07/49/54/1125074954.db2.gz PBHIDNUGCHXHRW-DEYYWGMASA-N 1 0 285.387 3.819 20 10 CHCDRO CC(C)[C@H]1C[C@H]([NH2+][C@@H](C)c2ccccc2O)CS1 ZINC000877758122 1125075622 /nfs/dbraw/zinc/07/56/22/1125075622.db2.gz JRPUOBGIXFNZLH-SLEUVZQESA-N 1 0 265.422 3.573 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CCCC(C)(F)F)cc1Cl ZINC000826029492 1125130475 /nfs/dbraw/zinc/13/04/75/1125130475.db2.gz GNLWYSIHVLEWEM-UHFFFAOYSA-N 1 0 277.742 3.879 20 10 CHCDRO COc1cc(C[N@@H+]2CC[C@@H]2C2CC2)c(O)c(C(C)(C)C)c1 ZINC000826043626 1125157787 /nfs/dbraw/zinc/15/77/87/1125157787.db2.gz MSTUQJHWBQESRC-MRXNPFEDSA-N 1 0 289.419 3.683 20 10 CHCDRO Cc1cc(Br)cc(C[NH2+][C@@H]2CC[C@@H](C)C2)c1O ZINC000783710098 1125285679 /nfs/dbraw/zinc/28/56/79/1125285679.db2.gz JNSWVPRREQEBDK-NOZJJQNGSA-N 1 0 298.224 3.741 20 10 CHCDRO COc1ccc([C@@H](C)[NH2+]Cc2cccc(C)c2O)cc1C ZINC000897417411 1125321218 /nfs/dbraw/zinc/32/12/18/1125321218.db2.gz OZSNRFYCKMQVGB-CQSZACIVSA-N 1 0 285.387 3.868 20 10 CHCDRO CC[C@@H](C)[NH2+][C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000130081677 1125356578 /nfs/dbraw/zinc/35/65/78/1125356578.db2.gz NVJUVSPSEQLDGU-CHWSQXEVSA-N 1 0 298.377 3.645 20 10 CHCDRO CSc1ccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)o1 ZINC000883092710 1125371326 /nfs/dbraw/zinc/37/13/26/1125371326.db2.gz WUWJAIKOJWYYOI-LBPRGKRZSA-N 1 0 290.432 3.918 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]CC(C)(C)CC(F)F)c1 ZINC000883252230 1125385271 /nfs/dbraw/zinc/38/52/71/1125385271.db2.gz YZSIJUJSEITGMB-UHFFFAOYSA-N 1 0 287.350 3.562 20 10 CHCDRO COc1ccc(C2CC2)cc1C[NH2+]Cc1cc(C)ccc1O ZINC000883257753 1125386791 /nfs/dbraw/zinc/38/67/91/1125386791.db2.gz JSYQHKNHXSQNTN-UHFFFAOYSA-N 1 0 297.398 3.876 20 10 CHCDRO CC(C)OCCC[N@H+](C)Cc1c(O)ccc2ccccc21 ZINC000382806792 1125396254 /nfs/dbraw/zinc/39/62/54/1125396254.db2.gz YJPAKHODAMIPTK-UHFFFAOYSA-N 1 0 287.403 3.792 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CCC[C@@H]2c2ccccc2)c1 ZINC000131584758 1125398394 /nfs/dbraw/zinc/39/83/94/1125398394.db2.gz HBGQZTPAHLHUSS-QGZVFWFLSA-N 1 0 283.371 3.738 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1ccc(C)c(C)c1O)[C@@H]1CCCOC1 ZINC000883351891 1125399491 /nfs/dbraw/zinc/39/94/91/1125399491.db2.gz NYPAGTPCSQMZEL-UXLLHSPISA-N 1 0 291.435 3.865 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCC2(CCC2)O1)c1ccc(Cl)cc1O ZINC000883357468 1125401370 /nfs/dbraw/zinc/40/13/70/1125401370.db2.gz LYMJEQPSAJQNRW-WCQYABFASA-N 1 0 295.810 3.798 20 10 CHCDRO COc1ccc(O)c(C[N@H+](C)[C@@H]2CCc3ccccc32)c1 ZINC000131994172 1125413064 /nfs/dbraw/zinc/41/30/64/1125413064.db2.gz SLXRACAULUNPFG-QGZVFWFLSA-N 1 0 283.371 3.520 20 10 CHCDRO C[C@H]([NH2+]CCCSc1nccs1)C1CCCC1 ZINC000132296227 1125416653 /nfs/dbraw/zinc/41/66/53/1125416653.db2.gz IFQUCKQKXXFXMP-NSHDSACASA-N 1 0 270.467 3.794 20 10 CHCDRO Cc1ccccc1[C@@H]1C[N@H+](Cc2ccccc2O)[C@@H](C)CO1 ZINC000245636847 1129214199 /nfs/dbraw/zinc/21/41/99/1129214199.db2.gz XGLFVBJYTAXYJL-KXBFYZLASA-N 1 0 297.398 3.663 20 10 CHCDRO C[C@@H]([NH2+]CCCC(C)(F)F)c1ccc(N(C)C)cc1 ZINC000297368658 1129225579 /nfs/dbraw/zinc/22/55/79/1129225579.db2.gz QJEBZVVKFUPLLF-GFCCVEGCSA-N 1 0 270.367 3.839 20 10 CHCDRO Cc1ccccc1C[C@@H](C)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000037777185 1129268714 /nfs/dbraw/zinc/26/87/14/1129268714.db2.gz FIICRXHHKMDPQI-OAHLLOKOSA-N 1 0 281.399 3.651 20 10 CHCDRO CCC[C@@H](C[NH2+]Cc1ccc(N2CCCCC2)cc1)OC ZINC000378858516 1129284269 /nfs/dbraw/zinc/28/42/69/1129284269.db2.gz ZJDKEMSIPJHUOP-SFHVURJKSA-N 1 0 290.451 3.582 20 10 CHCDRO C[C@@]1([NH2+]Cc2ccccc2O)CCCc2ccccc21 ZINC000734844131 1129324409 /nfs/dbraw/zinc/32/44/09/1129324409.db2.gz VGMDIYRRHUMVLX-GOSISDBHSA-N 1 0 267.372 3.734 20 10 CHCDRO CC[C@H]([NH2+]Cc1nc2c(s1)CCC2)c1ccccc1O ZINC000719570643 1129345535 /nfs/dbraw/zinc/34/55/35/1129345535.db2.gz KZGOTVSQPFEJML-LBPRGKRZSA-N 1 0 288.416 3.578 20 10 CHCDRO CSC[C@H](C)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000736361297 1129372995 /nfs/dbraw/zinc/37/29/95/1129372995.db2.gz SGNFCZMMHYWUTF-ZDUSSCGKSA-N 1 0 287.428 3.900 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCCC[C@@H](SC)C2)c1O ZINC000092064104 1129379371 /nfs/dbraw/zinc/37/93/71/1129379371.db2.gz ABOWQAUTYDVLHX-CQSZACIVSA-N 1 0 295.448 3.508 20 10 CHCDRO C[C@@H]([NH2+]CC(C)(C)N1CCC[C@@H](C)C1)c1ccccc1O ZINC000248386173 1129415993 /nfs/dbraw/zinc/41/59/93/1129415993.db2.gz LNVZEIOCELZUAP-HUUCEWRRSA-N 1 0 290.451 3.553 20 10 CHCDRO CCN1CCC[C@@H]1C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000248527202 1129420232 /nfs/dbraw/zinc/42/02/32/1129420232.db2.gz GXHQODOJEUVJCW-GDBMZVCRSA-N 1 0 298.430 3.680 20 10 CHCDRO CCO[C@H]1C[C@H]([N@H+](C)Cc2cc(C)c(C)cc2O)C1(C)C ZINC000740861685 1129420845 /nfs/dbraw/zinc/42/08/45/1129420845.db2.gz QXGUYJRCLQFRBM-IRXDYDNUSA-N 1 0 291.435 3.644 20 10 CHCDRO CC(C)C[C@@H]1OCCC[C@H]1[NH2+][C@H](C)c1cc(F)ccc1O ZINC000248555391 1129422331 /nfs/dbraw/zinc/42/23/31/1129422331.db2.gz KKMPOWITWFIEHI-VMGRFDJRSA-N 1 0 295.398 3.776 20 10 CHCDRO COc1cccc(C[N@@H+]2CCC[C@@]3(CC=CCC3)C2)c1O ZINC000093439508 1129423714 /nfs/dbraw/zinc/42/37/14/1129423714.db2.gz BMFAKQRJJXWPPS-SFHVURJKSA-N 1 0 287.403 3.723 20 10 CHCDRO COc1cccc(C[N@@H+]2CC[C@H](c3ccccc3)[C@H]2C)c1O ZINC000093689639 1129427274 /nfs/dbraw/zinc/42/72/74/1129427274.db2.gz SEURTYUTNDHCMB-PBHICJAKSA-N 1 0 297.398 3.779 20 10 CHCDRO Cc1cc(O)c(C[NH+]2CCC3(CCC3)CC2)cc1C ZINC000795712885 1129439630 /nfs/dbraw/zinc/43/96/30/1129439630.db2.gz BRGJRWCLVJEHMD-UHFFFAOYSA-N 1 0 259.393 3.775 20 10 CHCDRO CN(C)c1ccc(C[NH2+]Cc2ccccc2C2CC2)cc1 ZINC000094357599 1129444287 /nfs/dbraw/zinc/44/42/87/1129444287.db2.gz BGHXEPMXKZZTDL-UHFFFAOYSA-N 1 0 280.415 3.920 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(F)c(F)c1)c1cc(F)ccc1O ZINC000094617930 1129448291 /nfs/dbraw/zinc/44/82/91/1129448291.db2.gz NZVUKHZXBQCKSK-SECBINFHSA-N 1 0 281.277 3.660 20 10 CHCDRO C[C@@H]([NH2+]Cc1cccc(F)c1)c1cc(F)ccc1O ZINC000094617032 1129448584 /nfs/dbraw/zinc/44/85/84/1129448584.db2.gz NLMJWHPUGQZXLO-SNVBAGLBSA-N 1 0 263.287 3.521 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2Cc3ccccc3C[C@H]2C)cc1C ZINC000742159871 1129468418 /nfs/dbraw/zinc/46/84/18/1129468418.db2.gz UHBSSGMTUMXIFP-OAHLLOKOSA-N 1 0 281.399 3.956 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H]2CCC[C@@H](C3CC3)C2)c1 ZINC000742377034 1129475157 /nfs/dbraw/zinc/47/51/57/1129475157.db2.gz LVJOPXUXRAFKGX-GDBMZVCRSA-N 1 0 259.393 3.759 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H]2CC[C@@H]3CCC[C@@H]3C2)c1O ZINC000742378690 1129476061 /nfs/dbraw/zinc/47/60/61/1129476061.db2.gz JQTRQKDNIMSYPK-SQWLQELKSA-N 1 0 289.419 3.849 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)COc2ccccc2)cc1C ZINC000742724189 1129496852 /nfs/dbraw/zinc/49/68/52/1129496852.db2.gz PWZCPRGBFUWKAJ-HNNXBMFYSA-N 1 0 285.387 3.561 20 10 CHCDRO Oc1ccccc1C[N@H+](CC1CCC1)C1CCCC1 ZINC000743847418 1129539331 /nfs/dbraw/zinc/53/93/31/1129539331.db2.gz BVSUMISTDUPERP-UHFFFAOYSA-N 1 0 259.393 3.937 20 10 CHCDRO CCC[N@@H+](Cc1ccccc1O)C[C@@H]1CC1(Cl)Cl ZINC000743869856 1129542199 /nfs/dbraw/zinc/54/21/99/1129542199.db2.gz CODHIQIETJJYJE-LBPRGKRZSA-N 1 0 288.218 3.798 20 10 CHCDRO CC[C@H](C)C[C@@H](C)[NH2+][C@H](C)c1cc(OC)ccc1O ZINC000251963098 1129547506 /nfs/dbraw/zinc/54/75/06/1129547506.db2.gz VXJAGCRRFLBDPC-YNEHKIRRSA-N 1 0 265.397 3.876 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2C[C@H](OC(C)C)C2(C)C)c1 ZINC000766331849 1129604604 /nfs/dbraw/zinc/60/46/04/1129604604.db2.gz NMZUKAUDONQMGH-JQFCIGGWSA-N 1 0 291.435 3.943 20 10 CHCDRO CC(C)O[C@@H]1C[C@H]([NH2+][C@H](C)c2cc(F)ccc2O)C1(C)C ZINC000766330175 1129604685 /nfs/dbraw/zinc/60/46/85/1129604685.db2.gz BQHTZCYBIHBTJN-XFBWCDHKSA-N 1 0 295.398 3.774 20 10 CHCDRO CCC1([NH2+]Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000379726419 1129629504 /nfs/dbraw/zinc/62/95/04/1129629504.db2.gz VPBKUEHEKWQMBE-UHFFFAOYSA-N 1 0 258.409 3.709 20 10 CHCDRO C[C@H]1C[NH+](Cc2c(O)ccc3ccccc32)C[C@@H]1C ZINC000097987276 1129634248 /nfs/dbraw/zinc/63/42/48/1129634248.db2.gz UILOYEPJVHVSKG-STQMWFEESA-N 1 0 255.361 3.633 20 10 CHCDRO CSC1CCC(C[NH2+][C@H]2CCc3cccc(O)c32)CC1 ZINC000720559035 1129657442 /nfs/dbraw/zinc/65/74/42/1129657442.db2.gz UPGVWHQZMXGKHV-ZALBZXLWSA-N 1 0 291.460 3.891 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@H](OC)C(C)(C)C)cc1 ZINC000766368493 1129660990 /nfs/dbraw/zinc/66/09/90/1129660990.db2.gz IESXBZPHIHGKRD-PBHICJAKSA-N 1 0 292.467 3.854 20 10 CHCDRO CSC1CCC(C[NH2+]Cc2cccc(C)c2O)CC1 ZINC000720605898 1129670522 /nfs/dbraw/zinc/67/05/22/1129670522.db2.gz HMQZPIBWIVVQRL-UHFFFAOYSA-N 1 0 279.449 3.712 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cc(C)cs2)c1 ZINC000380898117 1129833562 /nfs/dbraw/zinc/83/35/62/1129833562.db2.gz MQOAJBLFWRVCNO-NSHDSACASA-N 1 0 277.389 3.622 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2c(O)cccc2Cl)cc1F ZINC000113316517 1129836034 /nfs/dbraw/zinc/83/60/34/1129836034.db2.gz DJKKAMBOBZORPF-UHFFFAOYSA-N 1 0 279.742 3.783 20 10 CHCDRO C[N@@H+](Cc1cc(Cl)ccc1O)Cc1ccccc1F ZINC000768172142 1129839546 /nfs/dbraw/zinc/83/95/46/1129839546.db2.gz NAJLXSXUXULDTI-UHFFFAOYSA-N 1 0 279.742 3.817 20 10 CHCDRO COc1cccc(O)c1C[N@@H+]1CCC[C@H]1c1ccccc1 ZINC000768228398 1129845147 /nfs/dbraw/zinc/84/51/47/1129845147.db2.gz IMJSLKPZVONJPA-INIZCTEOSA-N 1 0 283.371 3.738 20 10 CHCDRO CCC(CC)[N@H+](Cc1cccc(OC)c1O)C1CC1 ZINC000768258944 1129847139 /nfs/dbraw/zinc/84/71/39/1129847139.db2.gz ZGSCVDYKDAFKLW-UHFFFAOYSA-N 1 0 263.381 3.554 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](C)[C@@H]2CCC[C@@H](C)C2)c1 ZINC000768261225 1129848945 /nfs/dbraw/zinc/84/89/45/1129848945.db2.gz AFAOMFMVSACQIQ-UKRRQHHQSA-N 1 0 277.408 3.801 20 10 CHCDRO COc1cc(C[N@H+]2Cc3ccccc3[C@@H](C)C2)c(O)cc1C ZINC000768440740 1129855764 /nfs/dbraw/zinc/85/57/64/1129855764.db2.gz CSGUGCSTSXZOFO-AWEZNQCLSA-N 1 0 297.398 3.829 20 10 CHCDRO CCC(CC)[N@H+](Cc1cc(OC)c(OC)cc1O)C1CC1 ZINC000768441728 1129856790 /nfs/dbraw/zinc/85/67/90/1129856790.db2.gz HIMAKNIUMPYZBK-UHFFFAOYSA-N 1 0 293.407 3.562 20 10 CHCDRO Oc1cc2c(cc1C[N@@H+]1CC[C@H](C3CC3)C1)CCCC2 ZINC000768464986 1129858862 /nfs/dbraw/zinc/85/88/62/1129858862.db2.gz HIPNEDSOKINYMY-INIZCTEOSA-N 1 0 271.404 3.503 20 10 CHCDRO COc1cc(C[N@@H+]2C[C@@H](C)[C@H]2c2ccccc2)c(O)cc1C ZINC000768467096 1129859253 /nfs/dbraw/zinc/85/92/53/1129859253.db2.gz YKTUGBRXJYHJPN-KUHUBIRLSA-N 1 0 297.398 3.902 20 10 CHCDRO CC[C@@H]1Cc2ccccc2C[N@@H+]1Cc1cccc(OC)c1O ZINC000768530570 1129860247 /nfs/dbraw/zinc/86/02/47/1129860247.db2.gz LHQUERYHADUKHF-QGZVFWFLSA-N 1 0 297.398 3.738 20 10 CHCDRO Oc1ccccc1C[N@H+](C[C@@H]1CCCOC1)C1CCCC1 ZINC000768534085 1129860875 /nfs/dbraw/zinc/86/08/75/1129860875.db2.gz PEUGDCXXNSMEQO-HNNXBMFYSA-N 1 0 289.419 3.563 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C[C@@H]2CCCC(F)(F)C2)cc1 ZINC000800273427 1129861292 /nfs/dbraw/zinc/86/12/92/1129861292.db2.gz DGSJKCDXKMBJKB-CQSZACIVSA-N 1 0 282.378 3.668 20 10 CHCDRO CCOc1ccc(C[NH2+]C[C@@H]2CCCC(F)(F)C2)c(O)c1 ZINC000800276007 1129861864 /nfs/dbraw/zinc/86/18/64/1129861864.db2.gz HBFXVSYDNBCCRV-GFCCVEGCSA-N 1 0 299.361 3.706 20 10 CHCDRO CCOc1ccc(C[N@H+](C)[C@H](C)C(C)(C)C)c(O)c1 ZINC000768545327 1129863765 /nfs/dbraw/zinc/86/37/65/1129863765.db2.gz XVNZPCRKCCSISN-GFCCVEGCSA-N 1 0 265.397 3.657 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2CCC[C@H]3C[C@]32C)cc1F ZINC000800475484 1129875648 /nfs/dbraw/zinc/87/56/48/1129875648.db2.gz WWUVKZOHMVKGLC-IAOVAPTHSA-N 1 0 276.399 3.560 20 10 CHCDRO CCSCCC[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000800492701 1129879785 /nfs/dbraw/zinc/87/97/85/1129879785.db2.gz NAOPLFFQZQAVMN-AWEZNQCLSA-N 1 0 267.438 3.885 20 10 CHCDRO C[NH+]1CCN(c2ccc(/C=C/c3ccccc3)cc2)CC1 ZINC001239594671 1131405646 /nfs/dbraw/zinc/40/56/46/1131405646.db2.gz UIURFLVEILBWDO-BQYQJAHWSA-N 1 0 278.399 3.609 20 10 CHCDRO CC[N@H+](CCC(F)(F)F)Cc1ccc(N(C)C)c(F)c1 ZINC000769225776 1129896832 /nfs/dbraw/zinc/89/68/32/1129896832.db2.gz QDQLJGIFLHHWGH-UHFFFAOYSA-N 1 0 292.320 3.666 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](O)c2cc(C)cc(C)c2)c(O)c1 ZINC000800992822 1129903040 /nfs/dbraw/zinc/90/30/40/1129903040.db2.gz TUKXXJYMZOGNIH-DNVCBOLYSA-N 1 0 299.414 3.702 20 10 CHCDRO CCOc1ccc(C[N@@H+]2Cc3ccccc3C[C@H]2C)c(O)c1 ZINC000769482775 1129909764 /nfs/dbraw/zinc/90/97/64/1129909764.db2.gz HYGNJLBSKFSLMM-CQSZACIVSA-N 1 0 297.398 3.738 20 10 CHCDRO Cc1ccc(O)c(C[N@H+]2Cc3ccccc3C[C@H]2C)c1 ZINC000769483644 1129909805 /nfs/dbraw/zinc/90/98/05/1129909805.db2.gz RJTGLTWOECIRGS-CQSZACIVSA-N 1 0 267.372 3.647 20 10 CHCDRO CN(C)c1ccc(C[NH+](CC2CC2)CC2CC2)cc1F ZINC000769450546 1129911209 /nfs/dbraw/zinc/91/12/09/1129911209.db2.gz DZLVHKRDHMTRMQ-UHFFFAOYSA-N 1 0 276.399 3.514 20 10 CHCDRO CCOc1cccc(C[N@@H+]2C[C@H](C)CCC[C@H]2C)c1O ZINC000769452319 1129911338 /nfs/dbraw/zinc/91/13/38/1129911338.db2.gz WFTWRKAGZIDEEO-ZIAGYGMSSA-N 1 0 277.408 3.801 20 10 CHCDRO CCOc1ccc(C[N@H+](C)CCc2cccs2)c(O)c1 ZINC000769498504 1129914066 /nfs/dbraw/zinc/91/40/66/1129914066.db2.gz JFSYPZPIAZDXRE-UHFFFAOYSA-N 1 0 291.416 3.527 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC[C@@H]2c2cccc(F)c2)c1 ZINC000769507736 1129915059 /nfs/dbraw/zinc/91/50/59/1129915059.db2.gz NVSJRCYORKDNTK-MRXNPFEDSA-N 1 0 271.335 3.787 20 10 CHCDRO Cc1ccc(O)c(CN2CCc3c(F)ccc(F)c3C2)c1 ZINC000769528131 1129915463 /nfs/dbraw/zinc/91/54/63/1129915463.db2.gz NVFCLRAMRGLRFD-UHFFFAOYSA-N 1 0 289.325 3.537 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1CCC2(CCCC2)O1)c1ccccc1O ZINC000801527374 1129924161 /nfs/dbraw/zinc/92/41/61/1129924161.db2.gz AFYHNNHDZZRAMS-GDBMZVCRSA-N 1 0 289.419 3.925 20 10 CHCDRO CCCC[N@H+](CC[C@H]1CCCO1)Cc1ccccc1O ZINC000801594599 1129931343 /nfs/dbraw/zinc/93/13/43/1129931343.db2.gz HIQOCWAIWIRZPG-MRXNPFEDSA-N 1 0 277.408 3.563 20 10 CHCDRO CCCC[N@H+](CCC(=O)C(C)(C)C)Cc1ccccc1O ZINC000801598562 1129931737 /nfs/dbraw/zinc/93/17/37/1129931737.db2.gz CCPZPOMNWQTNJW-UHFFFAOYSA-N 1 0 291.435 4.000 20 10 CHCDRO COc1ccc(C[NH2+]CCC2C[C@H](C)O[C@@H](C)C2)cc1C ZINC000801732776 1129941438 /nfs/dbraw/zinc/94/14/38/1129941438.db2.gz WTYDMCQMAMUNGR-GJZGRUSLSA-N 1 0 291.435 3.687 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCC[C@H]1Cc1cccc(F)c1 ZINC000770508584 1129948242 /nfs/dbraw/zinc/94/82/42/1129948242.db2.gz AGMXYQNIUGQOBN-KRWDZBQOSA-N 1 0 285.362 3.738 20 10 CHCDRO Cc1ccc([C@H]2CSCC[N@@H+]2Cc2ccccc2O)cc1 ZINC000770509534 1129949139 /nfs/dbraw/zinc/94/91/39/1129949139.db2.gz DAMNZOYDYJVQSX-QGZVFWFLSA-N 1 0 299.439 3.991 20 10 CHCDRO CCc1cccc(C[NH2+]Cc2cscc2C)c1O ZINC000691494786 1129977967 /nfs/dbraw/zinc/97/79/67/1129977967.db2.gz ORLYRHZGCVJKPL-UHFFFAOYSA-N 1 0 261.390 3.614 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCC2C[C@@H](C)O[C@H](C)C2)c(O)c1 ZINC000802308716 1129991292 /nfs/dbraw/zinc/99/12/92/1129991292.db2.gz HGGRSHYOFQKQMX-KFWWJZLASA-N 1 0 291.435 3.945 20 10 CHCDRO C[C@@H](C[NH2+]CCCSc1nccs1)C(C)(C)C ZINC000802647078 1130024620 /nfs/dbraw/zinc/02/46/20/1130024620.db2.gz XDJMURMJUBMWJG-NSHDSACASA-N 1 0 272.483 3.897 20 10 CHCDRO CCCC[N@H+](Cc1scnc1C)Cc1ccccc1O ZINC000802657872 1130027447 /nfs/dbraw/zinc/02/74/47/1130027447.db2.gz WPWVLJJBDRDMFT-UHFFFAOYSA-N 1 0 290.432 3.959 20 10 CHCDRO CCNc1ccccc1C[NH2+][C@H](C)c1ccccc1O ZINC000902643235 1130033038 /nfs/dbraw/zinc/03/30/38/1130033038.db2.gz KZHTZYXZJNOSNU-CYBMUJFWSA-N 1 0 270.376 3.675 20 10 CHCDRO CCS[C@H]1CC[C@H]([N@H+](C)Cc2ccc(C)cc2O)C1 ZINC001461933510 1130116492 /nfs/dbraw/zinc/11/64/92/1130116492.db2.gz FLXJLURMWDQBRB-GJZGRUSLSA-N 1 0 279.449 3.807 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CCc2ccc(F)c(F)c2)cc1C ZINC000786819274 1130119204 /nfs/dbraw/zinc/11/92/04/1130119204.db2.gz PZAHALBZBSACPM-UHFFFAOYSA-N 1 0 291.341 3.620 20 10 CHCDRO CC[C@H]([NH2+]Cc1nccc2c1CCCC2)c1ccccc1O ZINC000903180913 1130124537 /nfs/dbraw/zinc/12/45/37/1130124537.db2.gz ATYRRVGTGZDANT-KRWDZBQOSA-N 1 0 296.414 3.907 20 10 CHCDRO C[N@H+](Cc1ccc(N2CCCCC2)cc1)CC1(C)CC1 ZINC000787039276 1130126900 /nfs/dbraw/zinc/12/69/00/1130126900.db2.gz IFFVMVGHKLHNPB-UHFFFAOYSA-N 1 0 272.436 3.909 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2cnn(CC3CCC3)c2)c1 ZINC000903240133 1130133914 /nfs/dbraw/zinc/13/39/14/1130133914.db2.gz PDNOMDJCGKTWOB-CQSZACIVSA-N 1 0 299.418 3.548 20 10 CHCDRO C[C@H]([NH2+]CC(C)(C)C1CCOCC1)c1cc(F)ccc1O ZINC000903243974 1130134886 /nfs/dbraw/zinc/13/48/86/1130134886.db2.gz LORMXXLJVSUWCV-LBPRGKRZSA-N 1 0 295.398 3.635 20 10 CHCDRO COC(C)(C)CC[N@H+](Cc1ccccc1O)C1CCCC1 ZINC000787248001 1130140040 /nfs/dbraw/zinc/14/00/40/1130140040.db2.gz YATWRHLQUZIQIM-UHFFFAOYSA-N 1 0 291.435 3.952 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C2CC3(C2)CO[C@@H](C)C3)c(O)c1 ZINC000903281162 1130145292 /nfs/dbraw/zinc/14/52/92/1130145292.db2.gz FOBRYHLTXIUXES-JGTPUYEMSA-N 1 0 289.419 3.617 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2cncs2)c(O)c1C ZINC000903309946 1130150667 /nfs/dbraw/zinc/15/06/67/1130150667.db2.gz HNIHGTNVKLSOBR-NWDGAFQWSA-N 1 0 276.405 3.877 20 10 CHCDRO CCCCC1([NH2+][C@@H](C)c2cccc(OC)c2O)CC1 ZINC000903313563 1130152453 /nfs/dbraw/zinc/15/24/53/1130152453.db2.gz TVZDYSVANXXKPV-LBPRGKRZSA-N 1 0 263.381 3.774 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CCc2cccnc2C)c(O)c1 ZINC000903418868 1130174341 /nfs/dbraw/zinc/17/43/41/1130174341.db2.gz PLSPZKZJJDJUPG-OAHLLOKOSA-N 1 0 284.403 3.606 20 10 CHCDRO C[C@@H]([NH2+][C@H](c1ccncc1)C1CC1)c1ccccc1O ZINC000903430048 1130176303 /nfs/dbraw/zinc/17/63/03/1130176303.db2.gz XGVUJECQWKQHGR-PXAZEXFGSA-N 1 0 268.360 3.589 20 10 CHCDRO CCN1CCCC[C@H]1C[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000788595032 1130196734 /nfs/dbraw/zinc/19/67/34/1130196734.db2.gz ZBZCPNUBPRVJHI-CVEARBPZSA-N 1 0 290.451 3.534 20 10 CHCDRO CCSCCC[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000788825218 1130213147 /nfs/dbraw/zinc/21/31/47/1130213147.db2.gz XCPFEVUSGLRBOH-CYBMUJFWSA-N 1 0 267.438 3.803 20 10 CHCDRO CCOc1cccc(C[N@@H+]2C[C@@H](C)CC(C)(C)C2)c1O ZINC000753574193 1130218855 /nfs/dbraw/zinc/21/88/55/1130218855.db2.gz CKUJULFGACNRKD-ZDUSSCGKSA-N 1 0 277.408 3.659 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)C1CCC(F)(F)CC1 ZINC000788983120 1130221081 /nfs/dbraw/zinc/22/10/81/1130221081.db2.gz BEIPENFHHJKWFG-LBPRGKRZSA-N 1 0 295.373 3.925 20 10 CHCDRO CCC[N@@H+](Cc1ccccc1O)C[C@H](O)CC1CCCC1 ZINC000789327431 1130243865 /nfs/dbraw/zinc/24/38/65/1130243865.db2.gz OYLKYVDDHUMFEY-QGZVFWFLSA-N 1 0 291.435 3.545 20 10 CHCDRO CCC[N@@H+](Cc1ccccc1O)C[C@H](O)C1CCCCC1 ZINC000789325602 1130243926 /nfs/dbraw/zinc/24/39/26/1130243926.db2.gz BOYFCKKBIPDCCB-SFHVURJKSA-N 1 0 291.435 3.545 20 10 CHCDRO CCc1ccc([C@@H](O)C[NH2+][C@@H](CC)c2ccccc2O)cc1 ZINC000789363042 1130247135 /nfs/dbraw/zinc/24/71/35/1130247135.db2.gz RJXLQQOVVBVARS-HKUYNNGSSA-N 1 0 299.414 3.729 20 10 CHCDRO C[C@H]1CCSCC[N@@H+]1Cc1cc2c(cc1O)CCCC2 ZINC000790479222 1130315281 /nfs/dbraw/zinc/31/52/81/1130315281.db2.gz DIVCWYCNIGIQCM-ZDUSSCGKSA-N 1 0 291.460 3.598 20 10 CHCDRO COCC[N@H+](Cc1cc(C)cc(C)c1O)[C@H]1CC[C@H](C)C1 ZINC000790480600 1130315444 /nfs/dbraw/zinc/31/54/44/1130315444.db2.gz SNPRJYXNZMWEJL-GUYCJALGSA-N 1 0 291.435 3.646 20 10 CHCDRO C[C@@]1(C[NH2+]Cc2ccc3ccccc3c2O)CC1(F)F ZINC000827250829 1130528811 /nfs/dbraw/zinc/52/88/11/1130528811.db2.gz AYBXUSFMLOPLQD-HNNXBMFYSA-N 1 0 277.314 3.680 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]CC[C@@]1(C)CC1(F)F ZINC000827259822 1130529439 /nfs/dbraw/zinc/52/94/39/1130529439.db2.gz IFOUTAMOQSZUHC-HNNXBMFYSA-N 1 0 282.378 3.586 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]CC[C@]1(C)CC1(F)F ZINC000827259824 1130529832 /nfs/dbraw/zinc/52/98/32/1130529832.db2.gz IFOUTAMOQSZUHC-OAHLLOKOSA-N 1 0 282.378 3.586 20 10 CHCDRO C[C@H]1CCC[C@H](C[NH2+]Cc2ccc3ccccc3c2O)O1 ZINC000827251704 1130530052 /nfs/dbraw/zinc/53/00/52/1130530052.db2.gz LGFNZJHJDUMGJS-XJKSGUPXSA-N 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ZINC000815012593 1130951266 /nfs/dbraw/zinc/95/12/66/1130951266.db2.gz JVADVUYNNXTXHD-UHFFFAOYSA-N 1 0 298.430 3.702 20 10 CHCDRO CCc1ccc([C@H](O)C[NH2+][C@@H](C)c2cc(C)ccc2O)cc1 ZINC000797027496 1130954291 /nfs/dbraw/zinc/95/42/91/1130954291.db2.gz UQAALQJVSDGIPB-IFXJQAMLSA-N 1 0 299.414 3.647 20 10 CHCDRO Cc1cc(C[NH2+]C2(c3ccc(F)cc3)CC2)ccc1N(C)C ZINC000815068892 1130955643 /nfs/dbraw/zinc/95/56/43/1130955643.db2.gz HDYPWIDPRVKTGI-UHFFFAOYSA-N 1 0 298.405 3.979 20 10 CHCDRO Cc1cc(C[NH2+]C2(c3ccccc3)CC2)ccc1N(C)C ZINC000815082721 1130957515 /nfs/dbraw/zinc/95/75/15/1130957515.db2.gz FFYRVBYCCIGVDT-UHFFFAOYSA-N 1 0 280.415 3.840 20 10 CHCDRO CCS[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(N(C)C)c(C)c1 ZINC000815116669 1130958193 /nfs/dbraw/zinc/95/81/93/1130958193.db2.gz ZDCCJFDYQPEBIO-NVXWUHKLSA-N 1 0 292.492 3.825 20 10 CHCDRO CCS[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(N(C)C)c(C)c1 ZINC000815116668 1130958365 /nfs/dbraw/zinc/95/83/65/1130958365.db2.gz ZDCCJFDYQPEBIO-DOTOQJQBSA-N 1 0 292.492 3.825 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CSC[C@H]1C)c1ccc(N(C)C)cc1 ZINC000797064034 1130958441 /nfs/dbraw/zinc/95/84/41/1130958441.db2.gz FPOHWMQGHGFCIF-KCXAZCMYSA-N 1 0 278.465 3.545 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCOC[C@@H]1C)c1cc(Cl)ccc1O ZINC000797085291 1130960290 /nfs/dbraw/zinc/96/02/90/1130960290.db2.gz LNJXRIKFQAFPFF-ZOWXZIJZSA-N 1 0 297.826 3.759 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCOC[C@@H]1C)c1cc(Cl)ccc1O ZINC000797085288 1130960305 /nfs/dbraw/zinc/96/03/05/1130960305.db2.gz LNJXRIKFQAFPFF-HUBLWGQQSA-N 1 0 297.826 3.759 20 10 CHCDRO CCCN1CCC[C@H]1C[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000797113496 1130963203 /nfs/dbraw/zinc/96/32/03/1130963203.db2.gz CMGOVPBEJYWIBZ-OCCSQVGLSA-N 1 0 296.842 3.571 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CCN2CCCCCC2)c(O)c1 ZINC000815556321 1130999153 /nfs/dbraw/zinc/99/91/53/1130999153.db2.gz SNQMJNKUUUCBCG-MRXNPFEDSA-N 1 0 290.451 3.536 20 10 CHCDRO Oc1cccc2c1C[N@H+](Cc1cccc3occc31)CC2 ZINC001236738941 1131001989 /nfs/dbraw/zinc/00/19/89/1131001989.db2.gz JOPQUUALRKJTGE-UHFFFAOYSA-N 1 0 279.339 3.697 20 10 CHCDRO CCc1ccc(C[N@@H+]2CCC[C@@H](C(F)(F)F)C2)c(O)c1 ZINC001236788376 1131006360 /nfs/dbraw/zinc/00/63/60/1131006360.db2.gz JSZUCBVZANIVNQ-CYBMUJFWSA-N 1 0 287.325 3.729 20 10 CHCDRO CCc1ccc(C[N@@H+]2CCC[C@@H]3CCC[C@@H]32)c(O)c1 ZINC001236787250 1131006475 /nfs/dbraw/zinc/00/64/75/1131006475.db2.gz APSULZJHMJSYTI-HOCLYGCPSA-N 1 0 259.393 3.719 20 10 CHCDRO CCc1ccc(C[N@@H+]2CCC[C@@H]2c2cccnc2)c(O)c1 ZINC001236784393 1131007679 /nfs/dbraw/zinc/00/76/79/1131007679.db2.gz WEESQGMKGIYJPP-QGZVFWFLSA-N 1 0 282.387 3.687 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@H](O)C2CCCCC2)c(O)c1 ZINC000815575483 1131008342 /nfs/dbraw/zinc/00/83/42/1131008342.db2.gz SRYUWYNOONARMM-YOEHRIQHSA-N 1 0 291.435 3.601 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CC23CCCC3)c(O)c1 ZINC000815620705 1131009179 /nfs/dbraw/zinc/00/91/79/1131009179.db2.gz YXWKLCJVDJJGRL-DZGCQCFKSA-N 1 0 259.393 3.992 20 10 CHCDRO CCc1ccc(C[N@@H+]2CCc3c(F)cccc3C2)c(O)c1 ZINC001236793546 1131009798 /nfs/dbraw/zinc/00/97/98/1131009798.db2.gz YLOVERQTLKBXNZ-UHFFFAOYSA-N 1 0 285.362 3.652 20 10 CHCDRO CCc1ccc(C[NH+]2CC(c3ccccc3)C2)c(O)c1 ZINC001236793528 1131009860 /nfs/dbraw/zinc/00/98/60/1131009860.db2.gz YAFGDEMEMMMGBT-UHFFFAOYSA-N 1 0 267.372 3.554 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H]2C[C@H](c3cccc(F)c3)C2)c1 ZINC000797880540 1131011331 /nfs/dbraw/zinc/01/13/31/1131011331.db2.gz SZEGTKCHTIOYAE-CZIWCDLHSA-N 1 0 285.362 3.876 20 10 CHCDRO COc1cc(C)c(C[NH+]2CCC3(CCCC3)CC2)c(O)c1 ZINC001236807734 1131011318 /nfs/dbraw/zinc/01/13/18/1131011318.db2.gz KKFZPPDEXOEGTF-UHFFFAOYSA-N 1 0 289.419 3.865 20 10 CHCDRO COc1cc(O)c(C[N@H+](C)C[C@@H]2CC2(C)C)c(Cl)c1 ZINC001236802977 1131011455 /nfs/dbraw/zinc/01/14/55/1131011455.db2.gz LTFLCKRVFHPGCL-JTQLQIEISA-N 1 0 283.799 3.532 20 10 CHCDRO CCCN(CC)C[C@H](C)[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000815627914 1131012238 /nfs/dbraw/zinc/01/22/38/1131012238.db2.gz NCHYAGUGVWGELM-JKSUJKDBSA-N 1 0 292.467 3.780 20 10 CHCDRO CCC[NH+](CCC)Cc1c(O)cc(OC)cc1Cl ZINC001236805238 1131012624 /nfs/dbraw/zinc/01/26/24/1131012624.db2.gz YALSSLBWWQCGNM-UHFFFAOYSA-N 1 0 271.788 3.676 20 10 CHCDRO CCCC[N@H+](CCC)Cc1c(C)cc(OC)cc1O ZINC001236814074 1131014588 /nfs/dbraw/zinc/01/45/88/1131014588.db2.gz OVRNEDOGLKQDKR-UHFFFAOYSA-N 1 0 265.397 3.721 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1cc[nH]c(=O)c1)c1ccc(C)cc1O ZINC000815642822 1131015196 /nfs/dbraw/zinc/01/51/96/1131015196.db2.gz MXAVUIAAAIAZPP-DOMZBBRYSA-N 1 0 286.375 3.603 20 10 CHCDRO CC1(C)[C@@H]2C[N@@H+](Cc3cc4ccccc4cc3O)C[C@@H]21 ZINC001236830892 1131016533 /nfs/dbraw/zinc/01/65/33/1131016533.db2.gz DGRRBKYYWLDHEA-IYBDPMFKSA-N 1 0 267.372 3.633 20 10 CHCDRO CC(C)C1([NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)CC1 ZINC000815647601 1131017108 /nfs/dbraw/zinc/01/71/08/1131017108.db2.gz PGUDZWBDTYDRFV-PWSUYJOCSA-N 1 0 263.356 3.858 20 10 CHCDRO CC(C)C1([NH2+][C@H](C)c2cc(Cl)ccc2O)CC1 ZINC000815647277 1131017262 /nfs/dbraw/zinc/01/72/62/1131017262.db2.gz DWGLIVHEKHMWLI-SNVBAGLBSA-N 1 0 253.773 3.885 20 10 CHCDRO CSC1CC[NH+](Cc2cc3ccccc3cc2O)CC1 ZINC001236840127 1131021944 /nfs/dbraw/zinc/02/19/44/1131021944.db2.gz HSPWXQWHEVCEMX-UHFFFAOYSA-N 1 0 287.428 3.873 20 10 CHCDRO CC(C)c1ccc(C[NH+]2CCC3(CC3)CC2)c(O)c1 ZINC001237045978 1131039481 /nfs/dbraw/zinc/03/94/81/1131039481.db2.gz OCDUJNUZNYVZRA-UHFFFAOYSA-N 1 0 259.393 3.892 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CCC[C@@H](C)[C@@H](C)C2)c(O)c1 ZINC001237049445 1131039593 /nfs/dbraw/zinc/03/95/93/1131039593.db2.gz FUBSUEJEONLPCZ-KGLIPLIRSA-N 1 0 277.408 3.659 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CCC23CCCCC3)c(O)c1 ZINC001237049483 1131039928 /nfs/dbraw/zinc/03/99/28/1131039928.db2.gz GTABYESFGOYNIM-UHFFFAOYSA-N 1 0 275.392 3.700 20 10 CHCDRO CC(C)c1ccc(C[NH+]2CC(c3cccnc3)C2)c(O)c1 ZINC001237050088 1131039985 /nfs/dbraw/zinc/03/99/85/1131039985.db2.gz XQVCGEVBLOIAKL-UHFFFAOYSA-N 1 0 282.387 3.510 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CCCC[C@@](C)(F)C2)c(O)c1 ZINC001237050741 1131040583 /nfs/dbraw/zinc/04/05/83/1131040583.db2.gz WPUFTBYEAFBIFM-MRXNPFEDSA-N 1 0 281.371 3.505 20 10 CHCDRO CC(C)c1ccc(C[N@@H+]2CC[C@H]3CCCO[C@H]3C2)c(O)c1 ZINC001237051949 1131042200 /nfs/dbraw/zinc/04/22/00/1131042200.db2.gz PNSBNGDZCXIBFF-KDOFPFPSSA-N 1 0 289.419 3.517 20 10 CHCDRO CC(C)[NH+](Cc1c(O)cccc1OC(F)(F)F)C(C)C ZINC001237119023 1131052267 /nfs/dbraw/zinc/05/22/67/1131052267.db2.gz COTXJAQAXPIHPF-UHFFFAOYSA-N 1 0 291.313 3.910 20 10 CHCDRO CCOc1cccc(C[N@H+](C)[C@@H]2CCC[C@@H](C)C2)c1O ZINC000217802426 1131057117 /nfs/dbraw/zinc/05/71/17/1131057117.db2.gz ZMLPMQOHLDRREK-UKRRQHHQSA-N 1 0 277.408 3.801 20 10 CHCDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]C1CCSCC1 ZINC000168831746 1131072622 /nfs/dbraw/zinc/07/26/22/1131072622.db2.gz AUTWYWRTZXJOPR-WCQYABFASA-N 1 0 277.433 3.734 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@@H+](C)Cc2cnc(C(C)C)nc2)c1 ZINC000799579072 1131094992 /nfs/dbraw/zinc/09/49/92/1131094992.db2.gz FEWSXBNCGNVQMN-UHFFFAOYSA-N 1 0 299.418 3.554 20 10 CHCDRO C[N@H+](CCOC(C)(C)C)Cc1ccc2ccccc2c1O ZINC000816516526 1131103322 /nfs/dbraw/zinc/10/33/22/1131103322.db2.gz ILLKSRASJJJKLS-UHFFFAOYSA-N 1 0 287.403 3.792 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+](C)[C@H]1CCc2ccccc21 ZINC001237492998 1131103336 /nfs/dbraw/zinc/10/33/36/1131103336.db2.gz YXJUYEICLWRNIG-KRWDZBQOSA-N 1 0 267.372 3.820 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+]1CCC[C@H]2CCCC[C@@H]21 ZINC001237487774 1131104044 /nfs/dbraw/zinc/10/40/44/1131104044.db2.gz MXYDMWRCFWLGKN-ZBFHGGJFSA-N 1 0 259.393 3.855 20 10 CHCDRO Cc1cccc(O)c1C[N@H+]1CC=C(c2ccccc2)CC1 ZINC001237488388 1131104224 /nfs/dbraw/zinc/10/42/24/1131104224.db2.gz WDYSCZOBCJWGBY-UHFFFAOYSA-N 1 0 279.383 3.990 20 10 CHCDRO COc1ccc2c(c1)C[N@@H+](Cc1c(C)cccc1O)CCC2 ZINC001237490823 1131104406 /nfs/dbraw/zinc/10/44/06/1131104406.db2.gz BZZRBVSXGWEEKR-UHFFFAOYSA-N 1 0 297.398 3.658 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+]1CC[C@@H](c2cccc(F)c2)C1 ZINC001237486683 1131104417 /nfs/dbraw/zinc/10/44/17/1131104417.db2.gz BLENNIGVFXBISO-OAHLLOKOSA-N 1 0 285.362 3.829 20 10 CHCDRO COc1ccccc1[C@H](C)[N@H+](C)Cc1c(C)cccc1O ZINC001237488154 1131104643 /nfs/dbraw/zinc/10/46/43/1131104643.db2.gz RVYSWLFJRRWBEA-AWEZNQCLSA-N 1 0 285.387 3.902 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+]1CC[C@@H](Cc2ccccc2)C1 ZINC001237490641 1131105108 /nfs/dbraw/zinc/10/51/08/1131105108.db2.gz YNOPNAOEMGDVNV-KRWDZBQOSA-N 1 0 281.399 3.765 20 10 CHCDRO Oc1c(C[NH2+]CCCC2CC2)ccc2ccccc21 ZINC000816552496 1131105224 /nfs/dbraw/zinc/10/52/24/1131105224.db2.gz NZBXDVQTMGGNSS-UHFFFAOYSA-N 1 0 255.361 3.825 20 10 CHCDRO Cc1cccc(O)c1C[NH+]1CCC(c2cccc(O)c2)CC1 ZINC001237494159 1131105331 /nfs/dbraw/zinc/10/53/31/1131105331.db2.gz FMVBULOPWDPLNN-UHFFFAOYSA-N 1 0 297.398 3.786 20 10 CHCDRO Cc1csc(C[NH2+]Cc2ccc3ccccc3c2O)n1 ZINC000816533410 1131105723 /nfs/dbraw/zinc/10/57/23/1131105723.db2.gz VFPXHQKNTDANPP-UHFFFAOYSA-N 1 0 284.384 3.600 20 10 CHCDRO CC[N@H+](CCc1ccc(OC)cc1)Cc1c(C)cccc1O ZINC001237494362 1131105844 /nfs/dbraw/zinc/10/58/44/1131105844.db2.gz HPONMNGEKOPUDN-UHFFFAOYSA-N 1 0 299.414 3.774 20 10 CHCDRO CC1=CC[C@@H]([NH2+]CCCSc2nccs2)CC1 ZINC000816553176 1131109559 /nfs/dbraw/zinc/10/95/59/1131109559.db2.gz LPVCIAZQNBPYBR-GFCCVEGCSA-N 1 0 268.451 3.714 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2ccc3ccccc3c2O)C[C@H](C2CC2)O1 ZINC000816594517 1131109602 /nfs/dbraw/zinc/10/96/02/1131109602.db2.gz HBVIFPMINIQMRZ-FZKQIMNGSA-N 1 0 297.398 3.545 20 10 CHCDRO Cc1nc(C)c(C[NH2+]Cc2ccc3ccccc3c2O)s1 ZINC000816554238 1131110222 /nfs/dbraw/zinc/11/02/22/1131110222.db2.gz SHRRYWFLYAFNPH-UHFFFAOYSA-N 1 0 298.411 3.909 20 10 CHCDRO Oc1c(C[NH2+][C@H]2CCOC3(CCC3)C2)ccc2ccccc21 ZINC000816556262 1131110342 /nfs/dbraw/zinc/11/03/42/1131110342.db2.gz DUJNCKJSIRYNGJ-INIZCTEOSA-N 1 0 297.398 3.737 20 10 CHCDRO Cc1cc(C)[nH+]c(NCc2cc(Cl)c(F)cc2O)c1 ZINC000816558012 1131111832 /nfs/dbraw/zinc/11/18/32/1131111832.db2.gz JQRUTECRBVUJLC-UHFFFAOYSA-N 1 0 280.730 3.809 20 10 CHCDRO Oc1c(C[NH2+]CCC[C@@H]2CCCCO2)ccc2ccccc21 ZINC000816569884 1131112474 /nfs/dbraw/zinc/11/24/74/1131112474.db2.gz ZQROIQRCYPSNLV-KRWDZBQOSA-N 1 0 299.414 3.984 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CC(C)(C)[C@@H]2C(C)C)c1 ZINC000816624647 1131112950 /nfs/dbraw/zinc/11/29/50/1131112950.db2.gz BYRGKXNISTZLRZ-INIZCTEOSA-N 1 0 277.408 3.657 20 10 CHCDRO Oc1c(C[NH2+][C@H]2CCO[C@H](C3CC3)C2)ccc2ccccc21 ZINC000816570131 1131113421 /nfs/dbraw/zinc/11/34/21/1131113421.db2.gz JSWFFEBIFZIVDJ-WMZOPIPTSA-N 1 0 297.398 3.593 20 10 CHCDRO CCc1nocc1C[N@H+](C)Cc1ccc2ccccc2c1O ZINC000816652521 1131120964 /nfs/dbraw/zinc/12/09/64/1131120964.db2.gz MQFZLQGULXVJBH-UHFFFAOYSA-N 1 0 296.370 3.728 20 10 CHCDRO Cc1cc(Cl)cc(C[NH+]2C[C@H](C)C[C@@H](C)C2)c1O ZINC001237685192 1131126564 /nfs/dbraw/zinc/12/65/64/1131126564.db2.gz FILWSDHKHHQZEK-GHMZBOCLSA-N 1 0 267.800 3.832 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](C)C2CCCC2)cc1Br ZINC001237678758 1131126781 /nfs/dbraw/zinc/12/67/81/1131126781.db2.gz MAAMODUZVDJYTH-UHFFFAOYSA-N 1 0 298.224 3.838 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@H](C(F)F)C2)c1O ZINC001237685077 1131127494 /nfs/dbraw/zinc/12/74/94/1131127494.db2.gz DWFPYGXKBYCYQG-SNVBAGLBSA-N 1 0 289.753 3.831 20 10 CHCDRO CCC[N@H+](Cc1cc(Cl)cc(C)c1O)C1CCOCC1 ZINC001237688268 1131128838 /nfs/dbraw/zinc/12/88/38/1131128838.db2.gz HCPPIRNLCBPHSU-UHFFFAOYSA-N 1 0 297.826 3.745 20 10 CHCDRO FC(F)C1CC[NH+](Cc2ccc(N3CCCC3)cc2)CC1 ZINC001116444157 1131147083 /nfs/dbraw/zinc/14/70/83/1131147083.db2.gz STECKRACBADPAH-UHFFFAOYSA-N 1 0 294.389 3.764 20 10 CHCDRO C[C@@H](c1cccnc1)[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001116590487 1131155857 /nfs/dbraw/zinc/15/58/57/1131155857.db2.gz WMGLNVJVLPJLHZ-INIZCTEOSA-N 1 0 295.430 3.875 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1CC12CCSCC2)c1ccccc1O ZINC000817411263 1131160840 /nfs/dbraw/zinc/16/08/40/1131160840.db2.gz QMKHAAAPJBQRQB-DZGCQCFKSA-N 1 0 291.460 3.966 20 10 CHCDRO CC[C@@H]1C[C@H]([NH2+]Cc2ccc3ccccc3c2O)CCO1 ZINC000817415770 1131160933 /nfs/dbraw/zinc/16/09/33/1131160933.db2.gz YPTWIOPPXNGZQZ-HZPDHXFCSA-N 1 0 285.387 3.593 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(C)nc(C)c1)c1ccccc1O ZINC000817410347 1131160966 /nfs/dbraw/zinc/16/09/66/1131160966.db2.gz LTAPFEFXZNIEHZ-INIZCTEOSA-N 1 0 270.376 3.645 20 10 CHCDRO Cc1ccc2c(c1)CC[N@@H+](Cc1cc(F)cc(C)c1O)C2 ZINC001238066649 1131166218 /nfs/dbraw/zinc/16/62/18/1131166218.db2.gz NLFCOUXAAAKERJ-UHFFFAOYSA-N 1 0 285.362 3.706 20 10 CHCDRO Cc1cc(F)cc(C[N@@H+]2CCC[C@H](C(F)(F)F)C2)c1O ZINC001238063580 1131167004 /nfs/dbraw/zinc/16/70/04/1131167004.db2.gz YZNKUNZIBIYURX-NSHDSACASA-N 1 0 291.288 3.614 20 10 CHCDRO Cc1cc(F)cc(C[NH+]2CCC(C(C)C)CC2)c1O ZINC001238070734 1131168407 /nfs/dbraw/zinc/16/84/07/1131168407.db2.gz OREAXZUCZANTDZ-UHFFFAOYSA-N 1 0 265.372 3.708 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2cc(C)nc(C)c2)c1 ZINC000817588677 1131175257 /nfs/dbraw/zinc/17/52/57/1131175257.db2.gz IKGHQRAOKZTNFD-CQSZACIVSA-N 1 0 270.376 3.563 20 10 CHCDRO C[C@H](CCC(C)(C)C)[NH2+]C[C@@H](N)c1ccc(N(C)C)cc1 ZINC000817943900 1131187747 /nfs/dbraw/zinc/18/77/47/1131187747.db2.gz WMASLHBETVJXLO-RHSMWYFYSA-N 1 0 291.483 3.557 20 10 CHCDRO C[C@H]1C[C@H]([NH2+]CCc2ccc(N)cc2)c2ccccc21 ZINC000817956702 1131190258 /nfs/dbraw/zinc/19/02/58/1131190258.db2.gz AVNKKXTUIYOJDG-UGSOOPFHSA-N 1 0 266.388 3.649 20 10 CHCDRO CCOc1ccccc1[C@@H](C)[NH2+]CCc1ccc(N)cc1 ZINC000817955761 1131190278 /nfs/dbraw/zinc/19/02/78/1131190278.db2.gz HCTKKUBDEJZFAZ-CQSZACIVSA-N 1 0 284.403 3.561 20 10 CHCDRO CC(C)c1ccc([C@@H](N)C[NH2+][C@H](C)c2ccccc2O)cc1 ZINC000817953403 1131190292 /nfs/dbraw/zinc/19/02/92/1131190292.db2.gz MXSDVMPWIABDOC-KDOFPFPSSA-N 1 0 298.430 3.866 20 10 CHCDRO CCc1ccc([C@@H](C)[NH2+]CCc2ccc(N)cc2)cc1 ZINC000817956013 1131190459 /nfs/dbraw/zinc/19/04/59/1131190459.db2.gz NOUQOQJXPYSEIX-CQSZACIVSA-N 1 0 268.404 3.725 20 10 CHCDRO Nc1ccc(CC[NH2+][C@@H]2CC[C@H]3CCCC[C@@H]3C2)cc1 ZINC000817955887 1131190555 /nfs/dbraw/zinc/19/05/55/1131190555.db2.gz KEJVTIDELLVKIC-JFIYKMOQSA-N 1 0 272.436 3.760 20 10 CHCDRO Nc1ccc(CC[NH2+][C@@H]2CC[C@H](c3ccccc3)C2)cc1 ZINC000817958774 1131190983 /nfs/dbraw/zinc/19/09/83/1131190983.db2.gz YDCGOZYLOCROPV-PKOBYXMFSA-N 1 0 280.415 3.737 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccc(N)cc1)C1CCCCCC1 ZINC000817958861 1131191245 /nfs/dbraw/zinc/19/12/45/1131191245.db2.gz ZYYSRWQUKPUAAD-CQSZACIVSA-N 1 0 260.425 3.760 20 10 CHCDRO Cc1ccc2c(c1)[C@@H]([NH2+]CCc1ccc(N)cc1)[C@H](C)C2 ZINC000817958527 1131191281 /nfs/dbraw/zinc/19/12/81/1131191281.db2.gz WRPYGDGZZADKQW-KUHUBIRLSA-N 1 0 280.415 3.643 20 10 CHCDRO Nc1ccc(CC[NH2+][C@H]2CCc3c2cccc3Cl)cc1 ZINC000817956242 1131191327 /nfs/dbraw/zinc/19/13/27/1131191327.db2.gz USHWKOOQROPQEV-KRWDZBQOSA-N 1 0 286.806 3.742 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccc(N)cc1)c1ccsc1 ZINC000817958787 1131191366 /nfs/dbraw/zinc/19/13/66/1131191366.db2.gz YHJVNSYZRNQWIL-OAHLLOKOSA-N 1 0 260.406 3.614 20 10 CHCDRO Cc1ccc2c(c1)[C@@H]([NH2+]CCc1ccc(N)cc1)[C@@H](C)C2 ZINC000817958528 1131191368 /nfs/dbraw/zinc/19/13/68/1131191368.db2.gz WRPYGDGZZADKQW-LIRRHRJNSA-N 1 0 280.415 3.643 20 10 CHCDRO Nc1ccc(CC[NH2+][C@H]2CCCC23CCCCC3)cc1 ZINC000817956987 1131191463 /nfs/dbraw/zinc/19/14/63/1131191463.db2.gz GXUBZLLJAPTVCE-KRWDZBQOSA-N 1 0 272.436 3.904 20 10 CHCDRO Nc1ccc(CC[NH2+][C@@H]2CCC[C@H](c3cccnc3)C2)cc1 ZINC000817958763 1131191571 /nfs/dbraw/zinc/19/15/71/1131191571.db2.gz YAFPHZATFPHZES-QFBILLFUSA-N 1 0 295.430 3.522 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCCC[C@H]1C[NH3+])c1cccc(Cl)c1[O-] ZINC000817960641 1131193043 /nfs/dbraw/zinc/19/30/43/1131193043.db2.gz ONGWKWJENMMPBO-CQDKDKBSSA-N 1 0 296.842 3.604 20 10 CHCDRO Nc1ccc2c(c1)CCC[C@H]2[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000817967376 1131193970 /nfs/dbraw/zinc/19/39/70/1131193970.db2.gz GVHNMQCJERUMPH-IAGOWNOFSA-N 1 0 294.398 3.629 20 10 CHCDRO C[C@H]([NH2+][C@H](CN)C1CCCC1)c1ccc2ccccc2c1O ZINC000817981189 1131195664 /nfs/dbraw/zinc/19/56/64/1131195664.db2.gz HAIMYTFRIHNNFY-SCLBCKFNSA-N 1 0 298.430 3.714 20 10 CHCDRO CCC[C@@H](C)C[NH2+]C[C@@H]1CCN(c2ccc(OC)cc2)C1 ZINC000818221057 1131206048 /nfs/dbraw/zinc/20/60/48/1131206048.db2.gz KVZDKGMHQCVOAB-CVEARBPZSA-N 1 0 290.451 3.547 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1CCN(c2ccc(OC)cc2)C1)C(C)C ZINC000818345424 1131209560 /nfs/dbraw/zinc/20/95/60/1131209560.db2.gz UOVYLWLZBFIJBA-CRAIPNDOSA-N 1 0 290.451 3.546 20 10 CHCDRO Cc1ccc(Cl)c(C[N@H+](C)Cc2ccccc2O)c1 ZINC001238568181 1131218307 /nfs/dbraw/zinc/21/83/07/1131218307.db2.gz CWXHBIVOTRUEOF-UHFFFAOYSA-N 1 0 275.779 3.986 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CC[C@H]3[C@@H](C2)C3(F)F)c(O)c1 ZINC001118489356 1131228705 /nfs/dbraw/zinc/22/87/05/1131228705.db2.gz JYZUJZPELRTVLL-UZGDPCLZSA-N 1 0 281.346 3.785 20 10 CHCDRO CC[N@H+](Cc1ccc(OC)cc1)Cc1c([O-])cccc1F ZINC001137840327 1131421661 /nfs/dbraw/zinc/42/16/61/1131421661.db2.gz XOHFXHNDNGLDRR-UHFFFAOYSA-N 1 0 289.350 3.562 20 10 CHCDRO C[N@H+](Cc1c([O-])cccc1F)C(C)(C)Cc1ccccc1 ZINC001137840227 1131421674 /nfs/dbraw/zinc/42/16/74/1131421674.db2.gz UBNJPTKFLLQMCM-UHFFFAOYSA-N 1 0 287.378 3.984 20 10 CHCDRO CCOc1ccc(C[NH2+]C[C@H]2CCCCC2(F)F)c(O)c1 ZINC000824544371 1131475452 /nfs/dbraw/zinc/47/54/52/1131475452.db2.gz VZYNKRUJGJYCLJ-CYBMUJFWSA-N 1 0 299.361 3.706 20 10 CHCDRO Cc1c(C[NH+]2C[C@@H]3CCC[C@H]3C2)c2ccccc2n1C ZINC001138252863 1131482269 /nfs/dbraw/zinc/48/22/69/1131482269.db2.gz XBLCNRRCEGWOPG-GJZGRUSLSA-N 1 0 268.404 3.719 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@@]2(C)CC2(Cl)Cl)cc1C ZINC000824765917 1131482738 /nfs/dbraw/zinc/48/27/38/1131482738.db2.gz RHSASBWWLRMOLA-CYBMUJFWSA-N 1 0 288.218 3.683 20 10 CHCDRO Cc1c(C[N@@H+]2CCC[C@@H](C(F)F)C2)c2ccccc2n1C ZINC001138256974 1131483023 /nfs/dbraw/zinc/48/30/23/1131483023.db2.gz QXZIOGSUHMDDSN-CYBMUJFWSA-N 1 0 292.373 3.964 20 10 CHCDRO Cc1c(C[N@H+](C)Cc2ccc(C)nc2)c2ccccc2n1C ZINC001138260202 1131483086 /nfs/dbraw/zinc/48/30/86/1131483086.db2.gz YOSBZZVSVGUQIE-UHFFFAOYSA-N 1 0 293.414 3.822 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1CCOC2(CCC2)C1)c1ccccc1O ZINC000824750795 1131484216 /nfs/dbraw/zinc/48/42/16/1131484216.db2.gz PEXHFHLEFQIDMR-GDBMZVCRSA-N 1 0 289.419 3.782 20 10 CHCDRO CCOCc1cc(C[NH2+]C(C)(C)C2CCC2)ccc1OC ZINC000824878365 1131488981 /nfs/dbraw/zinc/48/89/81/1131488981.db2.gz QHFGMBKTAOXUHQ-UHFFFAOYSA-N 1 0 291.435 3.900 20 10 CHCDRO CN1CCCc2cc(C[N@H+](C)Cc3ccccc3F)ccc21 ZINC001138357508 1131493525 /nfs/dbraw/zinc/49/35/25/1131493525.db2.gz HHPYIHFNQKRQHB-UHFFFAOYSA-N 1 0 298.405 3.840 20 10 CHCDRO CN1CCCc2cc(C[NH+]3CC4CCC(CC4)C3)ccc21 ZINC001138356346 1131494007 /nfs/dbraw/zinc/49/40/07/1131494007.db2.gz LQLMHLIYHGARSJ-UHFFFAOYSA-N 1 0 284.447 3.691 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]C1(Cc2ccc(F)cc2)CC1 ZINC000825017424 1131494676 /nfs/dbraw/zinc/49/46/76/1131494676.db2.gz RCBGXCRRKKOHPJ-UHFFFAOYSA-N 1 0 289.325 3.535 20 10 CHCDRO Cc1c2ccccc2[nH]c1C[N@@H+]1CCc2cccc(O)c2C1 ZINC001138399814 1131498214 /nfs/dbraw/zinc/49/82/14/1131498214.db2.gz JIZWIFFPHDUSKI-UHFFFAOYSA-N 1 0 292.382 3.740 20 10 CHCDRO CC1(C)C[C@H](O)CC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC000825090709 1131498602 /nfs/dbraw/zinc/49/86/02/1131498602.db2.gz FKHSJRJXBJSYLK-MRXNPFEDSA-N 1 0 299.414 3.528 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H]2CCOC3(CCC3)C2)cc1Cl ZINC000825341283 1131507033 /nfs/dbraw/zinc/50/70/33/1131507033.db2.gz FTIJEEHCFLWWBL-ZDUSSCGKSA-N 1 0 295.810 3.545 20 10 CHCDRO COc1cccc(C[N@H+](C(C)C)C2CC(C)(C)C2)c1O ZINC000825331809 1131507071 /nfs/dbraw/zinc/50/70/71/1131507071.db2.gz NQQWQYMSMUZINO-UHFFFAOYSA-N 1 0 277.408 3.800 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H]2CCO[C@H](C(C)C)C2)cc1Cl ZINC000825406794 1131511024 /nfs/dbraw/zinc/51/10/24/1131511024.db2.gz YZNRRCVCYWKMOB-CJNGLKHVSA-N 1 0 297.826 3.647 20 10 CHCDRO CCCC[N@H+](CCC)Cc1ccc(N2CCOCC2)cc1 ZINC001138498259 1131513427 /nfs/dbraw/zinc/51/34/27/1131513427.db2.gz XIBRQSOKMZEMEZ-UHFFFAOYSA-N 1 0 290.451 3.535 20 10 CHCDRO CCCOc1ccccc1C[N@@H+]1CCc2cccc(O)c2C1 ZINC001138998184 1131569806 /nfs/dbraw/zinc/56/98/06/1131569806.db2.gz GZDPOLANGJPWAA-UHFFFAOYSA-N 1 0 297.398 3.739 20 10 CHCDRO Oc1cc2c(cc1C[N@@H+]1CC[C@@]3(CC3(F)F)C1)CCCC2 ZINC000844756272 1131595905 /nfs/dbraw/zinc/59/59/05/1131595905.db2.gz JPQLHOBKMXPEPK-MRXNPFEDSA-N 1 0 293.357 3.502 20 10 CHCDRO CCCOc1ccc(C[NH2+][C@@H](CO)C[C@H](C)CC)cc1C ZINC001202922906 1131602696 /nfs/dbraw/zinc/60/26/96/1131602696.db2.gz VFHURSQBJGDPTP-RHSMWYFYSA-N 1 0 293.451 3.671 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CNc2ccccc2C1)c1ccc(C)cc1O ZINC000844921626 1131608387 /nfs/dbraw/zinc/60/83/87/1131608387.db2.gz QQXSGPPSTGKUPS-RDJZCZTQSA-N 1 0 296.414 3.778 20 10 CHCDRO Cc1cc(C[N@H+](C)C[C@H]2CC2(C)C)ccc1N(C)C ZINC001139672978 1131628160 /nfs/dbraw/zinc/62/81/60/1131628160.db2.gz MGUDZHFKSPKFNV-OAHLLOKOSA-N 1 0 260.425 3.539 20 10 CHCDRO COc1ccc2c(c1)C[N@@H+](Cc1c(C)ccc(C)c1O)C2 ZINC001140182498 1131673078 /nfs/dbraw/zinc/67/30/78/1131673078.db2.gz SOTFZAVFYKNPGO-UHFFFAOYSA-N 1 0 283.371 3.533 20 10 CHCDRO Cc1ccc(C)c(C[N@H+]2CCC[C@H](C)[C@@H](C)C2)c1O ZINC001140178698 1131673194 /nfs/dbraw/zinc/67/31/94/1131673194.db2.gz VBIJPIQVIMKICQ-WFASDCNBSA-N 1 0 261.409 3.877 20 10 CHCDRO Cc1ccc(C)c(C[N@H+]2CCC[C@H](C)[C@H](C)C2)c1O ZINC001140178697 1131673424 /nfs/dbraw/zinc/67/34/24/1131673424.db2.gz VBIJPIQVIMKICQ-SWLSCSKDSA-N 1 0 261.409 3.877 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCC(F)(F)C(C)(C)C2)c1O ZINC001140178290 1131673568 /nfs/dbraw/zinc/67/35/68/1131673568.db2.gz HDBHFSMZYIOMFX-UHFFFAOYSA-N 1 0 283.362 3.876 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCCC23CCC3)c1 ZINC000845970676 1131673782 /nfs/dbraw/zinc/67/37/82/1131673782.db2.gz BMIKBCHLVOOPMD-MLGOLLRUSA-N 1 0 275.392 3.774 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCCC3(CCC3)C2)c1O ZINC001140184776 1131674653 /nfs/dbraw/zinc/67/46/53/1131674653.db2.gz HYRHANYAFXCPAP-UHFFFAOYSA-N 1 0 259.393 3.775 20 10 CHCDRO Cc1ccc(C)c(C[N@H+](C)CCc2ccccc2F)c1O ZINC001140185027 1131674659 /nfs/dbraw/zinc/67/46/59/1131674659.db2.gz ONNQCCGDWHBBPV-UHFFFAOYSA-N 1 0 287.378 3.823 20 10 CHCDRO C[C@H](CCC(F)(F)F)[NH2+]Cc1cc(Cl)ccc1O ZINC000846056282 1131679345 /nfs/dbraw/zinc/67/93/45/1131679345.db2.gz SMDJEIDINBEURU-MRVPVSSYSA-N 1 0 281.705 3.866 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]CC1(c3ccccc3)CC1)CC2 ZINC000834501823 1131681038 /nfs/dbraw/zinc/68/10/38/1131681038.db2.gz KBURDYXUFHWWJH-INIZCTEOSA-N 1 0 279.383 3.701 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccncc1 ZINC000834549240 1131682743 /nfs/dbraw/zinc/68/27/43/1131682743.db2.gz ZMPQBEKPAXWVHG-SFHVURJKSA-N 1 0 295.430 3.705 20 10 CHCDRO C[C@]1(CC[NH2+]Cc2c(O)cccc2Cl)C[C@@]1(F)Cl ZINC000846040650 1131683294 /nfs/dbraw/zinc/68/32/94/1131683294.db2.gz XPPWBKNUBHGGIK-STQMWFEESA-N 1 0 292.181 3.840 20 10 CHCDRO CCC[C@H]([NH2+][C@H]1CCc2cccc(O)c21)c1ccccn1 ZINC000834566959 1131684215 /nfs/dbraw/zinc/68/42/15/1131684215.db2.gz WBHNYAPSQBTTAK-HOTGVXAUSA-N 1 0 282.387 3.906 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH+]1CCC2(CC2(F)F)CC1 ZINC000846054822 1131685302 /nfs/dbraw/zinc/68/53/02/1131685302.db2.gz QLVPHZGFKXKFQL-UHFFFAOYSA-N 1 0 287.737 3.667 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]Cc1cccc2c1CCC2 ZINC000846055272 1131685493 /nfs/dbraw/zinc/68/54/93/1131685493.db2.gz KKXAFLYJPJESAT-UHFFFAOYSA-N 1 0 287.790 3.824 20 10 CHCDRO CC(C)c1cnc(C[NH2+]Cc2cc(Cl)ccc2O)s1 ZINC000846054796 1131685564 /nfs/dbraw/zinc/68/55/64/1131685564.db2.gz GDZGKAUTCKRKRF-UHFFFAOYSA-N 1 0 296.823 3.915 20 10 CHCDRO COc1cccc(C[C@H](C)[NH2+][C@@H]2CCc3cccc(O)c32)c1 ZINC000834646016 1131690156 /nfs/dbraw/zinc/69/01/56/1131690156.db2.gz UEMHDZJZBNLVBQ-SUMWQHHRSA-N 1 0 297.398 3.609 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]Cc2c(C)cccc2C)c1O ZINC000846155880 1131692062 /nfs/dbraw/zinc/69/20/62/1131692062.db2.gz YYKFHYCXUMLDOU-CQSZACIVSA-N 1 0 285.387 3.868 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CCCc2cccs2)c1O ZINC000846160478 1131693196 /nfs/dbraw/zinc/69/31/96/1131693196.db2.gz XCHZIIJNBSPXPH-GFCCVEGCSA-N 1 0 291.416 3.746 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H]2CCc3ccccc3C2)c1O ZINC000846135474 1131693625 /nfs/dbraw/zinc/69/36/25/1131693625.db2.gz CUCDQLPDSOVNNM-XJKSGUPXSA-N 1 0 297.398 3.609 20 10 CHCDRO CCCCCC[NH2+][C@H](C)c1cccc(OC)c1O ZINC000846138563 1131693885 /nfs/dbraw/zinc/69/38/85/1131693885.db2.gz WIIZLOIDQVISCJ-GFCCVEGCSA-N 1 0 251.370 3.632 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]C[C@@H](C)c2ccccc2)c1O ZINC000846138120 1131693989 /nfs/dbraw/zinc/69/39/89/1131693989.db2.gz SVLJNGBWSDTGJY-KGLIPLIRSA-N 1 0 285.387 3.855 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H]2CCCc3occc32)c1O ZINC000846138245 1131694106 /nfs/dbraw/zinc/69/41/06/1131694106.db2.gz AGCBNDXIWOHFDT-FZMZJTMJSA-N 1 0 287.359 3.722 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@H](c1cccnc1)C1CC1)CC2 ZINC000834693479 1131694162 /nfs/dbraw/zinc/69/41/62/1131694162.db2.gz OWSOUMZZFFBLED-YJBOKZPZSA-N 1 0 280.371 3.515 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]CCCc1cccs1)CC2 ZINC000834698448 1131694281 /nfs/dbraw/zinc/69/42/81/1131694281.db2.gz ZPSZCBOZHXXOAU-CQSZACIVSA-N 1 0 273.401 3.663 20 10 CHCDRO CCOc1cccc(CC[NH2+][C@H]2CCc3cccc(O)c32)c1 ZINC000834688672 1131694486 /nfs/dbraw/zinc/69/44/86/1131694486.db2.gz DBAQGLYQCYMPTJ-KRWDZBQOSA-N 1 0 297.398 3.611 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H]2CCC[C@H](C)C2)c1O ZINC000846141836 1131694609 /nfs/dbraw/zinc/69/46/09/1131694609.db2.gz AKBASQLMMAJAIG-RWMBFGLXSA-N 1 0 263.381 3.630 20 10 CHCDRO CCc1ccccc1C[NH2+][C@H](C)c1cccc(OC)c1O ZINC000846142815 1131695183 /nfs/dbraw/zinc/69/51/83/1131695183.db2.gz CVBMPHXTBQZZGD-CYBMUJFWSA-N 1 0 285.387 3.814 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)COCC1CC1)c1ccc(C)cc1O ZINC000846206212 1131695844 /nfs/dbraw/zinc/69/58/44/1131695844.db2.gz XPYFCHSLIYCXFD-BBRMVZONSA-N 1 0 277.408 3.556 20 10 CHCDRO C[C@]1(CC[NH2+][C@H]2CCc3cccc(O)c32)C[C@]1(F)Cl ZINC000846184290 1131697728 /nfs/dbraw/zinc/69/77/28/1131697728.db2.gz JLMWVOXKMZKOTB-TUKIKUTGSA-N 1 0 283.774 3.674 20 10 CHCDRO C[C@H]([NH2+]CC[C@@]1(C)C[C@]1(F)Cl)c1cc(F)ccc1O ZINC000846185230 1131697807 /nfs/dbraw/zinc/69/78/07/1131697807.db2.gz RESCNIYONLGIMF-QCZZGDTMSA-N 1 0 289.753 3.887 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)COCC1CC1)c1ccc(N(C)C)cc1 ZINC000846202395 1131699755 /nfs/dbraw/zinc/69/97/55/1131699755.db2.gz CHLVUHNYCYCSCA-KDOFPFPSSA-N 1 0 290.451 3.608 20 10 CHCDRO CO[C@@H]1CCCC[C@H]1[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000846200623 1131700018 /nfs/dbraw/zinc/70/00/18/1131700018.db2.gz GOWSUFYEIJDJSZ-QMPIGLIWSA-N 1 0 293.382 3.627 20 10 CHCDRO CC[C@H](CC(F)(F)F)[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000834765448 1131703124 /nfs/dbraw/zinc/70/31/24/1131703124.db2.gz MJKRQBOTBZWNRI-GHMZBOCLSA-N 1 0 273.298 3.700 20 10 CHCDRO CC(C)C[C@@H]1OCCC[C@@H]1[NH2+][C@H]1CCc2cccc(O)c21 ZINC000834769405 1131704783 /nfs/dbraw/zinc/70/47/83/1131704783.db2.gz MPQVSGIBSZBBTC-ZOBUZTSGSA-N 1 0 289.419 3.563 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CCCC2CCOCC2)c(O)c1 ZINC000834819322 1131707355 /nfs/dbraw/zinc/70/73/55/1131707355.db2.gz UNUVXEWBAZNYJV-OAHLLOKOSA-N 1 0 291.435 3.866 20 10 CHCDRO CO[C@@H](C[NH2+][C@@H](C)c1ccc(C)cc1O)Cc1ccccc1 ZINC000834856646 1131713045 /nfs/dbraw/zinc/71/30/45/1131713045.db2.gz SVIPGLOHAGDMEO-DOTOQJQBSA-N 1 0 299.414 3.609 20 10 CHCDRO Cc1cc(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)ccn1 ZINC000834859571 1131713077 /nfs/dbraw/zinc/71/30/77/1131713077.db2.gz DMHHRQTWROEUOU-CQSZACIVSA-N 1 0 270.376 3.563 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCOC2(CCC2)C1)c1cc(F)ccc1O ZINC000834881801 1131717028 /nfs/dbraw/zinc/71/70/28/1131717028.db2.gz BHIHEXYMKJSEEJ-QWHCGFSZSA-N 1 0 293.382 3.531 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@](C)(CC)OC)c1ccc(C)cc1O ZINC000834883174 1131717443 /nfs/dbraw/zinc/71/74/43/1131717443.db2.gz ZQWUEEBDEVZVNO-GDBMZVCRSA-N 1 0 265.397 3.556 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCO[C@H](C(C)C)C2)c(O)c1 ZINC000834886213 1131718528 /nfs/dbraw/zinc/71/85/28/1131718528.db2.gz QXKSNJNGMKIPTJ-DAYGRLMNSA-N 1 0 291.435 3.802 20 10 CHCDRO Cc1ccncc1C[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000834887224 1131719379 /nfs/dbraw/zinc/71/93/79/1131719379.db2.gz QCZGDBMUERYQBT-SMDDNHRTSA-N 1 0 286.350 3.573 20 10 CHCDRO CCn1ccnc1[C@@H](C)[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000834896113 1131721779 /nfs/dbraw/zinc/72/17/79/1131721779.db2.gz UQDFVXSPCNFEHV-ZIAGYGMSSA-N 1 0 287.407 3.637 20 10 CHCDRO C[C@H]([NH2+]CCC[C@H]1CCOC1)c1cc(Cl)ccc1O ZINC000834906464 1131728826 /nfs/dbraw/zinc/72/88/26/1131728826.db2.gz WVTHKGQTZYJSEH-RYUDHWBXSA-N 1 0 283.799 3.513 20 10 CHCDRO CCO[C@@H]1CCC[C@H]1[NH2+][C@H](C)c1cc(Cl)cc(C)c1O ZINC000834911008 1131731775 /nfs/dbraw/zinc/73/17/75/1131731775.db2.gz HJGVVMUVAQNAAD-KCPJHIHWSA-N 1 0 297.826 3.962 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@H]2CC[C@@H](C)O2)c1O ZINC000834913940 1131732757 /nfs/dbraw/zinc/73/27/57/1131732757.db2.gz JNIAMEKCYDCKGT-NTZNESFSSA-N 1 0 283.799 3.572 20 10 CHCDRO CCO[C@@H]1CCC[C@H]1[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000834914826 1131733329 /nfs/dbraw/zinc/73/33/29/1131733329.db2.gz WRJBXAFMAFJKPM-QMPIGLIWSA-N 1 0 293.382 3.627 20 10 CHCDRO CCO[C@@H]1CCC[C@H]1[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000834914811 1131733787 /nfs/dbraw/zinc/73/37/87/1131733787.db2.gz WNXJWQVKBBVSGW-ZMSDIMECSA-N 1 0 277.408 3.699 20 10 CHCDRO Oc1cc(Cl)ccc1C[N@@H+]1CC[C@H]2CCC[C@@H]2C1 ZINC001140462208 1131748532 /nfs/dbraw/zinc/74/85/32/1131748532.db2.gz AKDOIHLNVAPKHL-VXGBXAGGSA-N 1 0 265.784 3.668 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]CC2(C3CC3)CC2)cc1 ZINC000835041765 1131762051 /nfs/dbraw/zinc/76/20/51/1131762051.db2.gz NJUNVIVRTJRSNM-ONEGZZNKSA-N 1 0 270.420 3.546 20 10 CHCDRO Cc1ccncc1[C@@H](C)[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC000835042206 1131762410 /nfs/dbraw/zinc/76/24/10/1131762410.db2.gz FBQIMIPXEBBQQN-SQRWCISFSA-N 1 0 295.430 3.820 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]CCCC(F)(F)F)cc1 ZINC000835039864 1131762621 /nfs/dbraw/zinc/76/26/21/1131762621.db2.gz LFWHRBMVWNQTNU-HWKANZROSA-N 1 0 286.341 3.698 20 10 CHCDRO C[C@H](CC(F)(F)F)[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC000835046741 1131764012 /nfs/dbraw/zinc/76/40/12/1131764012.db2.gz MLWLYDFLKPNBHR-ZYOFXKKJSA-N 1 0 286.341 3.696 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]CCCC(C)(F)F)cc1 ZINC000835053938 1131767298 /nfs/dbraw/zinc/76/72/98/1131767298.db2.gz GDPNMNXPESOYFP-GQCTYLIASA-N 1 0 282.378 3.791 20 10 CHCDRO Cc1c(O)ccc(C[NH+]2CCC3(CCCC3)CC2)c1O ZINC001140744234 1131905562 /nfs/dbraw/zinc/90/55/62/1131905562.db2.gz QAVUYFPGURVJRV-UHFFFAOYSA-N 1 0 275.392 3.562 20 10 CHCDRO Cc1c(O)ccc(C[N@H+](C)Cc2ccccc2Cl)c1O ZINC001140745991 1131905859 /nfs/dbraw/zinc/90/58/59/1131905859.db2.gz RQSNBJORIRGSTQ-UHFFFAOYSA-N 1 0 291.778 3.692 20 10 CHCDRO Cc1c(O)ccc(C[N@@H+]2CC[C@H](C3CCCCC3)C2)c1O ZINC001140749274 1131906334 /nfs/dbraw/zinc/90/63/34/1131906334.db2.gz UXQDCVVPXFDPSC-HNNXBMFYSA-N 1 0 289.419 3.808 20 10 CHCDRO Cc1c(O)ccc(C[N@@H+](C)C(C)(C)Cc2ccccc2)c1O ZINC001140747943 1131906647 /nfs/dbraw/zinc/90/66/47/1131906647.db2.gz ONQKCCCQSUGSAC-UHFFFAOYSA-N 1 0 299.414 3.859 20 10 CHCDRO CC[C@H]([NH2+][C@H](CO)CC(C)(C)C)c1ccc(N(C)C)cc1 ZINC000773076941 1131936463 /nfs/dbraw/zinc/93/64/63/1131936463.db2.gz PJEJCDHRNYVWOK-RDJZCZTQSA-N 1 0 292.467 3.590 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CC[C@H](C)C[C@H]2C)c(O)c1 ZINC001140856346 1131948974 /nfs/dbraw/zinc/94/89/74/1131948974.db2.gz YNPDZGGLYAEWFX-LSDHHAIUSA-N 1 0 290.451 3.859 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCc2c(F)cccc2C1)c1ccccc1O ZINC001171404103 1131970132 /nfs/dbraw/zinc/97/01/32/1131970132.db2.gz FPHQRZAMGKXTJS-GXTWGEPZSA-N 1 0 285.362 3.739 20 10 CHCDRO CC[C@@H]([NH2+]CCc1cccc(F)c1)c1ccccc1O ZINC000036778658 1131974915 /nfs/dbraw/zinc/97/49/15/1131974915.db2.gz ZZEDWCJCECLQBE-MRXNPFEDSA-N 1 0 273.351 3.815 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C2CC(c3ccccc3)C2)cc1 ZINC000036840535 1131977390 /nfs/dbraw/zinc/97/73/90/1131977390.db2.gz NTLPBGDEXJULAI-UHFFFAOYSA-N 1 0 280.415 3.788 20 10 CHCDRO C[C@@H](Cc1ccc(Cl)cc1)[NH2+]Cc1ccccc1O ZINC000036937509 1131983627 /nfs/dbraw/zinc/98/36/27/1131983627.db2.gz KHAVOQQFSYPDEZ-LBPRGKRZSA-N 1 0 275.779 3.766 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)Cc2ccco2)c(O)c1 ZINC000036993357 1131985904 /nfs/dbraw/zinc/98/59/04/1131985904.db2.gz MAGZFBCGIFBTTF-STQMWFEESA-N 1 0 259.349 3.575 20 10 CHCDRO CC[N@H+](Cc1c(O)cc(OC)cc1OC)C1CCCCC1 ZINC001141032221 1131988571 /nfs/dbraw/zinc/98/85/71/1131988571.db2.gz WMLCSCWMIJROSW-UHFFFAOYSA-N 1 0 293.407 3.564 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC[C@@H]2CCCS2)c(O)c1 ZINC000715698582 1131989975 /nfs/dbraw/zinc/98/99/75/1131989975.db2.gz SIZAHPNTWVGVAP-STQMWFEESA-N 1 0 265.422 3.637 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccns1)c1ccc(N(C)C)cc1 ZINC000715897687 1131994454 /nfs/dbraw/zinc/99/44/54/1131994454.db2.gz DAFCMDSWWVZZIF-NEPJUHHUSA-N 1 0 275.421 3.621 20 10 CHCDRO CCCC[N@H+](CCC)Cc1ccc2c(c1)OCCN2C ZINC001141143400 1132028480 /nfs/dbraw/zinc/02/84/80/1132028480.db2.gz XQISUIIQVQFFMV-UHFFFAOYSA-N 1 0 276.424 3.527 20 10 CHCDRO CC(C)(C)[N@H+](Cc1ccccc1)Cc1cc(O)ccc1O ZINC001141155730 1132029828 /nfs/dbraw/zinc/02/98/28/1132029828.db2.gz HVFSYANCTKTQAO-UHFFFAOYSA-N 1 0 285.387 3.899 20 10 CHCDRO Oc1ccc(O)c(C[N@@H+]2CC[C@@H](C3CCCCC3)C2)c1 ZINC001141161768 1132030764 /nfs/dbraw/zinc/03/07/64/1132030764.db2.gz XGOPWVYQDONKLH-CQSZACIVSA-N 1 0 275.392 3.500 20 10 CHCDRO CC(C)CC[NH+](CCC(C)C)Cc1cc(O)ccc1O ZINC001141162620 1132031800 /nfs/dbraw/zinc/03/18/00/1132031800.db2.gz XROMDDMJNQSLAN-UHFFFAOYSA-N 1 0 279.424 3.992 20 10 CHCDRO CCCCC1CC[NH+](Cc2cc(O)ccc2O)CC1 ZINC001141158178 1132031887 /nfs/dbraw/zinc/03/18/87/1132031887.db2.gz VLBBKJKDAXBFJM-UHFFFAOYSA-N 1 0 263.381 3.500 20 10 CHCDRO CC[C@@H]1CO[C@@H](CC)C[N@@H+]1Cc1ccc(N(C)CC)cc1 ZINC001171778858 1132095488 /nfs/dbraw/zinc/09/54/88/1132095488.db2.gz QULLHEQMNXDWPE-AEFFLSMTSA-N 1 0 290.451 3.532 20 10 CHCDRO CO[C@@H]1CC[N@H+](Cc2cc(Cl)c(C(C)(C)C)cc2O)C1 ZINC001248880807 1132151129 /nfs/dbraw/zinc/15/11/29/1132151129.db2.gz NLKYEAKSFSEJGL-GFCCVEGCSA-N 1 0 297.826 3.564 20 10 CHCDRO C[C@@H]1CC[C@@H]([N@@H+]2CCc3cccc(O)c3C2)C[C@@H]1C ZINC001172379578 1132171528 /nfs/dbraw/zinc/17/15/28/1132171528.db2.gz ORFCPCVCZOOULJ-VNHYZAJKSA-N 1 0 259.393 3.575 20 10 CHCDRO C[C@@H]([NH2+]CC[C@@H](O)c1ccccc1)c1ccc(N(C)C)cc1 ZINC000839563847 1132223484 /nfs/dbraw/zinc/22/34/84/1132223484.db2.gz PEBVMBGJJWIHPA-DNVCBOLYSA-N 1 0 298.430 3.527 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)cc1)[C@H](C)CCOC(C)C ZINC001172455799 1132239043 /nfs/dbraw/zinc/23/90/43/1132239043.db2.gz XMADVYYXNKHMFO-MRXNPFEDSA-N 1 0 292.467 3.778 20 10 CHCDRO COC[C@@]1(C)CC[N@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000840108691 1132247502 /nfs/dbraw/zinc/24/75/02/1132247502.db2.gz RLORZTFUPLRSFK-SFHVURJKSA-N 1 0 291.435 3.682 20 10 CHCDRO CO[C@@H]1C[C@H]([NH2+][C@@H](C)c2ccc(C)c(C)c2O)C12CCC2 ZINC000840806491 1132288685 /nfs/dbraw/zinc/28/86/85/1132288685.db2.gz HUGUJAHEFOILTP-CWRNSKLLSA-N 1 0 289.419 3.617 20 10 CHCDRO Cc1ncc(C[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)o1 ZINC000840796926 1132288827 /nfs/dbraw/zinc/28/88/27/1132288827.db2.gz PEPPMDQHODSJDO-AWEZNQCLSA-N 1 0 299.418 3.824 20 10 CHCDRO COCC[C@H](C)C[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000840835600 1132292131 /nfs/dbraw/zinc/29/21/31/1132292131.db2.gz OCMHHBVFHLKDEA-KBPBESRZSA-N 1 0 291.435 3.594 20 10 CHCDRO C[C@H]1CC[N@@H+]1Cc1ccc(OCc2ccccc2)cc1O ZINC001231467504 1132297370 /nfs/dbraw/zinc/29/73/70/1132297370.db2.gz HKAMRGBSCCXKHJ-AWEZNQCLSA-N 1 0 283.371 3.565 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H]2C[C@@H](C)O[C@@H]2C)cc1 ZINC000840874172 1132298603 /nfs/dbraw/zinc/29/86/03/1132298603.db2.gz XUAUEIJAXYWEJK-DLTWYDFYSA-N 1 0 290.451 3.607 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2c(O)cc(C)cc2Cl)cc1 ZINC000840877597 1132300358 /nfs/dbraw/zinc/30/03/58/1132300358.db2.gz ZAQWXKVSPIELTM-UHFFFAOYSA-N 1 0 275.779 3.952 20 10 CHCDRO COCC1CCC([NH2+][C@H](C)c2cc(F)cc(F)c2[O-])CC1 ZINC000840881130 1132300674 /nfs/dbraw/zinc/30/06/74/1132300674.db2.gz OCASNUPWMYSRQS-XSRFYTQQSA-N 1 0 299.361 3.526 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)C1(OC)CCC1)c1ccc(C)cc1O ZINC000840883912 1132302807 /nfs/dbraw/zinc/30/28/07/1132302807.db2.gz HDLCQBRRDONMCR-HIFRSBDPSA-N 1 0 277.408 3.699 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@H]1c1ccccn1 ZINC000840911222 1132307878 /nfs/dbraw/zinc/30/78/78/1132307878.db2.gz XYFTTXVZCREGHH-IBGZPJMESA-N 1 0 295.430 3.793 20 10 CHCDRO COC[C@@H]1CCCC[N@H+](Cc2c(O)cc(C)cc2Cl)C1 ZINC000840938175 1132309949 /nfs/dbraw/zinc/30/99/49/1132309949.db2.gz LPAAESJIJODXRC-CYBMUJFWSA-N 1 0 297.826 3.603 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]C[C@@H]1CCCC1(F)F ZINC000840950100 1132311012 /nfs/dbraw/zinc/31/10/12/1132311012.db2.gz FJPCNWDGPLLMNH-AWEZNQCLSA-N 1 0 282.378 3.586 20 10 CHCDRO CSCCC[N@H+](C)Cc1c(O)cc(C)cc1Cl ZINC000840942513 1132311538 /nfs/dbraw/zinc/31/15/38/1132311538.db2.gz ZIXGDOQSCHHJJT-UHFFFAOYSA-N 1 0 273.829 3.539 20 10 CHCDRO CO[C@@H]1CC[N@H+](Cc2c(O)cc(C)cc2Cl)CC1(C)C ZINC000840950729 1132311777 /nfs/dbraw/zinc/31/17/77/1132311777.db2.gz NKXNNASLUYCHRH-OAHLLOKOSA-N 1 0 297.826 3.601 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@@H](C)CC(F)(F)F)cc1C ZINC000840963237 1132313893 /nfs/dbraw/zinc/31/38/93/1132313893.db2.gz JGLBRXRBFXPMHW-VIFPVBQESA-N 1 0 275.314 3.687 20 10 CHCDRO CCc1ccc(C[N@H+](C)Cc2cccc(C)c2O)cc1 ZINC001231592204 1132320742 /nfs/dbraw/zinc/32/07/42/1132320742.db2.gz GDRVVPJKQQDSQC-UHFFFAOYSA-N 1 0 269.388 3.895 20 10 CHCDRO Nc1ccc(CC[NH2+][C@H]2CCC[C@H]2c2ccccc2)cc1 ZINC000841034069 1132321554 /nfs/dbraw/zinc/32/15/54/1132321554.db2.gz GEQDQDVKPBXLNI-OALUTQOASA-N 1 0 280.415 3.737 20 10 CHCDRO C[C@H](CCc1cccc(F)c1)[NH2+]CCc1ccc(N)cc1 ZINC000841035282 1132321800 /nfs/dbraw/zinc/32/18/00/1132321800.db2.gz LYCMFNVJJRFSHQ-CQSZACIVSA-N 1 0 286.394 3.561 20 10 CHCDRO Cc1cccc(C[NH2+]C[C@H](N)c2ccc(C(C)C)cc2)c1O ZINC000841034260 1132322237 /nfs/dbraw/zinc/32/22/37/1132322237.db2.gz BXCCGOVJAVLVMK-SFHVURJKSA-N 1 0 298.430 3.614 20 10 CHCDRO Cc1cc(C)c(C[NH2+]CCc2ccc(N)cc2)cc1C ZINC000841037032 1132322425 /nfs/dbraw/zinc/32/24/25/1132322425.db2.gz RZQZVCFMGVSMHK-UHFFFAOYSA-N 1 0 268.404 3.526 20 10 CHCDRO Nc1ccc(CC[NH2+][C@@H]2CC[C@H](Cc3ccccc3)C2)cc1 ZINC000841038782 1132322653 /nfs/dbraw/zinc/32/26/53/1132322653.db2.gz QEAMDDYKBXGRFE-UYAOXDASSA-N 1 0 294.442 3.812 20 10 CHCDRO Nc1ccc(CC[NH2+][C@@H]2CC[C@@H](Cc3ccccc3)C2)cc1 ZINC000841038779 1132322866 /nfs/dbraw/zinc/32/28/66/1132322866.db2.gz QEAMDDYKBXGRFE-AZUAARDMSA-N 1 0 294.442 3.812 20 10 CHCDRO CC[NH2+]Cc1cccc(NCc2c(O)cccc2Cl)c1 ZINC000841042902 1132324276 /nfs/dbraw/zinc/32/42/76/1132324276.db2.gz KVVDXFQMZNOVLU-UHFFFAOYSA-N 1 0 290.794 3.767 20 10 CHCDRO Cc1ccc2c(c1)C[C@@H]([NH2+]Cc1c(C)cc(C)cc1O)CC2 ZINC001172832205 1132325880 /nfs/dbraw/zinc/32/58/80/1132325880.db2.gz REDUAPHVJXPSBF-SFHVURJKSA-N 1 0 295.426 3.965 20 10 CHCDRO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc3c(c1)CCO3)[C@H](C)C2 ZINC001203119586 1132364787 /nfs/dbraw/zinc/36/47/87/1132364787.db2.gz SBVZRJRVSUTRSY-VLIAUNLRSA-N 1 0 293.410 3.953 20 10 CHCDRO CCCC1CC[NH+](Cc2ccc(N(C)C)cc2OC)CC1 ZINC001231851915 1132377936 /nfs/dbraw/zinc/37/79/36/1132377936.db2.gz JMFSTZHIWHFWJQ-UHFFFAOYSA-N 1 0 290.451 3.773 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCc3ccsc3C2)c(O)c1 ZINC001231846533 1132378067 /nfs/dbraw/zinc/37/80/67/1132378067.db2.gz NSYMHYXAMPQLSQ-UHFFFAOYSA-N 1 0 273.401 3.629 20 10 CHCDRO Cc1cc(C)c(C[N@H+](C)Cc2ccc(F)cc2F)c(O)c1 ZINC001231846125 1132378212 /nfs/dbraw/zinc/37/82/12/1132378212.db2.gz BHWGRGPOCDCMPH-UHFFFAOYSA-N 1 0 291.341 3.919 20 10 CHCDRO CCCC[N@H+](CCC)Cc1ccc(N(C)C)cc1OC ZINC001231851755 1132378616 /nfs/dbraw/zinc/37/86/16/1132378616.db2.gz HHSJWAXGBPLISC-UHFFFAOYSA-N 1 0 278.440 3.773 20 10 CHCDRO Cc1cc(O)c(CN2CC[C@](C)(F)[C@@H](F)C2)cc1Cl ZINC001231868665 1132385610 /nfs/dbraw/zinc/38/56/10/1132385610.db2.gz VZFCSVJBRITMFE-KBPBESRZSA-N 1 0 289.753 3.626 20 10 CHCDRO CCCOC1CCC([NH2+]Cc2ccc(OC)c(C)c2)CC1 ZINC001173094000 1132386479 /nfs/dbraw/zinc/38/64/79/1132386479.db2.gz FMJNWVURYDOBBC-UHFFFAOYSA-N 1 0 291.435 3.831 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)c2ccc(Cl)cc2O)cc1 ZINC000841745495 1132388278 /nfs/dbraw/zinc/38/82/78/1132388278.db2.gz YYVCPABPQGSEGL-LLVKDONJSA-N 1 0 291.778 3.905 20 10 CHCDRO Oc1c(C[N@@H+]2CC[C@@H]3OCCC[C@@H]3C2)ccc2ccccc21 ZINC001231878802 1132389294 /nfs/dbraw/zinc/38/92/94/1132389294.db2.gz UTRGFOLCMIPYHF-QAPCUYQASA-N 1 0 297.398 3.546 20 10 CHCDRO Oc1c(C[N@@H+]2CC[C@]3(C2)CCCCO3)ccc2ccccc21 ZINC001231879380 1132389635 /nfs/dbraw/zinc/38/96/35/1132389635.db2.gz DECJKGSGNDSMGP-IBGZPJMESA-N 1 0 297.398 3.690 20 10 CHCDRO Oc1c(C[N@@H+]2CCCC[C@H](F)C2)ccc2ccccc21 ZINC001231879614 1132389839 /nfs/dbraw/zinc/38/98/39/1132389839.db2.gz KQWUXYXZOIFHKB-HNNXBMFYSA-N 1 0 273.351 3.869 20 10 CHCDRO Cc1ccoc1C[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841759042 1132393560 /nfs/dbraw/zinc/39/35/60/1132393560.db2.gz XCYHRYHOUUOEKF-SNVBAGLBSA-N 1 0 265.740 3.798 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2COCc3ccccc32)c(O)c1 ZINC000841759378 1132394153 /nfs/dbraw/zinc/39/41/53/1132394153.db2.gz FLMRVNFUHTZGRJ-WMLDXEAASA-N 1 0 297.398 3.931 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)c2ccc(Cl)cc2O)nc1C ZINC000841756738 1132394701 /nfs/dbraw/zinc/39/47/01/1132394701.db2.gz JROYFMNDANWAAV-GFCCVEGCSA-N 1 0 290.794 3.908 20 10 CHCDRO CC[C@H]1CC[C@H]([NH2+][C@@H](C)c2ccc(N(C)C)cc2)C1 ZINC001173269248 1132434209 /nfs/dbraw/zinc/43/42/09/1132434209.db2.gz UJFYTAYSXNCDTR-DZKIICNBSA-N 1 0 260.425 3.982 20 10 CHCDRO CC[C@@H]1CC[C@@H]([NH2+][C@@H](C)c2ccc(N(C)C)cc2)C1 ZINC001173269251 1132434420 /nfs/dbraw/zinc/43/44/20/1132434420.db2.gz UJFYTAYSXNCDTR-SQWLQELKSA-N 1 0 260.425 3.982 20 10 CHCDRO COc1cc(O)c(C[NH+]2CCC(C(C)C)CC2)cc1Cl ZINC001232269767 1132447505 /nfs/dbraw/zinc/44/75/05/1132447505.db2.gz KHYJFBYGDCBKMA-UHFFFAOYSA-N 1 0 297.826 3.922 20 10 CHCDRO Oc1cc(O)c(C[N@@H+]2CCC[C@H]3CCC[C@H]32)cc1Cl ZINC001232268505 1132447524 /nfs/dbraw/zinc/44/75/24/1132447524.db2.gz PWNWTMISVAYUKC-ZWNOBZJWSA-N 1 0 281.783 3.516 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CCS[C@H]2C)cc1 ZINC000842926921 1132476653 /nfs/dbraw/zinc/47/66/53/1132476653.db2.gz BEWKNZYZNQPNMD-HEHGZKQESA-N 1 0 278.465 3.687 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H]2C[C@@H](OC(C)(C)C)C2)c1 ZINC000842920174 1132476802 /nfs/dbraw/zinc/47/68/02/1132476802.db2.gz IAWKLTLBEOZVSI-MCIONIFRSA-N 1 0 277.408 3.697 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CC2CCC(F)CC2)c1 ZINC000842929412 1132477504 /nfs/dbraw/zinc/47/75/04/1132477504.db2.gz PYDHQBUSUVVRJV-HSBZDZAISA-N 1 0 265.372 3.880 20 10 CHCDRO C[C@@H]([NH2+]CC1CCC(F)CC1)c1ccccc1O ZINC000842929698 1132477513 /nfs/dbraw/zinc/47/75/13/1132477513.db2.gz RKXXSLZDRNBFDE-PNESKVBLSA-N 1 0 251.345 3.571 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CC[C@H]3C[C@H]3C2)c(O)c1C ZINC000842930767 1132477633 /nfs/dbraw/zinc/47/76/33/1132477633.db2.gz WKLFXUBGUODIBW-ZQDZILKHSA-N 1 0 259.393 3.848 20 10 CHCDRO C[C@@H]1C[C@H](F)C[N@@H+]1Cc1cccc(C(C)(C)C)c1O ZINC001143103856 1132502456 /nfs/dbraw/zinc/50/24/56/1132502456.db2.gz LXMYJEGWQKZJTE-YPMHNXCESA-N 1 0 265.372 3.622 20 10 CHCDRO COCC1CC[NH+](Cc2cccc(C(C)(C)C)c2O)CC1 ZINC001143103785 1132502727 /nfs/dbraw/zinc/50/27/27/1132502727.db2.gz KESRZLPVMRBKGX-UHFFFAOYSA-N 1 0 291.435 3.548 20 10 CHCDRO CCO[C@@H]1CCC[N@H+](Cc2cccc(C(C)(C)C)c2O)C1 ZINC001143110412 1132503927 /nfs/dbraw/zinc/50/39/27/1132503927.db2.gz FMBSCLTUWRSNDU-OAHLLOKOSA-N 1 0 291.435 3.691 20 10 CHCDRO CC(C)C[NH+](Cc1ccc(N(C)C)cc1O)CC(C)C ZINC001232834117 1132529312 /nfs/dbraw/zinc/52/93/12/1132529312.db2.gz HCMZAVSLDNMPNG-UHFFFAOYSA-N 1 0 278.440 3.572 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CC3(CC=CC3)[C@H]2C(C)C)c1 ZINC000843432104 1132532315 /nfs/dbraw/zinc/53/23/15/1132532315.db2.gz QOOXWHZGGYRVEU-QGZVFWFLSA-N 1 0 287.403 3.577 20 10 CHCDRO CC[N@H+](CCSC)Cc1ccc2ccccc2c1O ZINC000843437364 1132535459 /nfs/dbraw/zinc/53/54/59/1132535459.db2.gz FAMTUBGHKHVTSV-UHFFFAOYSA-N 1 0 275.417 3.730 20 10 CHCDRO CC[N@H+](C)Cc1c(O)ccc2cc(Br)ccc21 ZINC001233193796 1132578370 /nfs/dbraw/zinc/57/83/70/1132578370.db2.gz FQAQUKTVDLJZAX-UHFFFAOYSA-N 1 0 294.192 3.760 20 10 CHCDRO Oc1ccc2cc(Br)ccc2c1C[NH+]1CCC1 ZINC001233194077 1132579001 /nfs/dbraw/zinc/57/90/01/1132579001.db2.gz LFHYNNZCWJSKOP-UHFFFAOYSA-N 1 0 292.176 3.514 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC[C@H]3CCCC[C@@H]3C2)c1 ZINC000132364373 1132581959 /nfs/dbraw/zinc/58/19/59/1132581959.db2.gz OTAORSCZHKPULD-HUUCEWRRSA-N 1 0 259.393 3.713 20 10 CHCDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CCC[C@@H](F)C2)c1 ZINC001233285887 1132594159 /nfs/dbraw/zinc/59/41/59/1132594159.db2.gz WTJXFMKUOOAYTK-CQSZACIVSA-N 1 0 265.372 3.624 20 10 CHCDRO CC(C)(C)c1ccc(O)c(C[N@H+]2C[C@H]3[C@H](CC3(F)F)C2)c1 ZINC001233284249 1132594593 /nfs/dbraw/zinc/59/45/93/1132594593.db2.gz NMIWTOBNFWOTRO-OCCSQVGLSA-N 1 0 295.373 3.777 20 10 CHCDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CCc3cnccc3C2)c1 ZINC001233284446 1132594902 /nfs/dbraw/zinc/59/49/02/1132594902.db2.gz VCPKXEMNKOORAC-UHFFFAOYSA-N 1 0 296.414 3.643 20 10 CHCDRO CC(C)(C)c1ccc(O)c(C[NH+]2CCC(CF)CC2)c1 ZINC001233286179 1132595136 /nfs/dbraw/zinc/59/51/36/1132595136.db2.gz IUKFCHWAWCAEIC-UHFFFAOYSA-N 1 0 279.399 3.871 20 10 CHCDRO CO[C@H]1CCC[N@H+](Cc2cc(C(C)(C)C)ccc2O)CC1 ZINC001233286426 1132595338 /nfs/dbraw/zinc/59/53/38/1132595338.db2.gz UAVFJLAGOQPRSM-INIZCTEOSA-N 1 0 291.435 3.691 20 10 CHCDRO CC(C)O[C@H]1CC[N@H+](Cc2cc(C(C)(C)C)ccc2O)C1 ZINC001233286824 1132595351 /nfs/dbraw/zinc/59/53/51/1132595351.db2.gz KBSFBRPJKHGEGU-INIZCTEOSA-N 1 0 291.435 3.689 20 10 CHCDRO C[N@H+](CCc1ccccn1)Cc1cc(C(C)(C)C)ccc1O ZINC001233283803 1132595548 /nfs/dbraw/zinc/59/55/48/1132595548.db2.gz WMQZGOIOBDHYFY-UHFFFAOYSA-N 1 0 298.430 3.759 20 10 CHCDRO CC(C)(C)c1ccc(O)c(C[N@H+]2C[C@@H]3[C@H](C2)C3(C)C)c1 ZINC001233286087 1132595943 /nfs/dbraw/zinc/59/59/43/1132595943.db2.gz DWHJYFPHVONNJP-GASCZTMLSA-N 1 0 273.420 3.778 20 10 CHCDRO CO[C@@H]1CC[N@H+](Cc2cc(C(C)(C)C)ccc2O)[C@H](C)C1 ZINC001233287428 1132596574 /nfs/dbraw/zinc/59/65/74/1132596574.db2.gz PELSODCVZDZLGW-CZUORRHYSA-N 1 0 291.435 3.689 20 10 CHCDRO Cc1[nH+]c(N(C)Cc2ccc(N(C)C)cc2)cc2[nH]ccc21 ZINC001156921361 1132715157 /nfs/dbraw/zinc/71/51/57/1132715157.db2.gz YODGRMVYCZGEBJ-UHFFFAOYSA-N 1 0 294.402 3.574 20 10 CHCDRO Nc1ccc(N(c2ccccc2)C2=C[NH2+]CCC2)cc1 ZINC001159703224 1132895771 /nfs/dbraw/zinc/89/57/71/1132895771.db2.gz AZAVGLOSAOXOKL-UHFFFAOYSA-N 1 0 265.360 3.632 20 10 CHCDRO Cc1cc(Nc2cc(F)ccc2O)c2ccccc2[nH+]1 ZINC001174624529 1132930475 /nfs/dbraw/zinc/93/04/75/1132930475.db2.gz JMEUMRQNDOTTSW-UHFFFAOYSA-N 1 0 268.291 3.553 20 10 CHCDRO Nc1ccc(Nc2ccc(C[C@H]3CCC[NH2+]C3)cc2)cc1 ZINC001160257348 1132951865 /nfs/dbraw/zinc/95/18/65/1132951865.db2.gz YJUXVUZRJZQASE-OAHLLOKOSA-N 1 0 281.403 3.555 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(NC[C@H]2C[NH2+][C@H](C)C2)cc1 ZINC001162557837 1133091546 /nfs/dbraw/zinc/09/15/46/1133091546.db2.gz LJMUHXWJSNPYBB-CZUORRHYSA-N 1 0 283.419 3.504 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H]2CCCC23CC3)c(Cl)c1 ZINC001203331481 1133316559 /nfs/dbraw/zinc/31/65/59/1133316559.db2.gz AMLODTPAEXCYBQ-AWEZNQCLSA-N 1 0 265.784 3.776 20 10 CHCDRO C=C/C=C/CC[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC001203517508 1133334455 /nfs/dbraw/zinc/33/44/55/1133334455.db2.gz UXGWVBWSYVXPCG-AATRIKPKSA-N 1 0 298.352 3.993 20 10 CHCDRO C[C@@H]([NH2+]Cc1c[nH]nc1-c1cccs1)c1ccccc1O ZINC001203536309 1133336549 /nfs/dbraw/zinc/33/65/49/1133336549.db2.gz OCVXQPKDSCILNH-LLVKDONJSA-N 1 0 299.399 3.695 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]CCC2CCC2)cc1 ZINC001203553516 1133338604 /nfs/dbraw/zinc/33/86/04/1133338604.db2.gz HCGSKBYLLXCGNN-DAXSKMNVSA-N 1 0 258.409 3.546 20 10 CHCDRO COc1ccc(C[NH2+]CCC[C@@H]2C=CCC2)cc1C ZINC001203553671 1133339346 /nfs/dbraw/zinc/33/93/46/1133339346.db2.gz MAFWZZZNYVZURE-OAHLLOKOSA-N 1 0 259.393 3.840 20 10 CHCDRO CC[C@H]1c2ccccc2CC[N@H+]1Cc1ccc(OC)cc1O ZINC001203628997 1133345920 /nfs/dbraw/zinc/34/59/20/1133345920.db2.gz NANWTROLILLUOX-SFHVURJKSA-N 1 0 297.398 3.910 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+]2C[C@H]3[C@H](CC3(F)F)C2)cc1 ZINC001203939373 1133385695 /nfs/dbraw/zinc/38/56/95/1133385695.db2.gz AHMBJKKDVYHXHI-ZBFHGGJFSA-N 1 0 294.389 3.620 20 10 CHCDRO CCc1ccc(C[N@H+](C)Cc2ccc(N(C)C)cc2)cc1 ZINC001203937650 1133386240 /nfs/dbraw/zinc/38/62/40/1133386240.db2.gz IYIFKMOYOFMTLQ-UHFFFAOYSA-N 1 0 282.431 3.947 20 10 CHCDRO CCN(CC)c1ccc(C[NH+]2CCC3(CC3)CC2)cc1 ZINC001203940663 1133386505 /nfs/dbraw/zinc/38/65/05/1133386505.db2.gz UDHMZRBNOQCBRX-UHFFFAOYSA-N 1 0 272.436 3.909 20 10 CHCDRO CC1(C)C(C)(C)C1(C)[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001203953058 1133390542 /nfs/dbraw/zinc/39/05/42/1133390542.db2.gz FLQUAGUIKASLOH-UHFFFAOYSA-N 1 0 273.420 3.926 20 10 CHCDRO CN(C)c1ccc(C[NH+]2CCCC2)c2ccccc21 ZINC001204232784 1133422818 /nfs/dbraw/zinc/42/28/18/1133422818.db2.gz JVAATUPKIZYKTG-UHFFFAOYSA-N 1 0 254.377 3.502 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)[C@@H]2CCCOC2)c2ccccc21 ZINC001204241175 1133423791 /nfs/dbraw/zinc/42/37/91/1133423791.db2.gz YUCKBINXKRTERP-MRXNPFEDSA-N 1 0 298.430 3.517 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[N@@H+]1CC[C@@H]2CCC[C@H]2C1 ZINC001204323775 1133437291 /nfs/dbraw/zinc/43/72/91/1133437291.db2.gz JAJPKDRZANNJNH-ROUUACIJSA-N 1 0 284.447 3.909 20 10 CHCDRO F[C@H]1CCCC[N@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001204325648 1133438378 /nfs/dbraw/zinc/43/83/78/1133438378.db2.gz SNQYLMPSBVFDJE-INIZCTEOSA-N 1 0 276.399 3.611 20 10 CHCDRO Cc1ccc(C[N@@H+]2CCc3cccc(O)c3C2)cc1C ZINC001204354483 1133439983 /nfs/dbraw/zinc/43/99/83/1133439983.db2.gz FSNFKOYNHHQLSB-UHFFFAOYSA-N 1 0 267.372 3.567 20 10 CHCDRO CCC1(CO)CC[NH+](Cc2cc(C(C)C)ccc2O)CC1 ZINC001204689353 1133475858 /nfs/dbraw/zinc/47/58/58/1133475858.db2.gz BRTHWZWLHJBSGL-UHFFFAOYSA-N 1 0 291.435 3.500 20 10 CHCDRO Cc1cccc(C[N@@H+](C)Cc2cc(F)cc(F)c2[O-])c1 ZINC001205069849 1133522481 /nfs/dbraw/zinc/52/24/81/1133522481.db2.gz IASXNCOVAKYCIS-UHFFFAOYSA-N 1 0 277.314 3.611 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCCc3cc(O)c(O)cc3C2)c1C ZINC001205095295 1133529271 /nfs/dbraw/zinc/52/92/71/1133529271.db2.gz BAMATVANSPFGTM-UHFFFAOYSA-N 1 0 297.398 3.663 20 10 CHCDRO CC[C@H]1CC[N@H+](Cc2ccc(Br)cc2O)[C@@H]1C ZINC001205470633 1133580581 /nfs/dbraw/zinc/58/05/81/1133580581.db2.gz BEHYKYJAGMWUDP-MNOVXSKESA-N 1 0 298.224 3.775 20 10 CHCDRO CC[C@@H]1[C@H](C)CC[N@@H+]1C/C=C\c1ccc(N(C)C)cc1 ZINC001205489424 1133582244 /nfs/dbraw/zinc/58/22/44/1133582244.db2.gz QGWQXIDOALEZCZ-QNRLHKFMSA-N 1 0 272.436 3.886 20 10 CHCDRO CCC[C@H]([NH2+]Cc1ccc(OC)cc1O)[C@H]1CC1(C)C ZINC001205517482 1133584447 /nfs/dbraw/zinc/58/44/47/1133584447.db2.gz QYWAUFVBWGGTCP-CABCVRRESA-N 1 0 277.408 3.705 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2CCC[C@H](C)C2)cc1Cl ZINC001205550940 1133586963 /nfs/dbraw/zinc/58/69/63/1133586963.db2.gz GDYGHQJZCYHEMQ-JTQLQIEISA-N 1 0 253.773 3.586 20 10 CHCDRO CC(C)c1ccc(O)c(C[NH2+]CC(C)(C)c2ccccn2)c1 ZINC001205877094 1133626789 /nfs/dbraw/zinc/62/67/89/1133626789.db2.gz YKFAEWMGCUYSIG-UHFFFAOYSA-N 1 0 298.430 3.978 20 10 CHCDRO CC(C)[C@@H]1[N@H+](Cc2cc(F)c(N(C)C)cc2F)CC1(C)C ZINC001206040942 1133646617 /nfs/dbraw/zinc/64/66/17/1133646617.db2.gz QRXYWZJUPQVAHA-INIZCTEOSA-N 1 0 296.405 3.897 20 10 CHCDRO COc1cc(C[NH+]2CC3(CCC3)C2)c(O)c(C(C)(C)C)c1 ZINC001206186043 1133669552 /nfs/dbraw/zinc/66/95/52/1133669552.db2.gz HIVLFLVKJZRHPS-UHFFFAOYSA-N 1 0 289.419 3.684 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CC[C@@H](C2CCC2)C1 ZINC001206288923 1133683401 /nfs/dbraw/zinc/68/34/01/1133683401.db2.gz XLUMHKYIJJEYEW-QGZVFWFLSA-N 1 0 272.436 3.683 20 10 CHCDRO Cc1ccc(CC[N@@H+]2Cc3cccc(O)c3C2)cc1C ZINC001207243890 1133782134 /nfs/dbraw/zinc/78/21/34/1133782134.db2.gz SXRQPPSCLGJMGA-UHFFFAOYSA-N 1 0 267.372 3.567 20 10 CHCDRO CC(C)c1ccc(O)c(C[NH2+]C2(CCO)CCCCC2)c1 ZINC001207439482 1133802517 /nfs/dbraw/zinc/80/25/17/1133802517.db2.gz FEEMDPIBQPGONC-UHFFFAOYSA-N 1 0 291.435 3.691 20 10 CHCDRO CC(C)c1ccc(O)c(C[NH2+]C2(C3CC3)CCC2)c1 ZINC001207526643 1133815407 /nfs/dbraw/zinc/81/54/07/1133815407.db2.gz IDPUJJCGTOJRQU-UHFFFAOYSA-N 1 0 259.393 3.938 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCc3ccsc3C2)cc1Cl ZINC001207719633 1133840705 /nfs/dbraw/zinc/84/07/05/1133840705.db2.gz NVIQHOCWTJVEMU-UHFFFAOYSA-N 1 0 293.819 3.974 20 10 CHCDRO CCCC[C@H](C)[NH2+]C[C@@H](c1ccc(N(C)C)cc1)N(C)C ZINC001207748376 1133844792 /nfs/dbraw/zinc/84/47/92/1133844792.db2.gz IKMQNYJVPMIUKV-YJBOKZPZSA-N 1 0 291.483 3.524 20 10 CHCDRO Cc1ccc([C@H](C)CC[N@@H+]2CCc3cccc(O)c3C2)o1 ZINC001208165850 1133893049 /nfs/dbraw/zinc/89/30/49/1133893049.db2.gz HFDHGCUQRCLRHV-CYBMUJFWSA-N 1 0 285.387 3.846 20 10 CHCDRO CC1=C[C@@H](C)[C@@H](C[N@@H+]2CCc3cccc(O)c3C2)CC1 ZINC001208184004 1133901255 /nfs/dbraw/zinc/90/12/55/1133901255.db2.gz ZMQNCEMLDDXNEK-GDBMZVCRSA-N 1 0 271.404 3.743 20 10 CHCDRO C[N@H+]1CC=C(Nc2cccc3c2C(=O)c2ccccc2-3)CC1 ZINC001208909816 1133962163 /nfs/dbraw/zinc/96/21/63/1133962163.db2.gz GTKGTXWEISQTET-UHFFFAOYSA-N 1 0 290.366 3.529 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)CC2Cc3ccccc3C2)cc1 ZINC001209322675 1134005794 /nfs/dbraw/zinc/00/57/94/1134005794.db2.gz SVKISSQVMCYBLH-UHFFFAOYSA-N 1 0 294.442 3.599 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(C[N@@H+](C)C2CCOCC2)cc1 ZINC001209517292 1134034747 /nfs/dbraw/zinc/03/47/47/1134034747.db2.gz CAZSDUACIADISR-UHFFFAOYSA-N 1 0 298.430 3.705 20 10 CHCDRO COc1cccc([C@H]2CCC[N@@H+]2Cc2ccccc2O)c1 ZINC000179555293 1134549268 /nfs/dbraw/zinc/54/92/68/1134549268.db2.gz ZLVHYTJMEOQIIC-QGZVFWFLSA-N 1 0 283.371 3.738 20 10 CHCDRO CC(C)C[NH2+]Cc1ccc(N(C)c2ccc(N)cc2)cc1 ZINC001215746031 1134673003 /nfs/dbraw/zinc/67/30/03/1134673003.db2.gz FESIQRFLCFHOMI-UHFFFAOYSA-N 1 0 283.419 3.782 20 10 CHCDRO CC[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)S2)c1ccccc1O ZINC000403514716 1134791154 /nfs/dbraw/zinc/79/11/54/1134791154.db2.gz NJWSVGQIELUEPC-FLTXBFBQSA-N 1 0 277.433 3.860 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CCc2ncccc2C)cc1 ZINC000404988795 1134954340 /nfs/dbraw/zinc/95/43/40/1134954340.db2.gz JBFAYGGKMYSUGQ-UHFFFAOYSA-N 1 0 297.446 3.569 20 10 CHCDRO C[C@@H]1C[C@H](Oc2ccccc2NN=C2C=CC=CC2=O)C[NH2+]1 ZINC001218046833 1135049249 /nfs/dbraw/zinc/04/92/49/1135049249.db2.gz XEEGFZZSPCPMHV-OCLJEGOKSA-N 1 0 297.358 3.937 20 10 CHCDRO CC(C)CCC[C@@H](C)Oc1ccc(N2CC[NH2+]CC2)cc1 ZINC001218311651 1135085832 /nfs/dbraw/zinc/08/58/32/1135085832.db2.gz RNNSUDQXVKUHCB-MRXNPFEDSA-N 1 0 290.451 3.690 20 10 CHCDRO O=C1C=CC=CC1=NNc1ccccc1O[C@@H]1C=CC[NH2+]C1 ZINC001218330097 1135089987 /nfs/dbraw/zinc/08/99/87/1135089987.db2.gz ACSJMIRBXLTMFV-ZIPFOMIPSA-N 1 0 295.342 3.714 20 10 CHCDRO CCC[C@@H](C)[C@H](CC)Oc1ccc(N2CC[NH2+]CC2)cc1 ZINC001218439343 1135105369 /nfs/dbraw/zinc/10/53/69/1135105369.db2.gz SPFJDIQXZPLFJI-QAPCUYQASA-N 1 0 290.451 3.690 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CCOc1ccccc1 ZINC000314533579 1135145743 /nfs/dbraw/zinc/14/57/43/1135145743.db2.gz ALLOOTFUTQZWGS-ZBFHGGJFSA-N 1 0 297.398 3.918 20 10 CHCDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]Cc1ccc(C#N)cc1 ZINC000314693421 1135146954 /nfs/dbraw/zinc/14/69/54/1135146954.db2.gz LVYYUDXWELTYSZ-XJKSGUPXSA-N 1 0 292.382 3.910 20 10 CHCDRO COC1(CC[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)CCC1 ZINC000315246661 1135151790 /nfs/dbraw/zinc/15/17/90/1135151790.db2.gz RGNRUPFHJYLOAP-KGLIPLIRSA-N 1 0 289.419 3.798 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]CCCOC1CCCCC1)CC2 ZINC000315450343 1135154386 /nfs/dbraw/zinc/15/43/86/1135154386.db2.gz KFMXZHCHFQVGIW-INIZCTEOSA-N 1 0 289.419 3.709 20 10 CHCDRO CC[C@H]([NH2+]CC[C@@H]1CCCCO1)c1ccc(C)cc1O ZINC000280270781 522597836 /nfs/dbraw/zinc/59/78/36/522597836.db2.gz XUXJESBEFNCECX-HOCLYGCPSA-N 1 0 277.408 3.701 20 10 CHCDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+][C@@H](C)c1ccccn1 ZINC000020123636 171005020 /nfs/dbraw/zinc/00/50/20/171005020.db2.gz VJCKLPAXBOICMR-KCQAQPDRSA-N 1 0 282.387 3.995 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCc2ccccc21)c1ccccc1O ZINC000020129743 171018402 /nfs/dbraw/zinc/01/84/02/171018402.db2.gz JAMZRKGHGBRESE-LRDDRELGSA-N 1 0 253.345 3.730 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H](C)c1ccccc1)c1ccccc1O ZINC000020137108 171024532 /nfs/dbraw/zinc/02/45/32/171024532.db2.gz NHTSKVCAGUVVSE-ZIAGYGMSSA-N 1 0 255.361 3.847 20 10 CHCDRO C[C@@H](CCc1ccccc1)[NH2+]Cc1ccccc1O ZINC000020138332 171026195 /nfs/dbraw/zinc/02/61/95/171026195.db2.gz KKGSJYLIMHXEIT-AWEZNQCLSA-N 1 0 255.361 3.503 20 10 CHCDRO C[C@H](CCc1ccco1)[NH2+][C@@H](C)c1ccccc1O ZINC000020144726 171030250 /nfs/dbraw/zinc/03/02/50/171030250.db2.gz XJTOQXRKKKWXJF-OLZOCXBDSA-N 1 0 259.349 3.657 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cc(F)ccc1F ZINC000020146104 171031711 /nfs/dbraw/zinc/03/17/11/171031711.db2.gz YJAKZBKUOIKLFU-LBPRGKRZSA-N 1 0 290.357 3.882 20 10 CHCDRO CN(C)c1ccc(C[NH2+]Cc2ccc(Cl)s2)cc1 ZINC000020146133 171032137 /nfs/dbraw/zinc/03/21/37/171032137.db2.gz MGKZJDFDSXWQRA-UHFFFAOYSA-N 1 0 280.824 3.757 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(Cl)cc2)c1 ZINC000020209787 171073456 /nfs/dbraw/zinc/07/34/56/171073456.db2.gz SKDXRCNRHCHLMH-NSHDSACASA-N 1 0 291.778 3.905 20 10 CHCDRO CC[C@H]([NH2+]Cc1cccc(F)c1)c1ccccc1O ZINC000020473377 171217416 /nfs/dbraw/zinc/21/74/16/171217416.db2.gz NLUQIZXRCZUQQS-HNNXBMFYSA-N 1 0 259.324 3.772 20 10 CHCDRO CC[C@@H]([NH2+]CC1CCC1)c1cc(Br)ccc1O ZINC000037179918 173012693 /nfs/dbraw/zinc/01/26/93/173012693.db2.gz VRMRIYUZXIMTBT-CYBMUJFWSA-N 1 0 298.224 3.996 20 10 CHCDRO CC(C)CCC[C@@H](C)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000037362838 173151679 /nfs/dbraw/zinc/15/16/79/173151679.db2.gz PMYJREVAPHZKBG-CQSZACIVSA-N 1 0 261.409 3.926 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C[C@@H](C)c2ccccc2)c1 ZINC000071406552 176155745 /nfs/dbraw/zinc/15/57/45/176155745.db2.gz DKZASJDPAVRMFL-CQSZACIVSA-N 1 0 255.361 3.594 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCc2cccs2)c1 ZINC000035628677 260152107 /nfs/dbraw/zinc/15/21/07/260152107.db2.gz MYZZWMAXUQJMDU-GFCCVEGCSA-N 1 0 261.390 3.655 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccco2)cc1 ZINC000152029509 261058594 /nfs/dbraw/zinc/05/85/94/261058594.db2.gz UPRVPWAWPKJRAE-CYBMUJFWSA-N 1 0 258.365 3.587 20 10 CHCDRO COCC[C@H](C)[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000152694194 261068555 /nfs/dbraw/zinc/06/85/55/261068555.db2.gz UFZALAKKLDFOJL-HOTGVXAUSA-N 1 0 290.451 3.753 20 10 CHCDRO COc1cccc(C[N@@H+]2CCC[C@@H]2c2ccsc2)c1O ZINC000153552092 261080539 /nfs/dbraw/zinc/08/05/39/261080539.db2.gz NOLKLKGXDRVZDL-CQSZACIVSA-N 1 0 289.400 3.799 20 10 CHCDRO CC[C@@H]([NH2+]Cc1c(C)noc1C)c1ccc(N(C)C)cc1 ZINC000153942200 261085777 /nfs/dbraw/zinc/08/57/77/261085777.db2.gz YSAJVCJFWVEUKL-QGZVFWFLSA-N 1 0 287.407 3.598 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccc(Cl)nc1)c1ccccc1O ZINC000156356508 261120663 /nfs/dbraw/zinc/12/06/63/261120663.db2.gz YBPRIDHDCNXACH-AWEZNQCLSA-N 1 0 290.794 3.724 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](C)c1c(C)noc1C)c1ccccc1O ZINC000156866638 261133818 /nfs/dbraw/zinc/13/38/18/261133818.db2.gz AJVHYHUHAAZGAY-IAQYHMDHSA-N 1 0 288.391 3.841 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc(C)cc(OC)c1)c1ccccc1O ZINC000156862034 261134155 /nfs/dbraw/zinc/13/41/55/261134155.db2.gz JWAYUQBKWXXYTF-QGZVFWFLSA-N 1 0 285.387 3.950 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCO[C@H](C2CC2)C1)c1cc(Cl)ccc1O ZINC000157884398 261154790 /nfs/dbraw/zinc/15/47/90/261154790.db2.gz YIJYIBHAKFQSRF-ZXIHIIQKSA-N 1 0 295.810 3.654 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCO[C@H](C3CC3)C2)c(O)c1C ZINC000157885722 261155082 /nfs/dbraw/zinc/15/50/82/261155082.db2.gz IXMIHGNVQVAYBV-KMFMINBZSA-N 1 0 289.419 3.617 20 10 CHCDRO Cc1cccc(C[N@@H+](C)[C@H](C)c2cccc(O)c2)c1O ZINC000180178767 261845334 /nfs/dbraw/zinc/84/53/34/261845334.db2.gz TYDCFSCNDDRJBX-CYBMUJFWSA-N 1 0 271.360 3.599 20 10 CHCDRO COc1cc(Cl)cc(C[N@H+](C)Cc2ccoc2C)c1O ZINC000184683484 262025855 /nfs/dbraw/zinc/02/58/55/262025855.db2.gz KHDSLOYDQJBCRW-UHFFFAOYSA-N 1 0 295.766 3.588 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(F)c(C)c2)c1 ZINC000184911658 262033242 /nfs/dbraw/zinc/03/32/42/262033242.db2.gz NPYZZOFHEJRTPK-CYBMUJFWSA-N 1 0 273.351 3.999 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)c2cc(F)ccc2O)cc1F ZINC000184927979 262033880 /nfs/dbraw/zinc/03/38/80/262033880.db2.gz KKRDIPIBWIZOHE-SNVBAGLBSA-N 1 0 293.313 3.530 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(Cl)nc2)c(O)c1 ZINC000185074202 262040079 /nfs/dbraw/zinc/04/00/79/262040079.db2.gz VDTKTRXMVYQCRU-LLVKDONJSA-N 1 0 276.767 3.600 20 10 CHCDRO CCOc1ccccc1C[NH2+][C@H](C)c1cc(F)ccc1O ZINC000185103758 262040924 /nfs/dbraw/zinc/04/09/24/262040924.db2.gz WKMCIVOBACGZDZ-GFCCVEGCSA-N 1 0 289.350 3.781 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc([C@H](C)O)cc2)c(O)c1 ZINC000185120283 262042644 /nfs/dbraw/zinc/04/26/44/262042644.db2.gz SLPVOQZRELCGNB-KGLIPLIRSA-N 1 0 285.387 3.605 20 10 CHCDRO COc1cc(C[NH2+][C@H](C)c2cc(C)ccc2O)ccc1C ZINC000185193167 262045032 /nfs/dbraw/zinc/04/50/32/262045032.db2.gz QHVMTCAASQMCSJ-CQSZACIVSA-N 1 0 285.387 3.868 20 10 CHCDRO C[C@H]([NH2+]Cc1cccc(O)c1)c1cc2c(cc1O)CCCC2 ZINC000185300230 262048934 /nfs/dbraw/zinc/04/89/34/262048934.db2.gz HCIVZYICJHPXKE-ZDUSSCGKSA-N 1 0 297.398 3.827 20 10 CHCDRO Cc1noc(C)c1CC[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000185395799 262052981 /nfs/dbraw/zinc/05/29/81/262052981.db2.gz JXCFVJYCINLXFY-SECBINFHSA-N 1 0 294.782 3.544 20 10 CHCDRO Cc1noc(C)c1C[C@H](C)[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000185501722 262056945 /nfs/dbraw/zinc/05/69/45/262056945.db2.gz TVWSZVLNEBLQAA-RYUDHWBXSA-N 1 0 288.391 3.587 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCOC3(CCCC3)C2)c1 ZINC000186129083 262081218 /nfs/dbraw/zinc/08/12/18/262081218.db2.gz FTQATLPYURFWKM-LSDHHAIUSA-N 1 0 289.419 3.843 20 10 CHCDRO COc1cc(C)cc(C[NH2+][C@H](C)c2cc(C)ccc2O)c1 ZINC000186156136 262082088 /nfs/dbraw/zinc/08/20/88/262082088.db2.gz KQVNAZAHIYUUSU-CQSZACIVSA-N 1 0 285.387 3.868 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(Cl)cn2)c(O)c1 ZINC000186230077 262085490 /nfs/dbraw/zinc/08/54/90/262085490.db2.gz SLMXCLLJINQKJQ-NSHDSACASA-N 1 0 276.767 3.600 20 10 CHCDRO C[C@H]([NH2+]CC[C@H]1CCCCO1)c1cc(Cl)ccc1O ZINC000186515141 262096211 /nfs/dbraw/zinc/09/62/11/262096211.db2.gz YCANDAKMZMTIHR-WCQYABFASA-N 1 0 283.799 3.655 20 10 CHCDRO CSc1ccccc1[C@H](C)[NH2+]Cc1ccccc1O ZINC000282482058 263077022 /nfs/dbraw/zinc/07/70/22/263077022.db2.gz VKRPNNZUZHWYFC-LBPRGKRZSA-N 1 0 273.401 3.965 20 10 CHCDRO Cc1ccc2c(c1C)OC[C@@H]2[NH2+][C@H]1CCc2cccc(O)c21 ZINC000297056648 263200224 /nfs/dbraw/zinc/20/02/24/263200224.db2.gz VTHZHXGSVLNAJL-HOTGVXAUSA-N 1 0 295.382 3.720 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC000281607686 328240169 /nfs/dbraw/zinc/24/01/69/328240169.db2.gz KLQOFDJKUDCROS-SECBINFHSA-N 1 0 275.726 3.571 20 10 CHCDRO COc1cccc(C[NH2+][C@H](C)c2ccc(C)cc2)c1O ZINC000037770031 326861071 /nfs/dbraw/zinc/86/10/71/326861071.db2.gz JGHSCASIJSJKCV-CYBMUJFWSA-N 1 0 271.360 3.560 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)c1O ZINC000403399834 327331110 /nfs/dbraw/zinc/33/11/10/327331110.db2.gz OMJAJUZTWRGQTM-GRYCIOLGSA-N 1 0 295.810 3.580 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CC[C@H](c2ccccc2)O1)c1ccccc1O ZINC000377587046 329019472 /nfs/dbraw/zinc/01/94/72/329019472.db2.gz LQAOJSDYFQZANJ-IDHHARJASA-N 1 0 297.398 3.963 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CC[C@H](c2ccccc2)O1)c1ccccc1O ZINC000377587047 329019608 /nfs/dbraw/zinc/01/96/08/329019608.db2.gz LQAOJSDYFQZANJ-ZSZQSSIHSA-N 1 0 297.398 3.963 20 10 CHCDRO COc1ccc2c(c1)OCC[C@H]2[NH2+][C@@H](C)c1ccccc1O ZINC000378629393 329057053 /nfs/dbraw/zinc/05/70/53/329057053.db2.gz DJZVSASDSGFIDJ-BLLLJJGKSA-N 1 0 299.370 3.575 20 10 CHCDRO COc1cccc2c1OCC[C@H]2[NH2+][C@@H](C)c1ccccc1O ZINC000378630016 329057240 /nfs/dbraw/zinc/05/72/40/329057240.db2.gz GDCKPYDHAMOMDM-SWLSCSKDSA-N 1 0 299.370 3.575 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cccnc1C)c1ccc(C)cc1O ZINC000527984789 330298641 /nfs/dbraw/zinc/29/86/41/330298641.db2.gz DRDVBCPGSRQQCP-MRXNPFEDSA-N 1 0 270.376 3.645 20 10 CHCDRO C[C@@H]([NH2+]Cc1cc(Cl)ccc1O)[C@@H]1C[C@H]1C1CC1 ZINC000529617808 333501597 /nfs/dbraw/zinc/50/15/97/333501597.db2.gz PJZFFJPRYIASIS-IIMNLJJBSA-N 1 0 265.784 3.570 20 10 CHCDRO Oc1ccccc1C[NH2+][C@H]1CCc2cc(Cl)ccc21 ZINC000134230259 334084927 /nfs/dbraw/zinc/08/49/27/334084927.db2.gz XOSDZVHOOBGKNV-HNNXBMFYSA-N 1 0 273.763 3.823 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1C[C@H](C)[C@H]1C ZINC000385713276 336154795 /nfs/dbraw/zinc/15/47/95/336154795.db2.gz VSDSWFYGIPVPCC-YWPYICTPSA-N 1 0 256.393 3.621 20 10 CHCDRO CC(C)[C@@H]1C[C@H]([NH2+][C@@H](C)c2cc(Cl)ccc2O)CCO1 ZINC000273482407 519805949 /nfs/dbraw/zinc/80/59/49/519805949.db2.gz MGVVBLHMWWBDQO-GHJWDPDVSA-N 1 0 297.826 3.900 20 10 CHCDRO CC(C)[C@H]1C[C@H]([NH2+][C@@H](C)c2ccc(N(C)C)cc2)CCO1 ZINC000271588997 519827886 /nfs/dbraw/zinc/82/78/86/519827886.db2.gz SSBGSMOUJBLFPP-YXJHDRRASA-N 1 0 290.451 3.607 20 10 CHCDRO CC(C)n1ncc2c1[C@@H]([NH2+][C@@H](C)c1ccccc1O)CCC2 ZINC000364882159 520076610 /nfs/dbraw/zinc/07/66/10/520076610.db2.gz KNAYBMFJKVPRCI-BBRMVZONSA-N 1 0 299.418 3.898 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]C2CC(F)(F)C2)cc1 ZINC000277046450 520285510 /nfs/dbraw/zinc/28/55/10/520285510.db2.gz GPDOYCBAOVMOTQ-LLVKDONJSA-N 1 0 268.351 3.591 20 10 CHCDRO CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)c1ccc(F)cc1[O-] ZINC000062744832 520632041 /nfs/dbraw/zinc/63/20/41/520632041.db2.gz OWVWYCONVYSTEM-KGLIPLIRSA-N 1 0 296.430 3.692 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2cccnc2)cc1 ZINC000020127954 520910330 /nfs/dbraw/zinc/91/03/30/520910330.db2.gz HNXQYKURAGNWNY-OAHLLOKOSA-N 1 0 283.419 3.779 20 10 CHCDRO CCCc1cccc(C[NH2+]Cc2cccc(OC)c2O)c1 ZINC000289379005 521430820 /nfs/dbraw/zinc/43/08/20/521430820.db2.gz CCAGKCLCFFMCKE-UHFFFAOYSA-N 1 0 285.387 3.643 20 10 CHCDRO CCC[N@H+](CCc1ccccn1)Cc1cccc(C)c1O ZINC000289756474 521673324 /nfs/dbraw/zinc/67/33/24/521673324.db2.gz JMCYBDSHSGVAMS-UHFFFAOYSA-N 1 0 284.403 3.550 20 10 CHCDRO CCC[N@H+](Cc1nc(C)c(C)s1)Cc1ccccc1O ZINC000088602565 521692805 /nfs/dbraw/zinc/69/28/05/521692805.db2.gz XWPOCPJTWXPSHD-UHFFFAOYSA-N 1 0 290.432 3.878 20 10 CHCDRO CCOCCCC[NH2+][C@H](CC)c1ccc(C)cc1O ZINC000279930648 521704303 /nfs/dbraw/zinc/70/43/03/521704303.db2.gz ARNSQFFZYDFONO-OAHLLOKOSA-N 1 0 265.397 3.558 20 10 CHCDRO CCc1nc(C)c(C[NH2+]Cc2cc(Cl)cc(C)c2O)o1 ZINC000292815842 522206400 /nfs/dbraw/zinc/20/64/00/522206400.db2.gz PGXOTNPEZSXIIR-UHFFFAOYSA-N 1 0 294.782 3.503 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](O)c1ccsc1)c1ccc(C)cc1O ZINC000279970150 522614278 /nfs/dbraw/zinc/61/42/78/522614278.db2.gz CYPHWHCLYKRUAZ-GOEBONIOSA-N 1 0 291.416 3.536 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CSCCS1)c1ccc(C)cc1O ZINC000280082569 522634980 /nfs/dbraw/zinc/63/49/80/522634980.db2.gz LUIDMGJGQHUAHK-JSGCOSHPSA-N 1 0 297.489 3.590 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCO[C@@H](C(C)C)C1)c1ccccc1O ZINC000274930813 522719950 /nfs/dbraw/zinc/71/99/50/522719950.db2.gz QUTGWAOXVKXKTI-UKPHBRMFSA-N 1 0 277.408 3.637 20 10 CHCDRO CC[C@@H]([NH2+]C1CC(F)(F)C1)c1ccc(N(C)C)cc1 ZINC000277193494 522810288 /nfs/dbraw/zinc/81/02/88/522810288.db2.gz VCEQWAATCBDQQJ-CQSZACIVSA-N 1 0 268.351 3.591 20 10 CHCDRO CC[C@@H]([NH2+]CC1([C@H](C)CCO)CCC1)c1ccccc1O ZINC000274741694 522820057 /nfs/dbraw/zinc/82/00/57/522820057.db2.gz FKWHEGNLOLHTGY-GDBMZVCRSA-N 1 0 291.435 3.622 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1COc2ccccc21)c1ccccc1O ZINC000289846632 522867572 /nfs/dbraw/zinc/86/75/72/522867572.db2.gz BBSPWPUSPVSTJL-XJKSGUPXSA-N 1 0 283.371 3.609 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccccc1)c1ccc(C)cc1O ZINC000280221006 522884992 /nfs/dbraw/zinc/88/49/92/522884992.db2.gz USONZRXMGAJUNX-MRXNPFEDSA-N 1 0 255.361 3.942 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CCCc2c1cnn2C)c1ccc(C)cc1O ZINC000280272573 522949567 /nfs/dbraw/zinc/94/95/67/522949567.db2.gz YABYPQNEXFHBIX-CVEARBPZSA-N 1 0 299.418 3.552 20 10 CHCDRO CC[C@@H](c1ccncc1)[N@H+](C)Cc1cc(C)c(C)cc1O ZINC000290488833 523121916 /nfs/dbraw/zinc/12/19/16/523121916.db2.gz OMTGQLULWYBLJN-KRWDZBQOSA-N 1 0 284.403 3.987 20 10 CHCDRO CCn1ccnc1[C@@H]1CCCC[N@@H+]1Cc1cc(C)ccc1O ZINC000281087836 523552873 /nfs/dbraw/zinc/55/28/73/523552873.db2.gz JXNXVMZPIZNUOE-INIZCTEOSA-N 1 0 299.418 3.644 20 10 CHCDRO CC[C@H](C)[NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1 ZINC000157733540 524002436 /nfs/dbraw/zinc/00/24/36/524002436.db2.gz UKQBIZGPBGPVEE-LBPRGKRZSA-N 1 0 298.377 3.645 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)c2ccccc2OC)cc1C ZINC000035052664 524090133 /nfs/dbraw/zinc/09/01/33/524090133.db2.gz IGDFBUBUPAHVJY-CQSZACIVSA-N 1 0 285.387 3.863 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2cccc3c2OCO3)c(O)c1 ZINC000293242534 524333800 /nfs/dbraw/zinc/33/38/00/524333800.db2.gz BGGISYGKRZYDFW-ZDUSSCGKSA-N 1 0 299.370 3.589 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)c2cc(F)ccc2O)s1 ZINC000094618036 524602465 /nfs/dbraw/zinc/60/24/65/524602465.db2.gz APXWKRYNTABCFR-SNVBAGLBSA-N 1 0 265.353 3.752 20 10 CHCDRO COc1ccccc1[C@@H](C)[NH2+][C@H](C)c1cc(F)ccc1O ZINC000094616808 524724487 /nfs/dbraw/zinc/72/44/87/524724487.db2.gz HBECQTMPITVVQH-VXGBXAGGSA-N 1 0 289.350 3.952 20 10 CHCDRO COc1ccc(O)c(C[NH2+]CC(C)(C)c2cccs2)c1 ZINC000127068696 524751226 /nfs/dbraw/zinc/75/12/26/524751226.db2.gz BBSVEWCQXPFESZ-UHFFFAOYSA-N 1 0 291.416 3.530 20 10 CHCDRO CSC1(C[NH2+]Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000193658188 525333034 /nfs/dbraw/zinc/33/30/34/525333034.db2.gz XGHFMMVMHSPELY-UHFFFAOYSA-N 1 0 290.476 3.662 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H](C)CCc2ccc(O)cc2)c1 ZINC000071407902 525351796 /nfs/dbraw/zinc/35/17/96/525351796.db2.gz XXUWXZFAPJRCOR-AWEZNQCLSA-N 1 0 285.387 3.517 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2c(F)cncc2F)c1 ZINC000285731444 525363405 /nfs/dbraw/zinc/36/34/05/525363405.db2.gz QTYWWSGWYCKREH-MNOVXSKESA-N 1 0 292.329 3.786 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccccn1 ZINC000037218853 525445733 /nfs/dbraw/zinc/44/57/33/525445733.db2.gz DJCWAKDOFLTLMW-HNNXBMFYSA-N 1 0 281.403 3.533 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cccc([N+](=O)[O-])c1 ZINC000070869295 525446053 /nfs/dbraw/zinc/44/60/53/525446053.db2.gz ZXJVUBAKBTXNTP-ZDUSSCGKSA-N 1 0 299.374 3.512 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(F)c(F)c1)c1ccc(N(C)C)cc1 ZINC000049577475 525523764 /nfs/dbraw/zinc/52/37/64/525523764.db2.gz QFAMJDGZKZATJY-GFCCVEGCSA-N 1 0 290.357 3.882 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)CCc1ccc(O)cc1)c1ccccc1O ZINC000037140278 525595094 /nfs/dbraw/zinc/59/50/94/525595094.db2.gz KVFOKGGRXHSFIB-UONOGXRCSA-N 1 0 285.387 3.770 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)c1cc(F)ccc1O)c1ccccc1 ZINC000094616548 525658147 /nfs/dbraw/zinc/65/81/47/525658147.db2.gz CYAKLAOOEDQXMZ-VXGBXAGGSA-N 1 0 259.324 3.943 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCCc2occc21)c1cc(F)ccc1O ZINC000094617008 525681600 /nfs/dbraw/zinc/68/16/00/525681600.db2.gz SOIPIERAOFOPDQ-YGRLFVJLSA-N 1 0 275.323 3.853 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCC(C)(F)F)c(O)c1C ZINC000297255608 525725418 /nfs/dbraw/zinc/72/54/18/525725418.db2.gz JPNPYKKOGDOGOW-LLVKDONJSA-N 1 0 257.324 3.705 20 10 CHCDRO Cc1cnc(C(C)(C)[NH2+]Cc2cc(C)c(C)cc2O)s1 ZINC000080346835 525981966 /nfs/dbraw/zinc/98/19/66/525981966.db2.gz LVRNLXZYCTUIBM-UHFFFAOYSA-N 1 0 290.432 3.799 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@@H]1CCOc3ccc(F)cc31)CC2 ZINC000296799812 526368430 /nfs/dbraw/zinc/36/84/30/526368430.db2.gz LJWYPCFBVSDCMC-CABCVRRESA-N 1 0 299.345 3.632 20 10 CHCDRO Cc1cccc(C[N@@H+](Cc2ccccn2)CC(C)C)c1O ZINC000055182847 570241270 /nfs/dbraw/zinc/24/12/70/570241270.db2.gz WNIYHVQRDXMURH-UHFFFAOYSA-N 1 0 284.403 3.754 20 10 CHCDRO COc1cc(C[NH2+]Cc2c(O)cccc2Cl)ccc1C ZINC000113329491 1125494643 /nfs/dbraw/zinc/49/46/43/1125494643.db2.gz HSASZXOGCOKGCK-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO Cc1cccnc1[C@H]([NH2+]Cc1ccc(N(C)C)cc1)C(C)C ZINC000115623022 1125505725 /nfs/dbraw/zinc/50/57/25/1125505725.db2.gz UGUZVLORGFHYHX-GOSISDBHSA-N 1 0 297.446 3.943 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC[C@@H](C(F)(F)F)C2(C)C)c1 ZINC000312743310 1120589237 /nfs/dbraw/zinc/58/92/37/1120589237.db2.gz YDIXIHHPSBGZPO-CYBMUJFWSA-N 1 0 287.325 3.863 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)CC2CCC2)c1 ZINC000710247507 1121474620 /nfs/dbraw/zinc/47/46/20/1121474620.db2.gz WBVXKIQNRDZUNF-RYUDHWBXSA-N 1 0 263.381 3.630 20 10 CHCDRO CC[C@@H]([NH2+]CCc1cscn1)c1cc(Cl)ccc1O ZINC000775513027 1122634466 /nfs/dbraw/zinc/63/44/66/1122634466.db2.gz DXTGEOSSNXZBDA-CYBMUJFWSA-N 1 0 296.823 3.786 20 10 CHCDRO CC[C@@H]1CC[C@H](C)[N@@H+]1Cc1ccc(N(C)C)c(C)c1 ZINC001192645509 1122654880 /nfs/dbraw/zinc/65/48/80/1122654880.db2.gz NRIOPXPZMKGLTH-GOEBONIOSA-N 1 0 260.425 3.824 20 10 CHCDRO [O-]c1c(F)cc(Cl)cc1C[N@@H+]1CCC[C@@H]1C1CCC1 ZINC000775670160 1122884700 /nfs/dbraw/zinc/88/47/00/1122884700.db2.gz UQRYCZBWMKGIOX-CQSZACIVSA-N 1 0 283.774 3.949 20 10 CHCDRO CCC(C)(C)[C@@H](C)[NH2+][C@H](C)c1cccc(OC)c1O ZINC000850502246 1123275880 /nfs/dbraw/zinc/27/58/80/1123275880.db2.gz MJCXWRHAKJBFPE-VXGBXAGGSA-N 1 0 265.397 3.876 20 10 CHCDRO CC[C@@H]([NH2+]CCC1(CSC)CC1)c1ccccc1O ZINC000850506735 1123276674 /nfs/dbraw/zinc/27/66/74/1123276674.db2.gz LAGMUSPUMBJUSF-CQSZACIVSA-N 1 0 279.449 3.966 20 10 CHCDRO CCSC1(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)CC1 ZINC000850553541 1123290284 /nfs/dbraw/zinc/29/02/84/1123290284.db2.gz YMDPEBBZEMMICY-JTQLQIEISA-N 1 0 285.840 3.982 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2C(C)(C)C2(F)F)c1 ZINC000850552884 1123290292 /nfs/dbraw/zinc/29/02/92/1123290292.db2.gz QHCKVEMVXPXCTM-MFKMUULPSA-N 1 0 269.335 3.643 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@@H+]2CCC[C@H](CCF)C2)c1 ZINC000853564095 1123443984 /nfs/dbraw/zinc/44/39/84/1123443984.db2.gz JNWNAPCDIWICGD-CQSZACIVSA-N 1 0 265.372 3.581 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H](C)CCC2CC2)c1O ZINC000846163853 1131693027 /nfs/dbraw/zinc/69/30/27/1131693027.db2.gz MEJGNSURTLSMJA-NEPJUHHUSA-N 1 0 263.381 3.630 20 10 CHCDRO C[C@H]1CCC[C@H](C)[NH+]1Cc1ccc(Cl)cc1O ZINC001140461953 1131748871 /nfs/dbraw/zinc/74/88/71/1131748871.db2.gz ZWWNRSKJVHYIJW-QWRGUYRKSA-N 1 0 253.773 3.809 20 10 CHCDRO CC(=O)c1cc(Cl)cc(C[N@H+]2CCCC[C@H]2C)c1O ZINC000037322572 1132028198 /nfs/dbraw/zinc/02/81/98/1132028198.db2.gz VJVQQHMAHDJXAC-SNVBAGLBSA-N 1 0 281.783 3.623 20 10 CHCDRO CCOCC(C)(C)C[NH2+]Cc1c(O)cc(C)cc1Cl ZINC000840946880 1132311061 /nfs/dbraw/zinc/31/10/61/1132311061.db2.gz PXWYNOMFXHDSBE-UHFFFAOYSA-N 1 0 285.815 3.506 20 10 CHCDRO CC1CC[NH+](Cc2ccc(C(F)(F)F)cc2O)CC1 ZINC001233451611 1132625752 /nfs/dbraw/zinc/62/57/52/1132625752.db2.gz RPGVLQMUOKJODL-UHFFFAOYSA-N 1 0 273.298 3.643 20 10 CHCDRO COc1ccc(CC[C@H](C)[NH2+]Cc2ccccc2O)cc1 ZINC000134230711 1125544587 /nfs/dbraw/zinc/54/45/87/1125544587.db2.gz CPEGTZYRARTYBP-AWEZNQCLSA-N 1 0 285.387 3.512 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CC[C@@H]([C@@H]2CCCO2)C1 ZINC000884482663 1125567587 /nfs/dbraw/zinc/56/75/87/1125567587.db2.gz GEDKAKKDTFRYBR-BEFAXECRSA-N 1 0 297.398 3.546 20 10 CHCDRO CO[C@H](C[NH2+][C@@H](C)c1c(C)cc(C)cc1O)CC(C)C ZINC000841754706 1125585664 /nfs/dbraw/zinc/58/56/64/1125585664.db2.gz BOOQFFJAYGIPSL-GJZGRUSLSA-N 1 0 279.424 3.721 20 10 CHCDRO CCn1cc([C@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2O)cn1 ZINC000841755524 1125592466 /nfs/dbraw/zinc/59/24/66/1125592466.db2.gz IHNDGUOIAAIRLV-QWRGUYRKSA-N 1 0 293.798 3.674 20 10 CHCDRO CC[NH+](CC)Cc1ccccc1Nc1cccc(O)c1O ZINC001211994044 1125614564 /nfs/dbraw/zinc/61/45/64/1125614564.db2.gz KSCFWXWGQONQMK-UHFFFAOYSA-N 1 0 286.375 3.683 20 10 CHCDRO CCOc1cccc(C[N@H+]2[C@H](CC)CC[C@@H]2C)c1O ZINC000136821571 1125647733 /nfs/dbraw/zinc/64/77/33/1125647733.db2.gz QXRZNKQAVXPVON-GXTWGEPZSA-N 1 0 263.381 3.554 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H]2CCOC3(CCCCC3)C2)c1 ZINC000136744488 1125647853 /nfs/dbraw/zinc/64/78/53/1125647853.db2.gz IJQDUUORCNZFKH-MRXNPFEDSA-N 1 0 289.419 3.672 20 10 CHCDRO CCOc1cccc(C[NH2+]Cc2cscc2Cl)c1O ZINC000886199015 1125661797 /nfs/dbraw/zinc/66/17/97/1125661797.db2.gz IBNBHVLCRNHIJX-UHFFFAOYSA-N 1 0 297.807 3.796 20 10 CHCDRO COc1ccc(C[NH2+]Cc2cccc3cc[nH]c32)cc1C ZINC000237436082 1125710932 /nfs/dbraw/zinc/71/09/32/1125710932.db2.gz CBVRRIJIWFAUPL-UHFFFAOYSA-N 1 0 280.371 3.775 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCC2(CCC2)CO1)c1cc(F)ccc1O ZINC000886731099 1125713692 /nfs/dbraw/zinc/71/36/92/1125713692.db2.gz UZTVSOKTRJJNEM-GXTWGEPZSA-N 1 0 293.382 3.531 20 10 CHCDRO Oc1ccc2ccncc2c1C[N@@H+]1CCc2ccsc2C1 ZINC000760284822 1125718402 /nfs/dbraw/zinc/71/84/02/1125718402.db2.gz GTJDVQFHXRISLJ-UHFFFAOYSA-N 1 0 296.395 3.560 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CC[C@H]2CCCC[C@H]2C1 ZINC000300416155 1125726154 /nfs/dbraw/zinc/72/61/54/1125726154.db2.gz LPMLKPNHKOSOPK-OLZOCXBDSA-N 1 0 263.356 3.543 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C2(C)CC=CC2)cc1Cl ZINC000826534626 1125748161 /nfs/dbraw/zinc/74/81/61/1125748161.db2.gz IOKLCXSXFUAIES-UHFFFAOYSA-N 1 0 251.757 3.552 20 10 CHCDRO CSc1cc(C)cc(C[N@@H+]2CCc3cccc(O)c3C2)c1 ZINC001238681239 1131231375 /nfs/dbraw/zinc/23/13/75/1131231375.db2.gz HPWGQSPGMCNXPP-UHFFFAOYSA-N 1 0 299.439 3.981 20 10 CHCDRO CCC[N@H+](Cc1scnc1C)Cc1ccccc1O ZINC000092705057 1125761805 /nfs/dbraw/zinc/76/18/05/1125761805.db2.gz OSZWFFFKWOEIPU-UHFFFAOYSA-N 1 0 276.405 3.569 20 10 CHCDRO C[C@@H]([NH2+]Cc1cnc(Cl)s1)c1ccc(N(C)C)cc1 ZINC000718187618 1129257732 /nfs/dbraw/zinc/25/77/32/1129257732.db2.gz PHWBABIROVPZBS-SNVBAGLBSA-N 1 0 295.839 3.713 20 10 CHCDRO CC[C@H]([NH2+]Cc1ncc(Cl)s1)c1ccccc1O ZINC000719395048 1129332205 /nfs/dbraw/zinc/33/22/05/1129332205.db2.gz OHTKWENUQAZXQA-JTQLQIEISA-N 1 0 282.796 3.743 20 10 CHCDRO CCCC[N@H+](C/C=C\Cl)Cc1ccccc1O ZINC000801597719 1129931785 /nfs/dbraw/zinc/93/17/85/1129931785.db2.gz NGFJTTVEMQAFTA-TWGQIWQCSA-N 1 0 253.773 3.747 20 10 CHCDRO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1cccc(C)c1O ZINC000158081685 1126746037 /nfs/dbraw/zinc/74/60/37/1126746037.db2.gz WFFOBUCZOZIMRK-AWEZNQCLSA-N 1 0 285.387 3.868 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C2(c3cccc(F)c3)CC2)cc1C ZINC000174420976 1126770161 /nfs/dbraw/zinc/77/01/61/1126770161.db2.gz BPKNHEUFVIUVNZ-UHFFFAOYSA-N 1 0 285.362 3.927 20 10 CHCDRO O=C(C[C@@H]1CCC[N@H+]1Cc1ccccc1O)c1ccccc1 ZINC000179580165 1126831147 /nfs/dbraw/zinc/83/11/47/1126831147.db2.gz GAWAOEMWSXRRBI-KRWDZBQOSA-N 1 0 295.382 3.630 20 10 CHCDRO CCCCCC[C@@H](C)[NH2+]Cc1cc2c(cc1O)OCO2 ZINC000042880055 1126837209 /nfs/dbraw/zinc/83/72/09/1126837209.db2.gz FCDPADBUGYYAFL-GFCCVEGCSA-N 1 0 279.380 3.569 20 10 CHCDRO Cc1nc(C)c([C@@H](C)[N@H+](C)Cc2cccc(C)c2O)s1 ZINC000180153903 1126840372 /nfs/dbraw/zinc/84/03/72/1126840372.db2.gz RLMJADHIDHPGOC-GFCCVEGCSA-N 1 0 290.432 3.967 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)Cc2ccncc2)cc1 ZINC000180866578 1126849298 /nfs/dbraw/zinc/84/92/98/1126849298.db2.gz SMNHQUPTBAODCZ-UHFFFAOYSA-N 1 0 283.419 3.560 20 10 CHCDRO Cc1cnc([C@H](C)C[NH2+][C@H](C)c2cc(F)ccc2O)s1 ZINC000183198790 1126882765 /nfs/dbraw/zinc/88/27/65/1126882765.db2.gz TUTJPWQMBPHLHA-MWLCHTKSSA-N 1 0 294.395 3.751 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCOc2ccccc21)c1ccccc1O ZINC000183504727 1126887434 /nfs/dbraw/zinc/88/74/34/1126887434.db2.gz NJDYZEUBTUQLHF-KGLIPLIRSA-N 1 0 283.371 3.609 20 10 CHCDRO CCc1ccc([C@H](COC)[NH2+][C@H](C)c2ccccc2O)o1 ZINC000183530185 1126888877 /nfs/dbraw/zinc/88/88/77/1126888877.db2.gz FCNMNCRQAMFMOX-DOMZBBRYSA-N 1 0 289.375 3.586 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCOc2ccc(F)cc21)c1ccccc1O ZINC000183599209 1126889755 /nfs/dbraw/zinc/88/97/55/1126889755.db2.gz LBRLDGFOJGJWAR-XHDPSFHLSA-N 1 0 287.334 3.706 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1cc(C)ccc1O)c1ccncc1 ZINC000185540940 1126900541 /nfs/dbraw/zinc/90/05/41/1126900541.db2.gz WDFDXUUCWFLESV-CZUORRHYSA-N 1 0 270.376 3.898 20 10 CHCDRO COC[C@H]([NH2+][C@@H](C)c1ccc(C)cc1O)c1ccc(C)o1 ZINC000185630813 1126901065 /nfs/dbraw/zinc/90/10/65/1126901065.db2.gz SLOMKYBQJJBJIL-ZFWWWQNUSA-N 1 0 289.375 3.640 20 10 CHCDRO CC[C@H]([NH2+]CC[C@](C)(O)c1ccccc1)c1ccccc1O ZINC000187889856 1126917005 /nfs/dbraw/zinc/91/70/05/1126917005.db2.gz JIFSWMOEHAFFKU-HKUYNNGSSA-N 1 0 299.414 3.731 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCC[C@@H]1CCO)c1ccc2ccccc2c1O ZINC000187975039 1126917425 /nfs/dbraw/zinc/91/74/25/1126917425.db2.gz QPRHFEQVTDMZFN-DDUZABMNSA-N 1 0 299.414 3.747 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H](C)c2cccc(O)c2)cc1C ZINC000192367468 1126961021 /nfs/dbraw/zinc/96/10/21/1126961021.db2.gz GFZCVEPPXPIBFX-CYBMUJFWSA-N 1 0 271.360 3.565 20 10 CHCDRO CSC1(C[NH2+][C@H](C)c2cc(Cl)ccc2O)CC1 ZINC000193821563 1126971246 /nfs/dbraw/zinc/97/12/46/1126971246.db2.gz FKRGUNYHSXNWTI-SECBINFHSA-N 1 0 271.813 3.592 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@H](C)C2CCCCCC2)c1 ZINC000150091070 1127043706 /nfs/dbraw/zinc/04/37/06/1127043706.db2.gz XLFUBDAMELRCPF-CYBMUJFWSA-N 1 0 277.408 3.849 20 10 CHCDRO COc1ccc(C[NH2+][C@H]2CCO[C@H](C(C)(C)C)C2)cc1C ZINC000270659876 1127060094 /nfs/dbraw/zinc/06/00/94/1127060094.db2.gz OCDHYHYSAGBPKQ-RDJZCZTQSA-N 1 0 291.435 3.687 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+]C1(C2CC2)CCC1 ZINC000717820551 1127072206 /nfs/dbraw/zinc/07/22/06/1127072206.db2.gz WIODOZUKUOBKPS-UHFFFAOYSA-N 1 0 268.404 3.909 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[NH2+]C1(C2CC2)CCC1 ZINC000717837339 1127094761 /nfs/dbraw/zinc/09/47/61/1127094761.db2.gz NIQSWLJZTCWNBS-UHFFFAOYSA-N 1 0 270.420 3.709 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H]2CCO[C@H](C)C2)cc1 ZINC000271639876 1127095855 /nfs/dbraw/zinc/09/58/55/1127095855.db2.gz ZOFJTRWQCGCUMC-OWCLPIDISA-N 1 0 290.451 3.608 20 10 CHCDRO C[C@@H]1CCCC[N@H+](Cc2c(O)ccc(F)c2Cl)C1 ZINC001237122555 1131056887 /nfs/dbraw/zinc/05/68/87/1131056887.db2.gz VYZMQHQWXPIRQT-SNVBAGLBSA-N 1 0 271.763 3.807 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H]2C[C@@H]2c2ccccc2)c1 ZINC000044674243 1127156318 /nfs/dbraw/zinc/15/63/18/1127156318.db2.gz PMHZEHZHTHLWTC-CSMYWGQOSA-N 1 0 283.371 3.608 20 10 CHCDRO CCc1cnc(CN(C)Cc2cc(C)cc(C)c2O)s1 ZINC000164447186 1127166310 /nfs/dbraw/zinc/16/63/10/1127166310.db2.gz RNYUPOXSWVGCDM-UHFFFAOYSA-N 1 0 290.432 3.660 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CCc2ccccc2O)c(O)c1 ZINC000284214268 1127178194 /nfs/dbraw/zinc/17/81/94/1127178194.db2.gz SWJVIPCIFMOAPH-CQSZACIVSA-N 1 0 285.387 3.608 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CC[C@@H]2CCCCO2)c(O)c1 ZINC000285400515 1127226099 /nfs/dbraw/zinc/22/60/99/1127226099.db2.gz XCWSSHWPMHQOIJ-GJZGRUSLSA-N 1 0 277.408 3.619 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1CCCSC1)c1ccc(C)cc1O ZINC000286973784 1127278160 /nfs/dbraw/zinc/27/81/60/1127278160.db2.gz IQLGVXJTEMWDSR-DZGCQCFKSA-N 1 0 279.449 3.885 20 10 CHCDRO [O-]c1c(Br)cccc1C[NH2+]C1(C2CC2)CCC1 ZINC000717848694 1127307077 /nfs/dbraw/zinc/30/70/77/1127307077.db2.gz GRVRKFWHZCDULY-UHFFFAOYSA-N 1 0 296.208 3.577 20 10 CHCDRO COc1ccc([C@@H](C)[NH2+]Cc2cc(F)ccc2O)cc1F ZINC000226582995 1127411712 /nfs/dbraw/zinc/41/17/12/1127411712.db2.gz MRSPOVDWLPPERG-SNVBAGLBSA-N 1 0 293.313 3.530 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)C[C@@H]2C[C@@H]2C)cc1 ZINC001308646015 1127413601 /nfs/dbraw/zinc/41/36/01/1127413601.db2.gz ZFPYXCOMONBRJH-HOCLYGCPSA-N 1 0 260.425 3.621 20 10 CHCDRO COc1cc(C)c(C[NH2+]CC2CCCCCC2)c(O)c1 ZINC001308766593 1127463181 /nfs/dbraw/zinc/46/31/81/1127463181.db2.gz MVQRVQYTCQGICD-UHFFFAOYSA-N 1 0 277.408 3.769 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1CCCS1)c1ccc(N(C)C)cc1 ZINC000168688221 1127461513 /nfs/dbraw/zinc/46/15/13/1127461513.db2.gz OYYFVNJUCJNOAX-HZPDHXFCSA-N 1 0 278.465 3.689 20 10 CHCDRO C[C@H]([NH2+]C1CC(C)C1)c1ccc2ccccc2c1O ZINC000168838474 1127472178 /nfs/dbraw/zinc/47/21/78/1127472178.db2.gz XXTVFKYGNPIUSH-LXVYMNJGSA-N 1 0 255.361 3.995 20 10 CHCDRO CC(C)c1cc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)on1 ZINC000169228353 1127491605 /nfs/dbraw/zinc/49/16/05/1127491605.db2.gz BLWYWTJIYBWXTH-ZDUSSCGKSA-N 1 0 287.407 3.715 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2cccc(F)c2)c(O)c1 ZINC000293622910 1127508932 /nfs/dbraw/zinc/50/89/32/1127508932.db2.gz HCAMZUISWDZMCC-ZDUSSCGKSA-N 1 0 273.351 3.999 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCCCC[NH+]2CCCC2)c(O)c1 ZINC000293649613 1127510573 /nfs/dbraw/zinc/51/05/73/1127510573.db2.gz HTLFUFSRWOWGNS-MRXNPFEDSA-N 1 0 290.451 3.617 20 10 CHCDRO CC(C)c1ccc(O)c(C[NH2+]CCC(C)(C)F)c1 ZINC001308855908 1127515067 /nfs/dbraw/zinc/51/50/67/1127515067.db2.gz SOVDLGWWEXGMHX-UHFFFAOYSA-N 1 0 253.361 3.743 20 10 CHCDRO COc1cccc(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)c1 ZINC000293765068 1127518717 /nfs/dbraw/zinc/51/87/17/1127518717.db2.gz PGHMHALZCPMSRU-AWEZNQCLSA-N 1 0 285.387 3.868 20 10 CHCDRO Nc1ccc(C[N@@H+]2CCC[C@]3(CC=CCC3)C2)cc1 ZINC001120370991 1127520875 /nfs/dbraw/zinc/52/08/75/1127520875.db2.gz LWUQCQQQUIUNQB-QGZVFWFLSA-N 1 0 256.393 3.591 20 10 CHCDRO COc1cc(Cl)cc(C[N@H+](C)CC(C)(C)C)c1O ZINC000228630971 1127576229 /nfs/dbraw/zinc/57/62/29/1127576229.db2.gz PVGRSZNCUNAZRT-UHFFFAOYSA-N 1 0 271.788 3.532 20 10 CHCDRO CC[N@@H+](Cc1cc(Cl)cc(OC)c1O)CC(C)C ZINC000228607256 1127571777 /nfs/dbraw/zinc/57/17/77/1127571777.db2.gz IXRCHPYQMHATEK-UHFFFAOYSA-N 1 0 271.788 3.532 20 10 CHCDRO CC(C)(C[NH2+]Cc1c(O)cccc1Cl)c1ccccn1 ZINC000294715822 1127593804 /nfs/dbraw/zinc/59/38/04/1127593804.db2.gz DZDLQWMHAXXQBD-UHFFFAOYSA-N 1 0 290.794 3.508 20 10 CHCDRO C[C@@H](Cc1cccs1)[NH2+][C@H]1CCc2cccc(O)c21 ZINC000295974601 1129220790 /nfs/dbraw/zinc/22/07/90/1129220790.db2.gz MVIULIGRMYTHOM-FZMZJTMJSA-N 1 0 273.401 3.662 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2cc(F)cnc2Cl)c1 ZINC000296245885 1127666370 /nfs/dbraw/zinc/66/63/70/1127666370.db2.gz BADMUUIXEXMGKF-JTQLQIEISA-N 1 0 294.757 3.739 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@@H]1CCOc3ccc(F)cc31)CC2 ZINC000296799825 1127683420 /nfs/dbraw/zinc/68/34/20/1127683420.db2.gz LJWYPCFBVSDCMC-HUUCEWRRSA-N 1 0 299.345 3.632 20 10 CHCDRO Cc1cc(C)c(C[NH2+][C@@H]2CCc3cc(F)ccc3C2)c(O)c1 ZINC001168415887 1127680610 /nfs/dbraw/zinc/68/06/10/1127680610.db2.gz SCRBAFJKZUMOJW-QGZVFWFLSA-N 1 0 299.389 3.795 20 10 CHCDRO C[C@@H]([NH2+]Cc1cc(Cl)ccc1O)c1ccsc1 ZINC000061360800 1127685840 /nfs/dbraw/zinc/68/58/40/1127685840.db2.gz NWAPLRLZMNVURO-SECBINFHSA-N 1 0 267.781 3.958 20 10 CHCDRO CCOCc1cc(C[NH2+]C(C)(CC)CC)ccc1OC ZINC000172074165 1127745325 /nfs/dbraw/zinc/74/53/25/1127745325.db2.gz DRLPNGPNWFTUMZ-UHFFFAOYSA-N 1 0 279.424 3.900 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CC[C@@H](C)C1)c1cc(F)ccc1O ZINC000230413071 1127752205 /nfs/dbraw/zinc/75/22/05/1127752205.db2.gz WCRLUSGGDHFJDC-IJLUTSLNSA-N 1 0 251.345 3.618 20 10 CHCDRO C[C@H]([NH2+]CC[C@H]1CCOC1)c1ccc2ccccc2c1O ZINC000230672531 1127770739 /nfs/dbraw/zinc/77/07/39/1127770739.db2.gz PXXDEJIQSDOXCA-KBPBESRZSA-N 1 0 285.387 3.623 20 10 CHCDRO C[C@H]1CCC[C@H]1C[NH2+]Cc1c(O)cccc1Cl ZINC000230667135 1127770921 /nfs/dbraw/zinc/77/09/21/1127770921.db2.gz NSKAFBHDCSXJPW-QWRGUYRKSA-N 1 0 253.773 3.571 20 10 CHCDRO CC(C)([NH2+]Cc1ccc(N2CCCCC2)cc1)C1CC1 ZINC000230674779 1127770968 /nfs/dbraw/zinc/77/09/68/1127770968.db2.gz OKDCPQMZSDSBSW-UHFFFAOYSA-N 1 0 272.436 3.955 20 10 CHCDRO CCCC1(C[NH2+][C@@H](C)c2cc(F)ccc2O)CC1 ZINC000230668549 1127771218 /nfs/dbraw/zinc/77/12/18/1127771218.db2.gz NRFBAJVRROCYFH-NSHDSACASA-N 1 0 251.345 3.762 20 10 CHCDRO CCC(CC)(C[NH2+]Cc1ccc2c(c1)CCO2)SC ZINC000230707584 1127772175 /nfs/dbraw/zinc/77/21/75/1127772175.db2.gz UDGLDTHFZVAOCN-UHFFFAOYSA-N 1 0 279.449 3.633 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2OCCc3ccccc32)c1 ZINC000371870660 1127782783 /nfs/dbraw/zinc/78/27/83/1127782783.db2.gz RRFLADLIBWVLFC-LIRRHRJNSA-N 1 0 297.398 3.665 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]CC2CCC(C)CC2)c1 ZINC000063144404 1127798471 /nfs/dbraw/zinc/79/84/71/1127798471.db2.gz IHNIIGUQMYWVDE-MOKVOYLWSA-N 1 0 277.408 3.878 20 10 CHCDRO CCSCCC[NH2+][C@@H](C)c1ccc(N(C)CC)cc1 ZINC000800492300 1127899976 /nfs/dbraw/zinc/89/99/76/1127899976.db2.gz HKEHVMATSNDCIO-AWEZNQCLSA-N 1 0 280.481 3.937 20 10 CHCDRO C[C@@H]([NH2+]CCCCF)c1ccc2ccccc2c1O ZINC000382494971 1127903862 /nfs/dbraw/zinc/90/38/62/1127903862.db2.gz IZKGKWACNJXFAX-GFCCVEGCSA-N 1 0 261.340 3.946 20 10 CHCDRO C[C@H]([NH2+]CCCCF)c1ccc2ccccc2c1O ZINC000382494974 1127904185 /nfs/dbraw/zinc/90/41/85/1127904185.db2.gz IZKGKWACNJXFAX-LBPRGKRZSA-N 1 0 261.340 3.946 20 10 CHCDRO C[C@H](CC(C)(C)O)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000296633510 1129223757 /nfs/dbraw/zinc/22/37/57/1129223757.db2.gz XNOSIUGAVQRCAD-CHWSQXEVSA-N 1 0 287.403 3.746 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C2CC2)C2CCC2)c1 ZINC000325004525 1127998328 /nfs/dbraw/zinc/99/83/28/1127998328.db2.gz BBZOZKAQBKDARH-APPDUMDISA-N 1 0 275.392 3.630 20 10 CHCDRO CC(C)[C@H]([NH2+][C@@H](C)c1cc(F)ccc1O)C1CC1 ZINC000324229945 1128160305 /nfs/dbraw/zinc/16/03/05/1128160305.db2.gz GXWMJOBWRWZBDS-BONVTDFDSA-N 1 0 251.345 3.617 20 10 CHCDRO Cc1cc(C)c(C[NH2+][C@H](C)Cc2cccc(F)c2)c(O)c1 ZINC001168465223 1128169795 /nfs/dbraw/zinc/16/97/95/1128169795.db2.gz POORRGPOSCCRFW-CQSZACIVSA-N 1 0 287.378 3.869 20 10 CHCDRO C[C@H]1CCC[C@H]([N@H+](C)Cc2cc3c(cc2O)CCC3)C1 ZINC000914785176 1128244617 /nfs/dbraw/zinc/24/46/17/1128244617.db2.gz RIUPUGBZQJNYNI-GUYCJALGSA-N 1 0 273.420 3.891 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CC[C@@H]2SC)cc1F ZINC000761988260 1128259327 /nfs/dbraw/zinc/25/93/27/1128259327.db2.gz ZKRPWQVGFYPMAD-ZBFHGGJFSA-N 1 0 296.455 3.656 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc3c(c2)C[C@H](C)O3)c(O)c1 ZINC000926917658 1128202722 /nfs/dbraw/zinc/20/27/22/1128202722.db2.gz CQNDVIYWGSNZDO-UONOGXRCSA-N 1 0 297.398 3.875 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCS[C@H](C)C1)c1ccc(N(C)C)cc1 ZINC000927032451 1128209437 /nfs/dbraw/zinc/20/94/37/1128209437.db2.gz NLAZLYOFNDIQOI-UMVBOHGHSA-N 1 0 278.465 3.687 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCCc3cccnc32)c(O)c1 ZINC000927064156 1128214484 /nfs/dbraw/zinc/21/44/84/1128214484.db2.gz PQLPBKYHQOSFQS-CJNGLKHVSA-N 1 0 282.387 3.824 20 10 CHCDRO COC/C(C)=C\C[N@H+](Cc1ccccc1O)C1CCCC1 ZINC000929635276 1128280269 /nfs/dbraw/zinc/28/02/69/1128280269.db2.gz IMUKOYSTXTVPMX-PTNGSMBKSA-N 1 0 289.419 3.730 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccccc2CF)c1 ZINC000930216662 1128307634 /nfs/dbraw/zinc/30/76/34/1128307634.db2.gz NBHSAVBZQGMGMO-LBPRGKRZSA-N 1 0 289.350 3.721 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C2Cc3ccccc3C2)cc1 ZINC000762777602 1128316899 /nfs/dbraw/zinc/31/68/99/1128316899.db2.gz GZGORINUFWBCRD-HNNXBMFYSA-N 1 0 294.442 3.961 20 10 CHCDRO C[C@H]1C[C@@H]([NH2+]C2Cc3ccccc3C2)c2c1c(F)ccc2O ZINC000762776131 1128318203 /nfs/dbraw/zinc/31/82/03/1128318203.db2.gz CWGSATOMNRNBJG-MEDUHNTESA-N 1 0 297.373 3.837 20 10 CHCDRO CCC(CC)[C@H](C[NH2+][C@H](C)c1cc(C)ccc1O)N(C)C ZINC000035628958 1128319376 /nfs/dbraw/zinc/31/93/76/1128319376.db2.gz VIJYXFMHAURGDO-PBHICJAKSA-N 1 0 292.467 3.718 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)[C@H](C)Cc1cccc(F)c1 ZINC001168499305 1128340496 /nfs/dbraw/zinc/34/04/96/1128340496.db2.gz YSNTUAOEGIEVTK-CQSZACIVSA-N 1 0 287.378 3.984 20 10 CHCDRO CC(C)(C)c1ccc(C[N@@H+]2CCC[C@H](F)C2)c(O)c1 ZINC001235677152 1128347272 /nfs/dbraw/zinc/34/72/72/1128347272.db2.gz BXYCAHBMEHRQFM-AWEZNQCLSA-N 1 0 265.372 3.624 20 10 CHCDRO Cc1ccc(F)c(C[NH2+][C@H](C)c2ccccc2O)c1F ZINC000931555337 1128368995 /nfs/dbraw/zinc/36/89/95/1128368995.db2.gz XRLYKCUPEWKNQO-LLVKDONJSA-N 1 0 277.314 3.830 20 10 CHCDRO CCC[C@H](C)CC[C@H](C)[NH2+]CCc1ccc(O)c(O)c1 ZINC001257466689 1128453404 /nfs/dbraw/zinc/45/34/04/1128453404.db2.gz FEVAIQICHYQQEU-KBPBESRZSA-N 1 0 279.424 3.835 20 10 CHCDRO Oc1cc2c(cc1C[N@@H+]1CC[C@@H]1c1ccccc1)CCC2 ZINC000917446486 1128499779 /nfs/dbraw/zinc/49/97/79/1128499779.db2.gz VHZDCZMWPSWSPU-GOSISDBHSA-N 1 0 279.383 3.828 20 10 CHCDRO CC[N@H+](Cc1cc2c(cc1O)CCC2)C1CCCC1 ZINC000917461959 1128499863 /nfs/dbraw/zinc/49/98/63/1128499863.db2.gz AJIMWFOHVVDKLY-UHFFFAOYSA-N 1 0 259.393 3.645 20 10 CHCDRO C[C@@H]([NH2+]CC(C)(C)C(C)(F)F)c1cc(F)ccc1O ZINC000699962102 1128537423 /nfs/dbraw/zinc/53/74/23/1128537423.db2.gz VWCYQXNBOGUOPT-SECBINFHSA-N 1 0 275.314 3.863 20 10 CHCDRO C[C@@H]1CCCC[C@H]1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000042859552 1128587581 /nfs/dbraw/zinc/58/75/81/1128587581.db2.gz PREOXHAETZUGAC-CJNGLKHVSA-N 1 0 259.393 3.537 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccccc1O)c1ccc(N(C)C)cc1 ZINC000154961630 1128604993 /nfs/dbraw/zinc/60/49/93/1128604993.db2.gz ZPZOSJKXCROUMZ-GOSISDBHSA-N 1 0 298.430 3.742 20 10 CHCDRO CCc1cnc(CC[NH2+][C@@H](CC)c2ccccc2O)s1 ZINC000156088984 1128625377 /nfs/dbraw/zinc/62/53/77/1128625377.db2.gz ISZVXIQFNIFBNQ-AWEZNQCLSA-N 1 0 290.432 3.695 20 10 CHCDRO Oc1cc2c(cc1C[N@@H+]1CCC[C@H]1c1ccccn1)CCC2 ZINC000919952296 1128653881 /nfs/dbraw/zinc/65/38/81/1128653881.db2.gz TXVVVKRAANTHOY-SFHVURJKSA-N 1 0 294.398 3.613 20 10 CHCDRO COc1cccc(CC[NH2+][C@@H](C)c2ccc(N(C)C)cc2)c1 ZINC000158950016 1128673010 /nfs/dbraw/zinc/67/30/10/1128673010.db2.gz SVRUIGHICPQOBW-HNNXBMFYSA-N 1 0 298.430 3.655 20 10 CHCDRO C[C@H]1[C@@H](c2ccccc2)CC[N@@H+]1Cc1cc(F)ccc1O ZINC000779022679 1128685290 /nfs/dbraw/zinc/68/52/90/1128685290.db2.gz FTTMQSNWRPCOEN-GUYCJALGSA-N 1 0 285.362 3.909 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@H](Cc2ccccc2)C(C)C)c1 ZINC000779033110 1128693957 /nfs/dbraw/zinc/69/39/57/1128693957.db2.gz VVIFMJKSDWIAPB-GOSISDBHSA-N 1 0 299.414 3.758 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc3c(c2)CCCO3)o1 ZINC000921489478 1128710638 /nfs/dbraw/zinc/71/06/38/1128710638.db2.gz JDUUJBQKASSDRF-ZDUSSCGKSA-N 1 0 271.360 3.764 20 10 CHCDRO CC(C)C[C@H](C)C[C@H](C)[NH2+]CCc1ccc(O)c(O)c1 ZINC001258056543 1128714835 /nfs/dbraw/zinc/71/48/35/1128714835.db2.gz QBDFUECEUALOFH-KBPBESRZSA-N 1 0 279.424 3.691 20 10 CHCDRO Cc1ccc(CC[C@@H](C)[NH2+]Cc2cc(F)ccc2O)o1 ZINC000779088568 1128727671 /nfs/dbraw/zinc/72/76/71/1128727671.db2.gz SAHJPAZNECPMCH-LLVKDONJSA-N 1 0 277.339 3.544 20 10 CHCDRO COc1ccc(CCC[NH2+][C@H](C)c2ccc(C)cc2O)cc1 ZINC000185095083 1117761400 /nfs/dbraw/zinc/76/14/00/1117761400.db2.gz IMFNRCKGZCEEPK-OAHLLOKOSA-N 1 0 299.414 3.993 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCOc2cccc(F)c2)c1 ZINC000185106244 1117764449 /nfs/dbraw/zinc/76/44/49/1117764449.db2.gz JSGVPCAGQQGKLS-ZDUSSCGKSA-N 1 0 289.350 3.569 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCCc2ccccc2)c1 ZINC000035628774 1117810979 /nfs/dbraw/zinc/81/09/79/1117810979.db2.gz LSWDRJCHADMYDX-HNNXBMFYSA-N 1 0 269.388 3.984 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1cc(OC)ccc1O)C1CCC1 ZINC000325046176 1117842837 /nfs/dbraw/zinc/84/28/37/1117842837.db2.gz NZGCRJSVGCZQQV-XHDPSFHLSA-N 1 0 263.381 3.630 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCOCc2ccccc2)c(O)c1 ZINC000185633168 1117860283 /nfs/dbraw/zinc/86/02/83/1117860283.db2.gz FZOASPSUMWJMNF-OAHLLOKOSA-N 1 0 285.387 3.568 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCCS1)c1cc2c(cc1O)CCCC2 ZINC000185698095 1117873486 /nfs/dbraw/zinc/87/34/86/1117873486.db2.gz GHBZKINFURWIDN-WFASDCNBSA-N 1 0 291.460 3.817 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H](CCO)C2CCCCC2)c1 ZINC000185828731 1117913738 /nfs/dbraw/zinc/91/37/38/1117913738.db2.gz WIVUMVGZKUPAQN-RHSMWYFYSA-N 1 0 291.435 3.683 20 10 CHCDRO C[C@H]([NH2+][C@@H](CCO)C1CCCCC1)c1cc(F)ccc1O ZINC000185829533 1117914132 /nfs/dbraw/zinc/91/41/32/1117914132.db2.gz PVQRICXYYLIYQF-LRDDRELGSA-N 1 0 295.398 3.513 20 10 CHCDRO C[N@H+](Cc1ccc(N2CCCCC2)cc1)Cc1ccccn1 ZINC000073394633 1118034136 /nfs/dbraw/zinc/03/41/36/1118034136.db2.gz LWYOIWKUTVFZEE-UHFFFAOYSA-N 1 0 295.430 3.704 20 10 CHCDRO CC[N@H+](Cc1ccc(OC)cc1)Cc1cccc(C)c1O ZINC000179698159 1128754407 /nfs/dbraw/zinc/75/44/07/1128754407.db2.gz SHWLJCQUTDLGKH-UHFFFAOYSA-N 1 0 285.387 3.731 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CCc2ccc(C)o2)cc1 ZINC000764921482 1118125287 /nfs/dbraw/zinc/12/52/87/1118125287.db2.gz QEQCCMDWWPSUNO-HNNXBMFYSA-N 1 0 286.419 3.937 20 10 CHCDRO CC[N@H+](Cc1cccc(C)c1O)[C@H](C)c1cccc(O)c1 ZINC000179770740 1128758289 /nfs/dbraw/zinc/75/82/89/1128758289.db2.gz SHEYTSOXCXPKRP-CQSZACIVSA-N 1 0 285.387 3.989 20 10 CHCDRO Cc1occc1C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000765395385 1118148434 /nfs/dbraw/zinc/14/84/34/1118148434.db2.gz IJXASYYTFXXNHU-LBPRGKRZSA-N 1 0 258.365 3.505 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2ccoc2C)cc1 ZINC000765398292 1118149397 /nfs/dbraw/zinc/14/93/97/1118149397.db2.gz YOJHGPOVRKKRPP-ZDUSSCGKSA-N 1 0 272.392 3.895 20 10 CHCDRO C[C@H]1CCCC[C@H]1C[NH2+]Cc1c(O)cccc1Cl ZINC000083552200 1118169623 /nfs/dbraw/zinc/16/96/23/1118169623.db2.gz XDXZQYVVDZSAKX-RYUDHWBXSA-N 1 0 267.800 3.962 20 10 CHCDRO CC[C@@H](C)N(C)CC[NH2+][C@@H](C)c1ccc(N(C)CC)cc1 ZINC000765653567 1118188146 /nfs/dbraw/zinc/18/81/46/1118188146.db2.gz BOCUDLJRWPBEGN-CVEARBPZSA-N 1 0 291.483 3.524 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)Cc2cncc(C)c2)cc1 ZINC000785439970 1118202121 /nfs/dbraw/zinc/20/21/21/1118202121.db2.gz SOLSONIBIJOKIW-UHFFFAOYSA-N 1 0 297.446 3.868 20 10 CHCDRO C[C@H]([NH2+]C[C@](C)(O)C1CCCCC1)c1cc(F)ccc1O ZINC000188664662 1128763928 /nfs/dbraw/zinc/76/39/28/1128763928.db2.gz PZRPTNKZJJUEBN-SJCJKPOMSA-N 1 0 295.398 3.513 20 10 CHCDRO CC[C@H]([NH2+]C[C@](C)(O)C1CCCCC1)c1ccccc1O ZINC000188660408 1128763942 /nfs/dbraw/zinc/76/39/42/1128763942.db2.gz CJFAGPCKXPBMNE-WMZOPIPTSA-N 1 0 291.435 3.764 20 10 CHCDRO Oc1ccc(F)cc1C[NH+]1CCC(c2ccsc2)CC1 ZINC000188695857 1128764153 /nfs/dbraw/zinc/76/41/53/1128764153.db2.gz DSUACPLQXIUALE-UHFFFAOYSA-N 1 0 291.391 3.972 20 10 CHCDRO C[C@@H]([NH2+]Cc1cc2ccccc2o1)c1ccccc1O ZINC000179896309 1128764128 /nfs/dbraw/zinc/76/41/28/1128764128.db2.gz IOFAGQLNYJBMOC-GFCCVEGCSA-N 1 0 267.328 3.989 20 10 CHCDRO COc1cnccc1[C@H](C)[NH2+][C@H](C)c1cc(C)ccc1O ZINC000188782225 1128764970 /nfs/dbraw/zinc/76/49/70/1128764970.db2.gz XYULIXUVXMSLIV-QWHCGFSZSA-N 1 0 286.375 3.516 20 10 CHCDRO C[C@@H](c1ccco1)[N@H+](Cc1cc(F)ccc1O)C1CC1 ZINC000179984961 1128769607 /nfs/dbraw/zinc/76/96/07/1128769607.db2.gz LJKUWBRBKPLNPF-NSHDSACASA-N 1 0 275.323 3.850 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)CN(CC)CC)c1ccc(N(C)C)cc1 ZINC000765770370 1118322506 /nfs/dbraw/zinc/32/25/06/1118322506.db2.gz WRPBHXRJVVSCTO-YJBOKZPZSA-N 1 0 291.483 3.524 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@](C)(O)C2CCCCC2)c1 ZINC000188671607 1118406504 /nfs/dbraw/zinc/40/65/04/1118406504.db2.gz VAWVTJWZDUUJKS-RDTXWAMCSA-N 1 0 291.435 3.683 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CC[C@H](C)[C@H](C)C2)cc1C ZINC000085041123 1118412010 /nfs/dbraw/zinc/41/20/10/1118412010.db2.gz NKENNUDCNDUWBY-WOSRLPQWSA-N 1 0 261.409 3.918 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccccc1 ZINC000050198284 1118443153 /nfs/dbraw/zinc/44/31/53/1118443153.db2.gz YZAUNUNRGRFXSN-KRWDZBQOSA-N 1 0 267.372 3.862 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H]2CCC[C@@H](CC)C2)c1O ZINC000068591622 1128786750 /nfs/dbraw/zinc/78/67/50/1128786750.db2.gz WZWVJHAGXZYZOW-UKRRQHHQSA-N 1 0 277.408 3.849 20 10 CHCDRO Oc1cccc(Br)c1C[NH+]1CCCCCC1 ZINC000707135042 1118640983 /nfs/dbraw/zinc/64/09/83/1118640983.db2.gz MWFJNNOENDYRSH-UHFFFAOYSA-N 1 0 284.197 3.531 20 10 CHCDRO CC[C@@H]1CCC[N@H+](Cc2c(O)cccc2Br)C1 ZINC000707141272 1118648935 /nfs/dbraw/zinc/64/89/35/1118648935.db2.gz XFUNLARYAOMVIS-LLVKDONJSA-N 1 0 298.224 3.777 20 10 CHCDRO C[N@H+](CCOC1CCCCCC1)Cc1ccccc1O ZINC000077284290 1118661880 /nfs/dbraw/zinc/66/18/80/1118661880.db2.gz ARVNSODZQIYCLJ-UHFFFAOYSA-N 1 0 277.408 3.563 20 10 CHCDRO Cc1cc(C[N@H+]2CCC[C@H]2C)ccc1N1CCCCC1 ZINC001167487153 1118717510 /nfs/dbraw/zinc/71/75/10/1118717510.db2.gz GNHUZSKWQJHJOW-MRXNPFEDSA-N 1 0 272.436 3.970 20 10 CHCDRO Oc1cc(Cl)ccc1C[N@@H+]1CC[C@H](F)C(F)(F)CC1 ZINC001140461941 1118720575 /nfs/dbraw/zinc/72/05/75/1118720575.db2.gz ZKRCTTXQIJYXMN-LBPRGKRZSA-N 1 0 293.716 3.615 20 10 CHCDRO CCSCC[C@@H](C)[N@H+](C)Cc1cccc(C)c1O ZINC000180670714 1128801230 /nfs/dbraw/zinc/80/12/30/1128801230.db2.gz AZQPJDPTKOMXCR-CYBMUJFWSA-N 1 0 267.438 3.664 20 10 CHCDRO C[C@@H]1C[N@H+](C/C=C\c2ccc(N(C)C)cc2)CCC1(F)F ZINC000835052569 1118830121 /nfs/dbraw/zinc/83/01/21/1118830121.db2.gz HGIPBKOSEGXUTD-ZRUQZJFASA-N 1 0 294.389 3.743 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)[C@@H](C)Cc1ccsc1 ZINC000190259212 1128808360 /nfs/dbraw/zinc/80/83/60/1128808360.db2.gz PEDAGZGWMPEMFP-ZDUSSCGKSA-N 1 0 275.417 3.907 20 10 CHCDRO CC1(C)CCC[C@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000094266139 1128831773 /nfs/dbraw/zinc/83/17/73/1128831773.db2.gz WIYWRVGPLKUKCX-QGZVFWFLSA-N 1 0 272.436 3.955 20 10 CHCDRO CCCC[C@H](CCC)[NH2+]Cc1ccc(O)c(O)c1 ZINC000226759967 1119323258 /nfs/dbraw/zinc/32/32/58/1119323258.db2.gz ZZOQGYWKSWCVMV-ZDUSSCGKSA-N 1 0 251.370 3.546 20 10 CHCDRO Cc1csc(C2([NH2+]Cc3ccccc3O)CCCC2)n1 ZINC000171842834 1128842577 /nfs/dbraw/zinc/84/25/77/1128842577.db2.gz WZNILQMQKCSXDN-UHFFFAOYSA-N 1 0 288.416 3.716 20 10 CHCDRO CSCC[C@H](C)[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C ZINC000168789093 1119478216 /nfs/dbraw/zinc/47/82/16/1119478216.db2.gz USRLCZFZKXAQQD-RWMBFGLXSA-N 1 0 279.449 3.980 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@]2(C)CCCS2)c1 ZINC000134072782 1119479923 /nfs/dbraw/zinc/47/99/23/1119479923.db2.gz SHLDQJFTUJHPJU-IUODEOHRSA-N 1 0 265.422 3.637 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CC[C@@H]1C)c1cc(Br)ccc1O ZINC000309587830 1119523183 /nfs/dbraw/zinc/52/31/83/1119523183.db2.gz SQJNWIPLYVMSRD-HOTUBEGUSA-N 1 0 284.197 3.604 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCC[C@H]1Cc1ccccc1 ZINC000179555468 1119751378 /nfs/dbraw/zinc/75/13/78/1119751378.db2.gz QAIAKOMVXIYADA-KRWDZBQOSA-N 1 0 267.372 3.599 20 10 CHCDRO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1ccccc1O ZINC000179568947 1119751393 /nfs/dbraw/zinc/75/13/93/1119751393.db2.gz QVGPOCOVRNFJMT-MRXNPFEDSA-N 1 0 283.371 3.738 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCSC[C@H]1c1ccccc1 ZINC000179556340 1119751703 /nfs/dbraw/zinc/75/17/03/1119751703.db2.gz DDFJRVWORBRUAO-INIZCTEOSA-N 1 0 285.412 3.682 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N2CCSCC2)cc1)C1CCC1 ZINC000178204302 1119966777 /nfs/dbraw/zinc/96/67/77/1119966777.db2.gz LGTPLJKLKOAGFV-CQSZACIVSA-N 1 0 290.476 3.518 20 10 CHCDRO CC[C@H]([NH2+]C1CC(C)C1)c1cc(Br)ccc1O ZINC000163655456 1120018591 /nfs/dbraw/zinc/01/85/91/1120018591.db2.gz KXPGYNBPUCKAKF-OCTTZUBCSA-N 1 0 298.224 3.994 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H](F)CC2)c(O)c1 ZINC001140850038 1120029752 /nfs/dbraw/zinc/02/97/52/1120029752.db2.gz BBYYARNJNRCZMJ-OAHLLOKOSA-N 1 0 294.414 3.562 20 10 CHCDRO CC[C@H]([NH2+]C1C[C@@H](C)O[C@H](C)C1)c1ccc(N(C)C)cc1 ZINC000090966037 1120036555 /nfs/dbraw/zinc/03/65/55/1120036555.db2.gz IQCVLLGJQGYALP-LBTNJELSSA-N 1 0 290.451 3.749 20 10 CHCDRO C[C@@H]([NH2+]Cc1cc(F)ccc1F)c1ccc(N(C)C)cc1 ZINC000107929136 1120062168 /nfs/dbraw/zinc/06/21/68/1120062168.db2.gz ZFTYJTHYGDAHIH-GFCCVEGCSA-N 1 0 290.357 3.882 20 10 CHCDRO CC(=O)c1cc(Cl)cc(C[N@@H+]2CCCC3(CC3)C2)c1[O-] ZINC000695086570 1120105234 /nfs/dbraw/zinc/10/52/34/1120105234.db2.gz TXGMMRIEIQHLEZ-UHFFFAOYSA-N 1 0 293.794 3.624 20 10 CHCDRO C[C@@H]([NH2+]CC1(C)CC1)c1ccc(Br)cc1O ZINC000309502780 1120121584 /nfs/dbraw/zinc/12/15/84/1120121584.db2.gz BGVMINVTHNCTEE-SECBINFHSA-N 1 0 284.197 3.605 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCOC1(C)C)c1ccc2ccccc2c1O ZINC000328416158 1120175189 /nfs/dbraw/zinc/17/51/89/1120175189.db2.gz IKSCIWPHERUZHG-BLLLJJGKSA-N 1 0 285.387 3.764 20 10 CHCDRO CC(C)(C)C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000040492708 1120196490 /nfs/dbraw/zinc/19/64/90/1120196490.db2.gz NSIYAACJUQVXIA-UHFFFAOYSA-N 1 0 260.425 3.813 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CC[C@H]1C)c1ccc2ccccc2c1O ZINC000312026333 1120255227 /nfs/dbraw/zinc/25/52/27/1120255227.db2.gz XMGBFAVMFDTXIU-BFQNTYOBSA-N 1 0 255.361 3.995 20 10 CHCDRO CC[N@H+](Cc1cc(F)ccc1O)[C@@H](C)c1cccc(O)c1 ZINC000179942725 1120258654 /nfs/dbraw/zinc/25/86/54/1120258654.db2.gz SBZHNAUZWJSCRY-LBPRGKRZSA-N 1 0 289.350 3.820 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCOc2ccccc2F)c1 ZINC000756369346 1120268409 /nfs/dbraw/zinc/26/84/09/1120268409.db2.gz BZAWKOFTSGRWCC-CYBMUJFWSA-N 1 0 289.350 3.569 20 10 CHCDRO Cc1cccc2[nH]cc(CC[NH2+]Cc3cc(F)ccc3O)c21 ZINC000180618236 1120278539 /nfs/dbraw/zinc/27/85/39/1120278539.db2.gz POQLHQUWVSTSNH-UHFFFAOYSA-N 1 0 298.361 3.653 20 10 CHCDRO CCCCN(C)CC[NH2+][C@H](C)c1ccc(N(C)CC)cc1 ZINC000765954129 1120281561 /nfs/dbraw/zinc/28/15/61/1120281561.db2.gz WGOIZKZYILUYKJ-MRXNPFEDSA-N 1 0 291.483 3.525 20 10 CHCDRO FC1(F)CCC([NH2+]Cc2ccc3c(c2)CCCO3)CC1 ZINC000921943008 1120299299 /nfs/dbraw/zinc/29/92/99/1120299299.db2.gz DMGRSMLUIWXVTD-UHFFFAOYSA-N 1 0 281.346 3.679 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCCO2)c1ccsc1 ZINC000922108359 1120368826 /nfs/dbraw/zinc/36/88/26/1120368826.db2.gz PYENCSCHEGEMTM-LBPRGKRZSA-N 1 0 273.401 3.924 20 10 CHCDRO CC1(C)C[NH+](Cc2c(O)ccc3ccccc32)CC(C)(C)O1 ZINC000318750360 1120375258 /nfs/dbraw/zinc/37/52/58/1120375258.db2.gz OPZAPOLTZSHNMG-UHFFFAOYSA-N 1 0 299.414 3.935 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCc2ccc3c(c2)CCO3)c1 ZINC000185451842 1120376822 /nfs/dbraw/zinc/37/68/22/1120376822.db2.gz XHQJUIDCIMYDQO-CQSZACIVSA-N 1 0 297.398 3.529 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]C/C=C/c2ccccc2)c1 ZINC000185440129 1120377620 /nfs/dbraw/zinc/37/76/20/1120377620.db2.gz IXFYSMKRBGFGGU-VIIAAUOXSA-N 1 0 283.371 3.765 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1CCOc2ccccc21)c1ccccc1O ZINC000186184033 1120392760 /nfs/dbraw/zinc/39/27/60/1120392760.db2.gz KNHPEAHHUPSMFG-WMLDXEAASA-N 1 0 297.398 3.999 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H]2Cc3cccc(Cl)c3C2)c1O ZINC001168704592 1120411725 /nfs/dbraw/zinc/41/17/25/1120411725.db2.gz NKCDJHWTHCOTJR-CQSZACIVSA-N 1 0 287.790 3.611 20 10 CHCDRO CO[C@H](C)C[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000188123737 1120447644 /nfs/dbraw/zinc/44/76/44/1120447644.db2.gz CQNQKCDZIFTIAC-CVEARBPZSA-N 1 0 290.451 3.753 20 10 CHCDRO Cc1ncc([C@H](C)[NH2+]Cc2ccc3c(c2)CCCO3)s1 ZINC000922307961 1120504774 /nfs/dbraw/zinc/50/47/74/1120504774.db2.gz UKJZFZCXSXNHHN-NSHDSACASA-N 1 0 288.416 3.627 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(F)cc1)c1ccccc1O ZINC000019943900 1120552537 /nfs/dbraw/zinc/55/25/37/1120552537.db2.gz CJRWCCYTZLXJLR-OAHLLOKOSA-N 1 0 259.324 3.772 20 10 CHCDRO Cc1cc(C[N@H+]2C[C@H](C)OC[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC000220294425 1120552639 /nfs/dbraw/zinc/55/26/39/1120552639.db2.gz GUGHSWIFABWSIF-KBPBESRZSA-N 1 0 291.435 3.607 20 10 CHCDRO Oc1ccccc1C[NH2+]C[C@@H]1[C@@H](c2ccccc2)C1(F)F ZINC000922775283 1120595304 /nfs/dbraw/zinc/59/53/04/1120595304.db2.gz JDAIRJAMWKUPBN-GDBMZVCRSA-N 1 0 289.325 3.531 20 10 CHCDRO Cc1csc([C@@H](C)C[NH2+][C@H](C)c2cc(F)ccc2O)n1 ZINC000186579503 1120597965 /nfs/dbraw/zinc/59/79/65/1120597965.db2.gz NCKILWYJWLSNHJ-GXSJLCMTSA-N 1 0 294.395 3.751 20 10 CHCDRO C[N@H+](Cc1cc(Cl)cs1)Cc1ccccc1O ZINC000194345470 1120598159 /nfs/dbraw/zinc/59/81/59/1120598159.db2.gz SZFIKRVUOUXTND-UHFFFAOYSA-N 1 0 267.781 3.739 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CCSC3(CCC3)C2)cc1C ZINC000922841982 1120609796 /nfs/dbraw/zinc/60/97/96/1120609796.db2.gz HPFORMXUTZTHLC-OAHLLOKOSA-N 1 0 291.460 3.912 20 10 CHCDRO c1cc(C[NH2+][C@@H]2CCSC3(CCC3)C2)cc2c1OCC2 ZINC000922843520 1120610831 /nfs/dbraw/zinc/61/08/31/1120610831.db2.gz VENUAWOHNHCPIP-OAHLLOKOSA-N 1 0 289.444 3.529 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2ncccc2c1)c1cc(F)ccc1O ZINC000195148489 1120615124 /nfs/dbraw/zinc/61/51/24/1120615124.db2.gz WSEFSIDWPWCLSZ-LBPRGKRZSA-N 1 0 296.345 3.930 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H]2CCCc3cccnc32)cc1C ZINC000922881106 1120616912 /nfs/dbraw/zinc/61/69/12/1120616912.db2.gz UDKHKCUQEWUFDV-MRXNPFEDSA-N 1 0 282.387 3.571 20 10 CHCDRO CC[C@H]([NH2+]C1(C2CC2)CC1)c1ccc(N(C)C)cc1 ZINC000777149246 1120622133 /nfs/dbraw/zinc/62/21/33/1120622133.db2.gz LROMADZDULHSPZ-INIZCTEOSA-N 1 0 258.409 3.736 20 10 CHCDRO C[C@@H](C[NH2+][C@H](C)c1cc(Cl)ccc1O)c1ccncc1 ZINC000756635190 1120642754 /nfs/dbraw/zinc/64/27/54/1120642754.db2.gz PWHUANPIERZSGT-NWDGAFQWSA-N 1 0 290.794 3.895 20 10 CHCDRO Oc1ccc(C[NH+]2CCC3(CCCCC3)CC2)c(O)c1 ZINC000092968997 1120664054 /nfs/dbraw/zinc/66/40/54/1120664054.db2.gz MGJWXJZCYLYZRT-UHFFFAOYSA-N 1 0 275.392 3.644 20 10 CHCDRO CO[C@@H](C)C[N@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000248410936 1120707029 /nfs/dbraw/zinc/70/70/29/1120707029.db2.gz DLCOCQXCHGSMHW-JKSUJKDBSA-N 1 0 299.414 3.990 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]CCc2c(C)cccc2C)c1 ZINC000756761306 1120806754 /nfs/dbraw/zinc/80/67/54/1120806754.db2.gz MKKZMPFXCAYDHP-HNNXBMFYSA-N 1 0 299.414 3.911 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCC[C@H]2CCCC[C@H]2O)c(O)c1 ZINC000756761947 1120808292 /nfs/dbraw/zinc/80/82/92/1120808292.db2.gz WDZPEHZYNHPLPZ-ZMSDIMECSA-N 1 0 291.435 3.683 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCc2ccc(F)c(F)c2)c(O)c1 ZINC000191514533 1128941860 /nfs/dbraw/zinc/94/18/60/1128941860.db2.gz UWXNWLQUHLNCKX-LBPRGKRZSA-N 1 0 291.341 3.872 20 10 CHCDRO COc1cccc(CC[NH2+][C@H](C)c2cc(C)ccc2O)c1 ZINC000185040311 1120909456 /nfs/dbraw/zinc/90/94/56/1120909456.db2.gz NDQJIYQCXWCAOM-CQSZACIVSA-N 1 0 285.387 3.603 20 10 CHCDRO CCN(CC[NH2+][C@H](C)c1ccc2ccccc2c1O)C1CC1 ZINC000185308109 1120910554 /nfs/dbraw/zinc/91/05/54/1120910554.db2.gz RGTQBAWZSFTHJY-CQSZACIVSA-N 1 0 298.430 3.680 20 10 CHCDRO CC(C)[C@](C)(O)C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000185434148 1120911753 /nfs/dbraw/zinc/91/17/53/1120911753.db2.gz ZLSZNWIZNXLKCN-FZKQIMNGSA-N 1 0 287.403 3.603 20 10 CHCDRO CCCC[N@H+](Cc1ccccc1O)[C@H](C)c1cnccn1 ZINC000282498668 1121032761 /nfs/dbraw/zinc/03/27/61/1121032761.db2.gz QQIIYRFRTSHYLN-CQSZACIVSA-N 1 0 285.391 3.546 20 10 CHCDRO Cc1cc(C[NH2+][C@H](C)[C@H]2CCOC2)c(C)n1-c1ccccc1 ZINC000317698842 1121037861 /nfs/dbraw/zinc/03/78/61/1121037861.db2.gz HAEVCOFHHRGQQP-WBVHZDCISA-N 1 0 298.430 3.609 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](O)CC(C)(C)C)c1ccc(N(C)C)cc1 ZINC000766057787 1121064088 /nfs/dbraw/zinc/06/40/88/1121064088.db2.gz AYCXQINJIPNBLK-IAGOWNOFSA-N 1 0 292.467 3.590 20 10 CHCDRO CCc1cccc(C[N@@H+]2CCC[C@@H](CCF)C2)c1O ZINC000701676232 1121163722 /nfs/dbraw/zinc/16/37/22/1121163722.db2.gz XPHAIMGMNFLGGW-ZDUSSCGKSA-N 1 0 265.372 3.526 20 10 CHCDRO CC[C@H]1CCC[C@@H]1[NH2+]CCCSc1nccs1 ZINC000766070318 1121180582 /nfs/dbraw/zinc/18/05/82/1121180582.db2.gz COADRODXEUDSOO-RYUDHWBXSA-N 1 0 270.467 3.794 20 10 CHCDRO C[C@@H]([NH2+]CCCNc1ccccc1)c1ccc(N(C)C)cc1 ZINC000766072294 1121182840 /nfs/dbraw/zinc/18/28/40/1121182840.db2.gz FGPLOBKPKKXFDP-MRXNPFEDSA-N 1 0 297.446 3.905 20 10 CHCDRO COc1cc(Cl)cc(C[N@H+](C)[C@@H](C)C(C)C)c1O ZINC000228598922 1121190421 /nfs/dbraw/zinc/19/04/21/1121190421.db2.gz AJDQWRFASVJKTE-JTQLQIEISA-N 1 0 271.788 3.531 20 10 CHCDRO Cc1cc(C[NH2+][C@@H]2CCOC[C@H]2C)c(C)n1-c1ccccc1 ZINC000319022495 1121224833 /nfs/dbraw/zinc/22/48/33/1121224833.db2.gz IDEDYTDXHDUVDE-AUUYWEPGSA-N 1 0 298.430 3.609 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cscc2C)c1 ZINC000094877438 1121238286 /nfs/dbraw/zinc/23/82/86/1121238286.db2.gz XNXBJYYUYDMDRB-LLVKDONJSA-N 1 0 277.389 3.622 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CC[C@@H](CC(F)(F)F)C2)cc1C ZINC000766118623 1121271936 /nfs/dbraw/zinc/27/19/36/1121271936.db2.gz NQACGLPXZITWIG-LBPRGKRZSA-N 1 0 287.325 3.783 20 10 CHCDRO CCCCC[N@H+](Cc1cc2c(cc1O)OCO2)C(C)C ZINC000096630361 1121283837 /nfs/dbraw/zinc/28/38/37/1121283837.db2.gz LHXJLSOGOHENFG-UHFFFAOYSA-N 1 0 279.380 3.522 20 10 CHCDRO Oc1cc2c(cc1C[N@@H+]1CC[C@@H](CC(F)(F)F)C1)CCC2 ZINC000766126110 1121288908 /nfs/dbraw/zinc/28/89/08/1121288908.db2.gz XHFZZZMKXFEMPG-NSHDSACASA-N 1 0 299.336 3.655 20 10 CHCDRO CCOc1cccc(C[NH2+]C[C@@H](C)C(C)(C)C)c1O ZINC000096610221 1121403263 /nfs/dbraw/zinc/40/32/63/1121403263.db2.gz JGWFCAMZAUNFPA-GFCCVEGCSA-N 1 0 265.397 3.563 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CCCC23CC3)c1 ZINC000707043735 1121449338 /nfs/dbraw/zinc/44/93/38/1121449338.db2.gz PUVYQDSSYBTGGJ-CHWSQXEVSA-N 1 0 275.392 3.632 20 10 CHCDRO CCc1cccc(C[NH2+][C@H](C)c2ccsc2)c1O ZINC000709425023 1121470398 /nfs/dbraw/zinc/47/03/98/1121470398.db2.gz UJZJFAVIHYVRML-LLVKDONJSA-N 1 0 261.390 3.867 20 10 CHCDRO CCCC[N@H+](Cc1nc(C)c(C)o1)Cc1ccccc1O ZINC000282533479 1121519952 /nfs/dbraw/zinc/51/99/52/1121519952.db2.gz VFWKITLJDGLYIK-UHFFFAOYSA-N 1 0 288.391 3.799 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]CC(C)(C)C(C)C)c1O ZINC000220929987 1121528736 /nfs/dbraw/zinc/52/87/36/1121528736.db2.gz GPGBLFBAYAOEFL-UHFFFAOYSA-N 1 0 285.815 3.826 20 10 CHCDRO CC(C)[C@@H]1[N@H+](Cc2ccccc2O)CC12CC=CC2 ZINC000843432059 1121530756 /nfs/dbraw/zinc/53/07/56/1121530756.db2.gz PIZNLDJHCQNOQL-INIZCTEOSA-N 1 0 257.377 3.569 20 10 CHCDRO Cc1cc(Nc2cc3ccccc3cc2O)cc(C)[nH+]1 ZINC001176056217 1121541578 /nfs/dbraw/zinc/54/15/78/1121541578.db2.gz STEWWYUZPVAKNF-UHFFFAOYSA-N 1 0 264.328 3.723 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CCC[C@H](F)C2)c(O)c1 ZINC001118177625 1121560702 /nfs/dbraw/zinc/56/07/02/1121560702.db2.gz VFQFPQKWGQIURP-MELADBBJSA-N 1 0 265.372 3.940 20 10 CHCDRO CCSCC[C@@H](C)[NH2+]Cc1cc(Cl)ccc1O ZINC000135295663 1121734307 /nfs/dbraw/zinc/73/43/07/1121734307.db2.gz FLZYHBHKEPYHGH-SNVBAGLBSA-N 1 0 273.829 3.667 20 10 CHCDRO CC(C)C(C[NH2+]Cc1ccc(N(C)C)c(F)c1)C(C)C ZINC001177554352 1121734788 /nfs/dbraw/zinc/73/47/88/1121734788.db2.gz VQQAMTNQJYWTPF-UHFFFAOYSA-N 1 0 280.431 3.910 20 10 CHCDRO Cc1ccc(C)c(C[NH2+]Cc2ccc3c(c2)CCCN3C)c1 ZINC001177529171 1121735240 /nfs/dbraw/zinc/73/52/40/1121735240.db2.gz MFFAFSUNKUSFFB-UHFFFAOYSA-N 1 0 294.442 3.976 20 10 CHCDRO CCN(CC)c1ccc(CNc2cc(OC)cc[nH+]2)cc1 ZINC001178383030 1121782083 /nfs/dbraw/zinc/78/20/83/1121782083.db2.gz UWDVZRHDKWXDMR-UHFFFAOYSA-N 1 0 285.391 3.549 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)Cc1ccccc1F ZINC001203357008 1121806659 /nfs/dbraw/zinc/80/66/59/1121806659.db2.gz DBDWCKACAPXHAR-UHFFFAOYSA-N 1 0 259.324 3.553 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C2CC(c3ccccc3F)C2)cc1 ZINC000237122447 1121818879 /nfs/dbraw/zinc/81/88/79/1121818879.db2.gz WNLKOIDWHJMUOB-UHFFFAOYSA-N 1 0 298.405 3.928 20 10 CHCDRO CCN(C)c1ccc(C[N@H+](C(C)C)C2CCC2)cc1 ZINC000773773570 1121819738 /nfs/dbraw/zinc/81/97/38/1121819738.db2.gz OLKNZDFNBRIRRU-UHFFFAOYSA-N 1 0 260.425 3.906 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2CC23CCCCC3)cc1F ZINC001179259705 1121865368 /nfs/dbraw/zinc/86/53/68/1121865368.db2.gz XBYNDLCEQIYRNQ-MRXNPFEDSA-N 1 0 276.399 3.704 20 10 CHCDRO CN(C)c1ccc(C[NH2+]CC[C@H]2CC=CCC2)cc1F ZINC001179359141 1121874176 /nfs/dbraw/zinc/87/41/76/1121874176.db2.gz ONBAYLWVIOCNOL-AWEZNQCLSA-N 1 0 276.399 3.728 20 10 CHCDRO COc1ccc(C[NH2+]C[C@H]2CCc3ccccc32)cc1C ZINC000732229871 1121913262 /nfs/dbraw/zinc/91/32/62/1121913262.db2.gz MQVBIMRSSFFRNT-QGZVFWFLSA-N 1 0 281.399 3.823 20 10 CHCDRO CCc1cnccc1[C@@H](C)[NH2+]Cc1ccc(N(C)CC)cc1 ZINC000773835485 1121915172 /nfs/dbraw/zinc/91/51/72/1121915172.db2.gz FWIMJHMKSBEEHW-OAHLLOKOSA-N 1 0 297.446 3.951 20 10 CHCDRO COCC[N@@H+](Cc1cc(C(C)C)ccc1O)CC(C)C ZINC001179942542 1121927794 /nfs/dbraw/zinc/92/77/94/1121927794.db2.gz RLOMCIKDXJJWSN-UHFFFAOYSA-N 1 0 279.424 3.620 20 10 CHCDRO C[C@@H]1CCC[N@H+](C/C=C/c2ccc(N(C)C)cc2)CC1 ZINC001180030805 1121939947 /nfs/dbraw/zinc/93/99/47/1121939947.db2.gz PXPDJNDDNWTKFV-BIENSFFJSA-N 1 0 272.436 3.888 20 10 CHCDRO Cc1ccc(C[N@H+]2C[C@H](C)[C@H]2c2ccccc2)c(O)c1 ZINC001180141993 1121951009 /nfs/dbraw/zinc/95/10/09/1121951009.db2.gz KFTXUQVVSIKOMQ-KSSFIOAISA-N 1 0 267.372 3.894 20 10 CHCDRO C[C@@H]1CC[C@@H](C)[NH+]1C/C=C\c1ccc(N(C)C)cc1 ZINC001180108867 1121952911 /nfs/dbraw/zinc/95/29/11/1121952911.db2.gz ZFFRYYZBDDHBAN-JBZXTQMFSA-N 1 0 258.409 3.639 20 10 CHCDRO CC(C)c1ccc(O)c(C[N@@H+]2CC[C@H]3OCCC[C@H]3C2)c1 ZINC001180203730 1121963026 /nfs/dbraw/zinc/96/30/26/1121963026.db2.gz YJCBLTKYXIITKB-MAUKXSAKSA-N 1 0 289.419 3.517 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2cc(F)ccc2O)[C@@H]2CCCC[C@H]12 ZINC001180271334 1121971727 /nfs/dbraw/zinc/97/17/27/1121971727.db2.gz ISFPEDDZHKSMQO-DAXOMENPSA-N 1 0 277.383 3.932 20 10 CHCDRO C[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000733322020 1121975762 /nfs/dbraw/zinc/97/57/62/1121975762.db2.gz MYEITAKOGLJVQL-DOMZBBRYSA-N 1 0 264.388 3.560 20 10 CHCDRO CC1CCC([NH2+]Cc2ccc(N(C)C)c(F)c2)CC1 ZINC000733323187 1121976095 /nfs/dbraw/zinc/97/60/95/1121976095.db2.gz NDEKPHGJHJCGTG-UHFFFAOYSA-N 1 0 264.388 3.560 20 10 CHCDRO CCCN(Cc1cccn1C(F)F)c1ccc(C[NH3+])cc1 ZINC001181458001 1122056026 /nfs/dbraw/zinc/05/60/26/1122056026.db2.gz SSNBAEYOXUIYCZ-UHFFFAOYSA-N 1 0 293.361 3.759 20 10 CHCDRO COc1cc(C)cc(C[NH+]2CC(C3CCCCC3)C2)c1O ZINC001182215712 1122121653 /nfs/dbraw/zinc/12/16/53/1122121653.db2.gz HSJBDXVNSZUQOG-UHFFFAOYSA-N 1 0 289.419 3.721 20 10 CHCDRO CCOC[C@H]1CCCC[N@@H+]1Cc1c(O)cc(C)cc1Cl ZINC001182284847 1122130313 /nfs/dbraw/zinc/13/03/13/1122130313.db2.gz IXIIYQWPKPGIJO-CYBMUJFWSA-N 1 0 297.826 3.745 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2C[C@H](C)[C@H](C)[C@H]2C)c(Cl)c1 ZINC001182453745 1122161272 /nfs/dbraw/zinc/16/12/72/1122161272.db2.gz VREIVDASYNLTSK-SDDRHHMPSA-N 1 0 267.800 3.830 20 10 CHCDRO CCNc1ccccc1C[NH2+]Cc1cc(Cl)ccc1O ZINC001182686176 1122182836 /nfs/dbraw/zinc/18/28/36/1122182836.db2.gz YJASJVWMNKEFMC-UHFFFAOYSA-N 1 0 290.794 3.767 20 10 CHCDRO CC(C)c1ccc(O)c(C[NH2+]CCCOC(C)(C)C)c1 ZINC001182774337 1122189094 /nfs/dbraw/zinc/18/90/94/1122189094.db2.gz ZMHVERYMARLQGL-UHFFFAOYSA-N 1 0 279.424 3.810 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+][C@H]1CCOC2(CCCCC2)C1 ZINC000272527099 1122206430 /nfs/dbraw/zinc/20/64/30/1122206430.db2.gz YZCRKJBIDPSSRK-HNNXBMFYSA-N 1 0 293.382 3.503 20 10 CHCDRO CN(C)c1ccc(C[NH2+]Cc2cccc3cc[nH]c32)cc1F ZINC000237126561 1122209732 /nfs/dbraw/zinc/20/97/32/1122209732.db2.gz GMHVRXXAFCFZOQ-UHFFFAOYSA-N 1 0 297.377 3.663 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]CC[C@@H]1CC=CCC1 ZINC001183323959 1122217363 /nfs/dbraw/zinc/21/73/63/1122217363.db2.gz HWMRFWJGSIUJOF-MRXNPFEDSA-N 1 0 272.436 3.897 20 10 CHCDRO Cc1ccc(C[NH+]2CC([C@@H]3CCC[C@H](C)C3)C2)c(O)c1 ZINC001183441907 1122223727 /nfs/dbraw/zinc/22/37/27/1122223727.db2.gz BDDMGHRZCZOZPG-DZGCQCFKSA-N 1 0 273.420 3.959 20 10 CHCDRO Oc1cccc2c1C[N@H+](C/C=C/c1ccc(F)cc1)C2 ZINC001183454769 1122223764 /nfs/dbraw/zinc/22/37/64/1122223764.db2.gz NNLMGLKHRJQLJF-NSCUHMNNSA-N 1 0 269.319 3.560 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@H]3OCC[C@H]32)c(O)c1C ZINC000273363328 1122230660 /nfs/dbraw/zinc/23/06/60/1122230660.db2.gz AVXQQBSSRQZWLT-QMCVQRASSA-N 1 0 289.419 3.617 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccccc2)c(O)c1C ZINC000273411000 1122231239 /nfs/dbraw/zinc/23/12/39/1122231239.db2.gz POPDTOMBHSZSPE-CQSZACIVSA-N 1 0 255.361 3.860 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccccn2)c(O)c1C ZINC000273427566 1122233251 /nfs/dbraw/zinc/23/32/51/1122233251.db2.gz UREUJQODVBPUCE-KGLIPLIRSA-N 1 0 270.376 3.816 20 10 CHCDRO C[C@H]([NH2+]C1(c2ccccc2)CC1)c1cc(F)ccc1O ZINC000273535744 1122237860 /nfs/dbraw/zinc/23/78/60/1122237860.db2.gz XGEOOKHBWVOHOL-LBPRGKRZSA-N 1 0 271.335 3.871 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCCSC2)c(O)c1C ZINC000273552619 1122239186 /nfs/dbraw/zinc/23/91/86/1122239186.db2.gz GFDKZRBVQGVABX-OLZOCXBDSA-N 1 0 265.422 3.555 20 10 CHCDRO CC[C@H](C[C@@H](C)CC)[NH2+]Cc1c([O-])cccc1F ZINC001183920007 1122248227 /nfs/dbraw/zinc/24/82/27/1122248227.db2.gz SKOPYHSGBAIYLS-NWDGAFQWSA-N 1 0 253.361 3.836 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H](C)C1CCSCC1 ZINC000192898109 1129045745 /nfs/dbraw/zinc/04/57/45/1129045745.db2.gz CCHQOWVHDVHIEH-AWEZNQCLSA-N 1 0 292.492 3.893 20 10 CHCDRO CC[C@H](c1ccccc1)[N@H+](C)Cc1ccc(OC)cc1O ZINC001203628494 1122363818 /nfs/dbraw/zinc/36/38/18/1122363818.db2.gz AXDAIRWWBYAUCN-QGZVFWFLSA-N 1 0 285.387 3.984 20 10 CHCDRO Cc1cc(C)cc(OCC[NH2+][C@@H](C)c2ccccc2O)c1 ZINC000775136619 1122437335 /nfs/dbraw/zinc/43/73/35/1122437335.db2.gz LZGLYODUGQNHOA-HNNXBMFYSA-N 1 0 285.387 3.739 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCc2ccc(F)cc21)c1ccccc1O ZINC000775134970 1122437638 /nfs/dbraw/zinc/43/76/38/1122437638.db2.gz AOTAINRWJVEADA-MEDUHNTESA-N 1 0 271.335 3.869 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2ccccc2n1)c1ccccc1O ZINC000775137700 1122437672 /nfs/dbraw/zinc/43/76/72/1122437672.db2.gz XLLCDDMCLQOKDX-ZDUSSCGKSA-N 1 0 278.355 3.791 20 10 CHCDRO CCCN(Cc1sccc1C)c1ccc(C[NH3+])cc1 ZINC000775151222 1122445987 /nfs/dbraw/zinc/44/59/87/1122445987.db2.gz YMQFNTICIMCMKZ-UHFFFAOYSA-N 1 0 274.433 3.932 20 10 CHCDRO Cc1cccc(O)c1C[NH+]1CCC2(CCCC2)CC1 ZINC001237486179 1129055656 /nfs/dbraw/zinc/05/56/56/1129055656.db2.gz WNGUVELLHRLZLD-UHFFFAOYSA-N 1 0 259.393 3.857 20 10 CHCDRO COc1ccc(O)c(C[N@H+](C)[C@@H](C)C2CCCCC2)c1 ZINC000775206449 1122481406 /nfs/dbraw/zinc/48/14/06/1122481406.db2.gz PAJQLIVIGBYPIZ-ZDUSSCGKSA-N 1 0 277.408 3.801 20 10 CHCDRO CCCc1cccc(C[NH2+]Cc2ccc3c(c2)CCO3)c1 ZINC000775307593 1122513062 /nfs/dbraw/zinc/51/30/62/1122513062.db2.gz OVFMAMMCMVPGGT-UHFFFAOYSA-N 1 0 281.399 3.864 20 10 CHCDRO C[C@@H]([NH2+]CCCSc1nccs1)c1ccccc1O ZINC000183520271 1129059693 /nfs/dbraw/zinc/05/96/93/1129059693.db2.gz WYJGATLVLNCTMG-LLVKDONJSA-N 1 0 294.445 3.682 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C2(Cc3ccccc3)CC2)cc1 ZINC000775327152 1122517525 /nfs/dbraw/zinc/51/75/25/1122517525.db2.gz VTBYKDZSLNSZHR-UHFFFAOYSA-N 1 0 280.415 3.618 20 10 CHCDRO CC[C@@H]1C[C@H](C[NH2+][C@H](C)c2ccc(N(C)C)cc2)CCO1 ZINC000775366103 1122529095 /nfs/dbraw/zinc/52/90/95/1122529095.db2.gz ZXDOUGKMLGPWFX-IIDMSEBBSA-N 1 0 290.451 3.608 20 10 CHCDRO CC[C@@H]1C[C@@H](C[NH2+][C@H](C)c2ccc(N(C)C)cc2)CCO1 ZINC000775366105 1122529313 /nfs/dbraw/zinc/52/93/13/1122529313.db2.gz ZXDOUGKMLGPWFX-RVKKMQEKSA-N 1 0 290.451 3.608 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]CCCc2ccccc2C)c1 ZINC000775375491 1122534088 /nfs/dbraw/zinc/53/40/88/1122534088.db2.gz LYSNWANWNNXWBH-HNNXBMFYSA-N 1 0 299.414 3.993 20 10 CHCDRO Cc1ccc(O[C@H](C)C[NH2+][C@@H](C)c2ccccc2O)cc1 ZINC000183534498 1129061114 /nfs/dbraw/zinc/06/11/14/1129061114.db2.gz PQYHTDDFJCKIMF-CABCVRRESA-N 1 0 285.387 3.819 20 10 CHCDRO C[C@@H](C[NH2+][C@H](C)c1ccccc1O)Cc1cccs1 ZINC000183531655 1129061788 /nfs/dbraw/zinc/06/17/88/1129061788.db2.gz ISXQVXIEVWROQI-CHWSQXEVSA-N 1 0 275.417 3.983 20 10 CHCDRO CC[C@H]([NH2+]CCOc1ccccc1F)c1ccccc1O ZINC000775414522 1122557452 /nfs/dbraw/zinc/55/74/52/1122557452.db2.gz NGGANYSKZPVRSF-HNNXBMFYSA-N 1 0 289.350 3.651 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H](C)Cc2ccccc2C)c1 ZINC000071408113 1129063053 /nfs/dbraw/zinc/06/30/53/1129063053.db2.gz CCIYDPHUMRFNPJ-OAHLLOKOSA-N 1 0 269.388 3.730 20 10 CHCDRO CCOc1cc(C)ccc1C[NH2+][C@@H](C)c1ccccc1O ZINC000183554849 1129064950 /nfs/dbraw/zinc/06/49/50/1129064950.db2.gz WTGDBQZVHJEDDH-AWEZNQCLSA-N 1 0 285.387 3.950 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cccs1 ZINC000048417213 1122611617 /nfs/dbraw/zinc/61/16/17/1122611617.db2.gz DFARTASSCDMMBE-AWEZNQCLSA-N 1 0 273.401 3.924 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1C[C@@H]1C)c1cc(Cl)ccc1O ZINC000775488561 1122620442 /nfs/dbraw/zinc/62/04/42/1122620442.db2.gz IZBFUZIMWYLEGE-KWBADKCTSA-N 1 0 253.773 3.742 20 10 CHCDRO COc1ccc(N(C)C[C@@H]2CCCC[N@@H+]2C(C)C)cc1F ZINC001191891259 1122620671 /nfs/dbraw/zinc/62/06/71/1122620671.db2.gz GZJSPCGIADSZSD-HNNXBMFYSA-N 1 0 294.414 3.533 20 10 CHCDRO CC[C@@H]([NH2+]CCOc1ccccc1C)c1ccccc1O ZINC000775498319 1122628924 /nfs/dbraw/zinc/62/89/24/1122628924.db2.gz YJJBZAIHPGHNBP-MRXNPFEDSA-N 1 0 285.387 3.820 20 10 CHCDRO CCc1cc(C[NH2+][C@H](CC)c2cc(Cl)ccc2O)[nH]n1 ZINC000775508547 1122630154 /nfs/dbraw/zinc/63/01/54/1122630154.db2.gz VLAJSMPOGVTBGU-CQSZACIVSA-N 1 0 293.798 3.572 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1CCCS1)c1cc(Cl)ccc1O ZINC000775512318 1122633559 /nfs/dbraw/zinc/63/35/59/1122633559.db2.gz JBJKVQJMYYZUHB-WCQYABFASA-N 1 0 285.840 3.982 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCCS1)c1cc(Cl)ccc1O ZINC000775512319 1122633501 /nfs/dbraw/zinc/63/35/01/1122633501.db2.gz JBJKVQJMYYZUHB-YPMHNXCESA-N 1 0 285.840 3.982 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCCSC1)c1cc(Cl)ccc1O ZINC000775510942 1122633676 /nfs/dbraw/zinc/63/36/76/1122633676.db2.gz BGPYOPZJOOKZIB-YPMHNXCESA-N 1 0 285.840 3.982 20 10 CHCDRO CCC[C@@H](CCO)C[NH2+][C@H](CC)c1cc(Cl)ccc1O ZINC000775512473 1122634340 /nfs/dbraw/zinc/63/43/40/1122634340.db2.gz LCWMVIJJNSLKJJ-SWLSCSKDSA-N 1 0 299.842 3.885 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@H]1CCOc3ccc(F)cc31)CC2 ZINC000296799819 1122778659 /nfs/dbraw/zinc/77/86/59/1122778659.db2.gz LJWYPCFBVSDCMC-GJZGRUSLSA-N 1 0 299.345 3.632 20 10 CHCDRO CC(C)(C)[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3cccc(O)c32)CCO1 ZINC000296890506 1122780988 /nfs/dbraw/zinc/78/09/88/1122780988.db2.gz ONXJFQXHHGPLMG-LZWOXQAQSA-N 1 0 289.419 3.563 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]C1(c3ccccc3)CC1)CC2 ZINC000297037381 1122786850 /nfs/dbraw/zinc/78/68/50/1122786850.db2.gz VCCSODSHBLVNAX-HNNXBMFYSA-N 1 0 265.356 3.658 20 10 CHCDRO Cc1cc(C[N@H+]2C[C@@H](C)[C@@H]2C)ccc1N1CCCCC1 ZINC001194702076 1122789074 /nfs/dbraw/zinc/78/90/74/1122789074.db2.gz OTGQCBLHNGTCGM-CVEARBPZSA-N 1 0 272.436 3.826 20 10 CHCDRO CCC[N@@H+](Cc1ccccc1O)C[C@@H]1CCC(C)(C)O1 ZINC000775609986 1122799317 /nfs/dbraw/zinc/79/93/17/1122799317.db2.gz HVQLQENBRRPWND-HNNXBMFYSA-N 1 0 277.408 3.562 20 10 CHCDRO COc1ccc(O)c(C[N@H+](C(C)C)C2CCCCC2)c1 ZINC000775643355 1122851444 /nfs/dbraw/zinc/85/14/44/1122851444.db2.gz OMNYVANEKGGYSS-UHFFFAOYSA-N 1 0 277.408 3.944 20 10 CHCDRO COc1cc(C)cc(C[NH2+]C2(C)CCC(F)(F)CC2)c1O ZINC000894444886 1122854111 /nfs/dbraw/zinc/85/41/11/1122854111.db2.gz LVFLNBWKFYTLAV-UHFFFAOYSA-N 1 0 299.361 3.767 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CCC[C@@H]2Cc2ccccc2)c1 ZINC000775648094 1122856908 /nfs/dbraw/zinc/85/69/08/1122856908.db2.gz QPHOARKHUVGIHI-QGZVFWFLSA-N 1 0 297.398 3.608 20 10 CHCDRO Cc1cccc2c1CC[N@H+](Cc1cc3c(cc1O)CCC3)C2 ZINC000729466905 1122894183 /nfs/dbraw/zinc/89/41/83/1122894183.db2.gz FQCIATFSZMEKLE-UHFFFAOYSA-N 1 0 293.410 3.748 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2C[C@@H](C)C[C@H]2C)c1O ZINC000775716546 1122920537 /nfs/dbraw/zinc/92/05/37/1122920537.db2.gz XQOWBYHXVDIISE-GXSJLCMTSA-N 1 0 253.773 3.584 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CCC[C@@H]2CCC(C)C)c1 ZINC000775730390 1122927395 /nfs/dbraw/zinc/92/73/95/1122927395.db2.gz APBRZTHCVMUTQT-OAHLLOKOSA-N 1 0 277.408 3.801 20 10 CHCDRO Cc1cccc(C[N@H+]2C[C@H](C)[C@H]2c2ccccc2)c1O ZINC000775735574 1122928661 /nfs/dbraw/zinc/92/86/61/1122928661.db2.gz WOYZNCZOUMBWTM-YOEHRIQHSA-N 1 0 267.372 3.894 20 10 CHCDRO CCOc1ccc(C[NH2+]Cc2ccc(C)c(F)c2)c(O)c1 ZINC000775826082 1122982546 /nfs/dbraw/zinc/98/25/46/1122982546.db2.gz CHWKGCLVFYAGGE-UHFFFAOYSA-N 1 0 289.350 3.528 20 10 CHCDRO CCC1(C[NH2+]C/C=C/c2ccc(N(C)C)cc2)CCC1 ZINC001200940988 1123066849 /nfs/dbraw/zinc/06/68/49/1123066849.db2.gz BVNJKUPXJAGTSG-FNORWQNLSA-N 1 0 272.436 3.936 20 10 CHCDRO COc1cccc(O)c1C[NH2+]CC[C@@H](C)c1ccccc1 ZINC000776153652 1123086348 /nfs/dbraw/zinc/08/63/48/1123086348.db2.gz BZFJSTZFUPLRMI-CQSZACIVSA-N 1 0 285.387 3.684 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]CCc2ccc(F)cc2Cl)c1 ZINC000776173655 1123101583 /nfs/dbraw/zinc/10/15/83/1123101583.db2.gz CLFMUOFYZNVFJE-UHFFFAOYSA-N 1 0 293.769 3.825 20 10 CHCDRO COc1ccc(C[NH2+]CCc2ccccc2C)cc1C ZINC000106001918 1123103294 /nfs/dbraw/zinc/10/32/94/1123103294.db2.gz WTTHOVDSPFAHQE-UHFFFAOYSA-N 1 0 269.388 3.644 20 10 CHCDRO CC[C@@H]1CCC[C@H]1[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC001201449607 1123106278 /nfs/dbraw/zinc/10/62/78/1123106278.db2.gz IMOOAJWKJNVNMW-WXYTYNPNSA-N 1 0 272.436 3.934 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(Cl)cc(C)c1O)C1CCOCC1 ZINC000776230878 1123163077 /nfs/dbraw/zinc/16/30/77/1123163077.db2.gz BOSISMHEVBLUHR-HNNXBMFYSA-N 1 0 297.826 3.649 20 10 CHCDRO CCC(CC)(CCO)[NH2+]Cc1c(C)c2ccccc2n1C ZINC001202126046 1123177082 /nfs/dbraw/zinc/17/70/82/1123177082.db2.gz CMDVVWUJNPFIDS-UHFFFAOYSA-N 1 0 288.435 3.518 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H](CO)CCC(C)(C)C)c(Cl)c1 ZINC001202159248 1123180414 /nfs/dbraw/zinc/18/04/14/1123180414.db2.gz SCYUJLQPKGSUEW-GFCCVEGCSA-N 1 0 299.842 3.631 20 10 CHCDRO Oc1ccccc1C[NH2+]CCCc1c[nH]c2ccccc12 ZINC000107714171 1123226780 /nfs/dbraw/zinc/22/67/80/1123226780.db2.gz XJGQRWDPSXROKX-UHFFFAOYSA-N 1 0 280.371 3.596 20 10 CHCDRO CC1CCN(c2ccc(C[NH2+]Cc3ccco3)cc2)CC1 ZINC000108423619 1123231390 /nfs/dbraw/zinc/23/13/90/1123231390.db2.gz NEIREOBMNLOCBY-UHFFFAOYSA-N 1 0 284.403 3.806 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H]2Cc3ccccc3[C@@H]2C)c1 ZINC000850364255 1123257530 /nfs/dbraw/zinc/25/75/30/1123257530.db2.gz WLLQNJPNWYXMNV-SUMWQHHRSA-N 1 0 267.372 3.519 20 10 CHCDRO C[C@]1(CC[NH2+]Cc2cc(Cl)ccc2O)CC1(F)F ZINC000850380117 1123260481 /nfs/dbraw/zinc/26/04/81/1123260481.db2.gz BQZGEEZFXBEEKA-LBPRGKRZSA-N 1 0 275.726 3.571 20 10 CHCDRO C[C@H]([NH2+]Cc1ccccc1O)c1ccc2c(c1)CCCO2 ZINC000850429477 1123266128 /nfs/dbraw/zinc/26/61/28/1123266128.db2.gz FCKZSNPWJRBTOP-ZDUSSCGKSA-N 1 0 283.371 3.568 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)c2cc3cnccc3o2)cc1C ZINC000850430833 1123266538 /nfs/dbraw/zinc/26/65/38/1123266538.db2.gz VFEDPZPSJACJSC-CYBMUJFWSA-N 1 0 296.370 3.996 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@H](C)c2ccccn2)c(O)c1 ZINC000850480645 1123273362 /nfs/dbraw/zinc/27/33/62/1123273362.db2.gz BAPLGDIQAGWADC-LSDHHAIUSA-N 1 0 284.403 3.858 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+][C@@H]2CCN(C(C)(C)C)C2)c(O)c1 ZINC000850492641 1123273928 /nfs/dbraw/zinc/27/39/28/1123273928.db2.gz FOBSZEIAABTOSJ-HUUCEWRRSA-N 1 0 290.451 3.532 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCN(C(C)(C)C)C1)c1cc(Cl)ccc1O ZINC000850494850 1123275302 /nfs/dbraw/zinc/27/53/02/1123275302.db2.gz SXTPXMFCOHXCHT-YPMHNXCESA-N 1 0 296.842 3.569 20 10 CHCDRO C[C@H]([NH2+]CCc1ccoc1)c1cc(Cl)ccc1O ZINC000850531580 1123285232 /nfs/dbraw/zinc/28/52/32/1123285232.db2.gz MFKYBCLLLHNJNQ-JTQLQIEISA-N 1 0 265.740 3.532 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCC[C@@H](C)O1)c1ccc(Cl)cc1O ZINC000850534043 1123285948 /nfs/dbraw/zinc/28/59/48/1123285948.db2.gz FSZRHRKZCGTOOB-NTZNESFSSA-N 1 0 283.799 3.654 20 10 CHCDRO C[C@@H]([NH2+][C@H]1C[C@H](Oc2ccccc2)C1)c1ccccc1O ZINC000850532265 1123286231 /nfs/dbraw/zinc/28/62/31/1123286231.db2.gz RUCXMPAOVRHDNM-IIAWOOMASA-N 1 0 283.371 3.653 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+]C[C@@]2(C)CC2(F)F)c2c1c(F)ccc2O ZINC000850536497 1123286778 /nfs/dbraw/zinc/28/67/78/1123286778.db2.gz KQRKDTWTGOFUOB-IPURGOFSSA-N 1 0 285.309 3.715 20 10 CHCDRO CC[C@@H]([NH2+]Cc1c(C2CC2)cnn1C)c1ccc(C)cc1O ZINC000850535589 1123286879 /nfs/dbraw/zinc/28/68/79/1123286879.db2.gz XLUSFVQQVGWBJK-MRXNPFEDSA-N 1 0 299.418 3.552 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@@]2(C)CC2(F)F)cc1 ZINC000850535381 1123286982 /nfs/dbraw/zinc/28/69/82/1123286982.db2.gz VSJOXUNQSPWIQD-SWLSCSKDSA-N 1 0 282.378 3.839 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCc3ccc(O)cc32)c1 ZINC000850543198 1123289107 /nfs/dbraw/zinc/28/91/07/1123289107.db2.gz GJJXAEPDXCGSTH-SJKOYZFVSA-N 1 0 283.371 3.744 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCOC1(C)C)c1cc(Cl)ccc1O ZINC000850570193 1123294253 /nfs/dbraw/zinc/29/42/53/1123294253.db2.gz FPUZJCDLCCNTBQ-MNOVXSKESA-N 1 0 283.799 3.511 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1nccn1C)c1cc(Cl)ccc1O ZINC000850572743 1123295626 /nfs/dbraw/zinc/29/56/26/1123295626.db2.gz OZPINMUYRXDPMP-GWCFXTLKSA-N 1 0 293.798 3.581 20 10 CHCDRO C[C@@H](O)[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1ccccc1 ZINC000850585147 1123296497 /nfs/dbraw/zinc/29/64/97/1123296497.db2.gz VXACVHRXNBQBFJ-QMTMVMCOSA-N 1 0 298.430 3.525 20 10 CHCDRO Oc1ccc(-c2ccccc2)cc1C[NH2+][C@H]1CCCOCC1 ZINC000776498224 1123305302 /nfs/dbraw/zinc/30/53/02/1123305302.db2.gz OCHFXENBEXUYGA-SFHVURJKSA-N 1 0 297.398 3.718 20 10 CHCDRO C[N@H+](Cc1ccccc1O)Cc1cccc2cccnc21 ZINC000109770008 1123326520 /nfs/dbraw/zinc/32/65/20/1123326520.db2.gz KACJSFLLGUTHBC-UHFFFAOYSA-N 1 0 278.355 3.572 20 10 CHCDRO CC[C@H]1C[N@H+](C/C=C\c2ccc(N(C)C)cc2)CCS1 ZINC001204769372 1123425289 /nfs/dbraw/zinc/42/52/89/1123425289.db2.gz SZRHVJWAALEWMG-OSJSJHBBSA-N 1 0 290.476 3.593 20 10 CHCDRO C[C@]1(C2CC2)C[N@H+](Cc2c(O)ccc3ccccc32)CCO1 ZINC000853527807 1123442857 /nfs/dbraw/zinc/44/28/57/1123442857.db2.gz FFSAJYBOIXAKOF-LJQANCHMSA-N 1 0 297.398 3.546 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cc(F)ccc2F)c1 ZINC000111405127 1123443594 /nfs/dbraw/zinc/44/35/94/1123443594.db2.gz ODSCKIAEJSRGML-JTQLQIEISA-N 1 0 293.313 3.530 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCOC2CCCCC2)c1 ZINC000111635949 1123457691 /nfs/dbraw/zinc/45/76/91/1123457691.db2.gz OBAXNUAINUNMGI-AWEZNQCLSA-N 1 0 277.408 3.701 20 10 CHCDRO COc1cccc(C[C@@H](C)[NH2+][C@@H](C)c2ccccc2O)c1 ZINC000783521093 1123470119 /nfs/dbraw/zinc/47/01/19/1123470119.db2.gz DTRMFCIBIJBMAS-KGLIPLIRSA-N 1 0 285.387 3.683 20 10 CHCDRO CC[C@H]([NH2+]Cc1cccc(N)c1)c1ccc(C)cc1O ZINC000854217279 1123478232 /nfs/dbraw/zinc/47/82/32/1123478232.db2.gz JSLRKULRMODQSU-INIZCTEOSA-N 1 0 270.376 3.524 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCc2cc(N)ccc21)c1ccc(N(C)C)cc1 ZINC000854227148 1123478802 /nfs/dbraw/zinc/47/88/02/1123478802.db2.gz SQDQLNQDGLJZMG-YJYMSZOUSA-N 1 0 295.430 3.673 20 10 CHCDRO Oc1c(C[NH2+]C[C@H]2CCC3(CCC3)O2)ccc2ccccc21 ZINC000895676889 1123503062 /nfs/dbraw/zinc/50/30/62/1123503062.db2.gz DMPZSBZVNCLWMW-MRXNPFEDSA-N 1 0 297.398 3.737 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]CC[C@@H]1CC1(Cl)Cl ZINC000856806757 1123569700 /nfs/dbraw/zinc/56/97/00/1123569700.db2.gz HKYYETVGVHPNAE-MRVPVSSYSA-N 1 0 294.609 3.719 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+]CC[C@H]2CC2(F)F)c2c1c(F)ccc2O ZINC000857082196 1123586079 /nfs/dbraw/zinc/58/60/79/1123586079.db2.gz UQVBZMUNPQCGOE-YWVKMMECSA-N 1 0 285.309 3.715 20 10 CHCDRO C[C@H]([NH2+]CC[C@@H]1CC1(F)F)c1cc(Cl)ccc1O ZINC000857081691 1123586093 /nfs/dbraw/zinc/58/60/93/1123586093.db2.gz QDOWEUBOKXSDPA-DTWKUNHWSA-N 1 0 275.726 3.742 20 10 CHCDRO COc1ccc(C[NH2+][C@H]2CCO[C@@H](CC(C)C)C2)cc1C ZINC000776949109 1123608975 /nfs/dbraw/zinc/60/89/75/1123608975.db2.gz JYPGFKAZWSTAHR-IRXDYDNUSA-N 1 0 291.435 3.687 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1cccc(F)c1F ZINC000115629540 1123619883 /nfs/dbraw/zinc/61/98/83/1123619883.db2.gz WFQYCVAAENVMID-UHFFFAOYSA-N 1 0 290.357 3.629 20 10 CHCDRO C[C@H]([NH2+]CCCSc1nccs1)[C@@H]1C[C@H]1C1CC1 ZINC000858141688 1123634254 /nfs/dbraw/zinc/63/42/54/1123634254.db2.gz QTQVBPYFJWOAKV-DRZSPHRISA-N 1 0 282.478 3.650 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H](c2ccccn2)C2CCC2)cc1 ZINC000858238576 1123639226 /nfs/dbraw/zinc/63/92/26/1123639226.db2.gz WMTVKSFFMJHATG-IBGZPJMESA-N 1 0 295.430 3.779 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2c(O)cc(C)cc2Cl)c1 ZINC000858239062 1123639389 /nfs/dbraw/zinc/63/93/89/1123639389.db2.gz GUHDOBMRSGKSDT-UHFFFAOYSA-N 1 0 291.778 3.658 20 10 CHCDRO Cc1csc([C@H](C)[NH2+]CCCSc2nccs2)n1 ZINC000858364918 1123647945 /nfs/dbraw/zinc/64/79/45/1123647945.db2.gz IBIUJHNYAKQLEY-JTQLQIEISA-N 1 0 299.490 3.741 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]C[C@H]2CCCC23CC3)c1O ZINC000858594006 1123666490 /nfs/dbraw/zinc/66/64/90/1123666490.db2.gz LLPUBERSNWWVCC-QWHCGFSZSA-N 1 0 275.392 3.632 20 10 CHCDRO Cc1cc(O)c(C[NH+]2CCC(C(F)(F)F)CC2)cc1C ZINC000173420106 1123769666 /nfs/dbraw/zinc/76/96/66/1123769666.db2.gz HDVGDMKGENMIQO-UHFFFAOYSA-N 1 0 287.325 3.783 20 10 CHCDRO CN(C)c1ccc(/C=C/Cn2cnc3c2CCCC3)cc1 ZINC000862432284 1123808871 /nfs/dbraw/zinc/80/88/71/1123808871.db2.gz XUCDQUWXVFCNQI-AATRIKPKSA-N 1 0 281.403 3.541 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000862473369 1123812973 /nfs/dbraw/zinc/81/29/73/1123812973.db2.gz OXWJAQQORYMDAT-SJORKVTESA-N 1 0 290.476 3.531 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CC[C@H]3CC[C@@H](C2)S3)c(Cl)c1 ZINC000862473605 1123813130 /nfs/dbraw/zinc/81/31/30/1123813130.db2.gz WUVCEEPWLRASFF-NEPJUHHUSA-N 1 0 297.851 3.824 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CCCC3(CC3)CC2)c(O)c1 ZINC000862538882 1123818077 /nfs/dbraw/zinc/81/80/77/1123818077.db2.gz GMYMRPPGSMTKGA-UHFFFAOYSA-N 1 0 275.392 3.557 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CS[C@@H](C)C2)c(O)c1C ZINC000840859779 1123860296 /nfs/dbraw/zinc/86/02/96/1123860296.db2.gz MGJMGOPQGDKAGG-WCFLWFBJSA-N 1 0 265.422 3.554 20 10 CHCDRO Oc1ccc2ccncc2c1C[N@@H+]1CCCC2(CC2)CC1 ZINC000863329634 1123861250 /nfs/dbraw/zinc/86/12/50/1123861250.db2.gz DGMRBOLMHDNGEB-UHFFFAOYSA-N 1 0 282.387 3.707 20 10 CHCDRO COc1ccc(C[NH2+]C2C[C@H](C)C[C@@H](C)C2)cc1C ZINC000084461627 1129153430 /nfs/dbraw/zinc/15/34/30/1129153430.db2.gz KEVOMAXYHATEMW-CHWSQXEVSA-N 1 0 261.409 3.918 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@H+]2CC[C@@H](C(F)(F)F)[C@H]2C)c1 ZINC000794654505 1123925480 /nfs/dbraw/zinc/92/54/80/1123925480.db2.gz CSDUHSSWUPNHKO-DGCLKSJQSA-N 1 0 287.325 3.782 20 10 CHCDRO CC[C@H]([NH2+]CC1(N(C)C)CCCC1)c1ccc(C)cc1O ZINC000794794825 1123949962 /nfs/dbraw/zinc/94/99/62/1123949962.db2.gz RBDJQURLMNVTCN-INIZCTEOSA-N 1 0 290.451 3.616 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](CCO)CC(C)C)c1ccc(C)cc1O ZINC000794802141 1123950324 /nfs/dbraw/zinc/95/03/24/1123950324.db2.gz MVAZOZXNXNENQM-DOTOQJQBSA-N 1 0 293.451 3.786 20 10 CHCDRO CCCC[C@@H](COC)[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000794801677 1123950346 /nfs/dbraw/zinc/95/03/46/1123950346.db2.gz KDKMYNOKASONGL-HOCLYGCPSA-N 1 0 279.424 3.947 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1COc2ccccc2C1)c1ccc(C)cc1O ZINC000794802500 1123950796 /nfs/dbraw/zinc/95/07/96/1123950796.db2.gz FVTYRDCTIWFCSQ-DOTOQJQBSA-N 1 0 297.398 3.745 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)Cc1ccncc1)c1ccc(C)cc1O ZINC000794799972 1123951010 /nfs/dbraw/zinc/95/10/10/1123951010.db2.gz ASYDBTZTPCUUHI-PBHICJAKSA-N 1 0 284.403 3.768 20 10 CHCDRO CC[C@@H]([NH2+]C[C@](C)(O)CCC(C)C)c1ccc(C)cc1O ZINC000794799987 1123951046 /nfs/dbraw/zinc/95/10/46/1123951046.db2.gz AYIWFJKMWRQMAH-SJLPKXTDSA-N 1 0 293.451 3.929 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)Cc1ccco1)c1ccc(C)cc1O ZINC000794794008 1123951518 /nfs/dbraw/zinc/95/15/18/1123951518.db2.gz PBGKSXXZNDQTMW-CJNGLKHVSA-N 1 0 273.376 3.966 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCCCN1CC)c1ccc(C)cc1O ZINC000794807000 1123953945 /nfs/dbraw/zinc/95/39/45/1123953945.db2.gz JDDQLSJVUWTYGM-RDJZCZTQSA-N 1 0 290.451 3.616 20 10 CHCDRO CC[C@@H]([NH2+]Cc1scnc1C)c1ccc(C)cc1O ZINC000794807243 1123954173 /nfs/dbraw/zinc/95/41/73/1123954173.db2.gz LEGCMFSZOYZRQI-CYBMUJFWSA-N 1 0 276.405 3.706 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]C2C[C@H](C)C[C@@H](C)C2)c1 ZINC000084973068 1129155759 /nfs/dbraw/zinc/15/57/59/1129155759.db2.gz FHQXVHWXLGQFDE-UPJWGTAASA-N 1 0 277.408 3.876 20 10 CHCDRO CC[C@H]([NH2+]CCC(O)(CC)CC)c1ccc(C)cc1O ZINC000794815416 1123958240 /nfs/dbraw/zinc/95/82/40/1123958240.db2.gz PENZSNGMMILALK-HNNXBMFYSA-N 1 0 279.424 3.683 20 10 CHCDRO CC[C@@H]([NH2+]CC(C)(C)[C@H](O)C(C)C)c1ccc(C)cc1O ZINC000794816505 1123958330 /nfs/dbraw/zinc/95/83/30/1123958330.db2.gz NQLWQKSLRPYPTE-NVXWUHKLSA-N 1 0 293.451 3.784 20 10 CHCDRO CC[C@H]([NH2+][C@@H](CC)[C@H]1CCCO1)c1ccc(C)cc1O ZINC000794815937 1123959258 /nfs/dbraw/zinc/95/92/58/1123959258.db2.gz MKUUQGDJCSAAKM-YQQAZPJKSA-N 1 0 277.408 3.699 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)C[C@H]1CCOC1)c1ccc(C)cc1O ZINC000794811921 1123959809 /nfs/dbraw/zinc/95/98/09/1123959809.db2.gz UTNHRGDYIKGPQR-FMKPAKJESA-N 1 0 277.408 3.556 20 10 CHCDRO CC[C@H]([NH2+][C@H](CO)C1CCCCC1)c1ccc(C)cc1O ZINC000794818353 1123959962 /nfs/dbraw/zinc/95/99/62/1123959962.db2.gz SFUXXTVCLZSCKF-DLBZAZTESA-N 1 0 291.435 3.683 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](C)N(CC)CC)c1cc(Cl)ccc1O ZINC000794832453 1123963005 /nfs/dbraw/zinc/96/30/05/1123963005.db2.gz SIHNPWKIAPQRPS-DOMZBBRYSA-N 1 0 298.858 3.817 20 10 CHCDRO C[C@H]([NH2+][C@@H](CO)CC1CCC1)c1ccc2ccccc2c1O ZINC000794833797 1123965810 /nfs/dbraw/zinc/96/58/10/1123965810.db2.gz LBQGRSDIJMYNJC-XJKSGUPXSA-N 1 0 299.414 3.747 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CCC2(F)CCC2)c(Cl)c1 ZINC000840945545 1124033474 /nfs/dbraw/zinc/03/34/74/1124033474.db2.gz PUUBNNMRHADFEO-UHFFFAOYSA-N 1 0 271.763 3.726 20 10 CHCDRO C[C@@H]([NH2+]CC[C@H]1CCSC1)c1cc(Cl)ccc1O ZINC000866403495 1124063401 /nfs/dbraw/zinc/06/34/01/1124063401.db2.gz QOIZZLQBUPBFNZ-MNOVXSKESA-N 1 0 285.840 3.839 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCO[C@H]1c1ccccc1)c1ccccc1O ZINC000866404993 1124063894 /nfs/dbraw/zinc/06/38/94/1124063894.db2.gz SFBPYOXTQGWWDC-QBIMZIAESA-N 1 0 283.371 3.573 20 10 CHCDRO Cc1ncc([C@H](C)[NH2+][C@@H](C)c2ccccc2O)s1 ZINC000866455423 1124068442 /nfs/dbraw/zinc/06/84/42/1124068442.db2.gz LKTDKVKWHKGXKL-UWVGGRQHSA-N 1 0 262.378 3.569 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]Cc2ccnc(F)c2)c1O ZINC000866473821 1124070149 /nfs/dbraw/zinc/07/01/49/1124070149.db2.gz HZAQQHBTKNTFQR-SNVBAGLBSA-N 1 0 294.757 3.739 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2C[C@H]2C(F)(F)F)c(O)c1C ZINC000866500779 1124073191 /nfs/dbraw/zinc/07/31/91/1124073191.db2.gz WBKKRNGZDMEXCD-YUSALJHKSA-N 1 0 273.298 3.610 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C2CCC2)[C@H]2CCOC2)c1 ZINC000866511177 1124076157 /nfs/dbraw/zinc/07/61/57/1124076157.db2.gz BHJJYLGSFSQFAR-DHSIGJKJSA-N 1 0 289.419 3.556 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2c3ccccc3CN2C)c(O)c1 ZINC000866562145 1124081642 /nfs/dbraw/zinc/08/16/42/1124081642.db2.gz CRGMOEDQSCWWTF-RDTXWAMCSA-N 1 0 296.414 3.538 20 10 CHCDRO CC[C@H]([NH2+]C1([C@@H]2CCCCO2)CCC1)c1ccccc1O ZINC000866622789 1124091404 /nfs/dbraw/zinc/09/14/04/1124091404.db2.gz JBUFCHGMBOALLB-RDJZCZTQSA-N 1 0 289.419 3.925 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@@H+]2CCc3sccc3C2)c1 ZINC000122538393 1124507577 /nfs/dbraw/zinc/50/75/77/1124507577.db2.gz KGAUUEPOEKDNHA-UHFFFAOYSA-N 1 0 273.401 3.629 20 10 CHCDRO C[C@@H]([NH2+]CC1(O)CCCCC1)c1ccc2ccccc2c1O ZINC000123318571 1124583230 /nfs/dbraw/zinc/58/32/30/1124583230.db2.gz ZCBFQZAXYQSLEH-CQSZACIVSA-N 1 0 299.414 3.891 20 10 CHCDRO Cc1ccccc1[C@@H]1CC[N@H+](Cc2ccc(N)cc2)C1 ZINC001120370607 1131274674 /nfs/dbraw/zinc/27/46/74/1131274674.db2.gz BXTNPSPYLJKGRN-MRXNPFEDSA-N 1 0 266.388 3.567 20 10 CHCDRO C/C(Cl)=C/C[N@@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000528419751 1124658320 /nfs/dbraw/zinc/65/83/20/1124658320.db2.gz PGNBAEAHRIIZQO-ODDCISTRSA-N 1 0 295.810 3.516 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C)Cc1ccoc1 ZINC000449294074 1124689510 /nfs/dbraw/zinc/68/95/10/1124689510.db2.gz KFBSMYHSIJAFQA-ZDUSSCGKSA-N 1 0 282.387 3.801 20 10 CHCDRO CCCOc1ccc(C[NH2+][C@@H]2CCCn3nccc32)cc1C ZINC000873152543 1124743751 /nfs/dbraw/zinc/74/37/51/1124743751.db2.gz STOXIEHXYGOXOW-MRXNPFEDSA-N 1 0 299.418 3.605 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1cccc(Cl)c1[O-] ZINC000873239102 1124754032 /nfs/dbraw/zinc/75/40/32/1124754032.db2.gz NUNYSFPKJZAGND-LALPHHSUSA-N 1 0 296.842 3.604 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2cc(N)cc(F)c2)c(O)c1 ZINC000873288424 1124761803 /nfs/dbraw/zinc/76/18/03/1124761803.db2.gz FLNVKZSSILOJAL-GFCCVEGCSA-N 1 0 288.366 3.581 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccc(F)cc1)c1ccccc1O ZINC000019904138 1124766648 /nfs/dbraw/zinc/76/66/48/1124766648.db2.gz AFJPZMQZNCZHMP-MRXNPFEDSA-N 1 0 273.351 3.815 20 10 CHCDRO CC1CCC([NH2+]Cc2cc(Cl)ccc2O)CC1 ZINC000019917955 1124770425 /nfs/dbraw/zinc/77/04/25/1124770425.db2.gz WDHNZDWDVVYTRT-UHFFFAOYSA-N 1 0 253.773 3.714 20 10 CHCDRO CCOc1cccc(C[NH2+]CCC2=CCCCC2)c1O ZINC000020093675 1124804848 /nfs/dbraw/zinc/80/48/48/1124804848.db2.gz KSMZXKOBQLFCNB-UHFFFAOYSA-N 1 0 275.392 3.771 20 10 CHCDRO CCC[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000020595287 1124853539 /nfs/dbraw/zinc/85/35/39/1124853539.db2.gz QIZPUSWEKHMESV-ZDUSSCGKSA-N 1 0 264.388 3.877 20 10 CHCDRO C[C@H]([NH2+]CCc1ccccn1)c1ccc2ccccc2c1O ZINC000020827932 1124878371 /nfs/dbraw/zinc/87/83/71/1124878371.db2.gz YUGNLKOJMLMXDB-AWEZNQCLSA-N 1 0 292.382 3.834 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C(C2CC2)C2CC2)cc1 ZINC000021502552 1124929157 /nfs/dbraw/zinc/92/91/57/1124929157.db2.gz GOPXTPBWVKIPDK-UHFFFAOYSA-N 1 0 272.436 3.811 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC000876636255 1124966577 /nfs/dbraw/zinc/96/65/77/1124966577.db2.gz DAEBJCJHBUGGNC-QGZVFWFLSA-N 1 0 283.371 3.743 20 10 CHCDRO Cc1ccc(C[N@@H+](CCc2nccs2)C(C)C)c(O)c1 ZINC000876778206 1124976850 /nfs/dbraw/zinc/97/68/50/1124976850.db2.gz YRLNWJBLLITOSX-UHFFFAOYSA-N 1 0 290.432 3.610 20 10 CHCDRO Cc1ccc2c(c1C)OC[C@@H]2[NH2+]Cc1c(C)cccc1O ZINC000876876063 1124987147 /nfs/dbraw/zinc/98/71/47/1124987147.db2.gz JLAXPNVOIDBSDR-INIZCTEOSA-N 1 0 283.371 3.541 20 10 CHCDRO CC(=O)Nc1cccc([C@H](C)[NH2+]Cc2ccc(C)cc2O)c1 ZINC000876911904 1124990007 /nfs/dbraw/zinc/99/00/07/1124990007.db2.gz AGRKMPXJSHSJOZ-ZDUSSCGKSA-N 1 0 298.386 3.510 20 10 CHCDRO Cc1ccc(C[NH2+]C(C)(C)c2ccc(F)cc2)c(O)c1 ZINC000877007259 1124997230 /nfs/dbraw/zinc/99/72/30/1124997230.db2.gz JBBZLYKGINAHHC-UHFFFAOYSA-N 1 0 273.351 3.865 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(C)cc1O)c1nc(C)cs1 ZINC000877025516 1124999618 /nfs/dbraw/zinc/99/96/18/1124999618.db2.gz MTSWGHOKPBJINF-ZDUSSCGKSA-N 1 0 276.405 3.706 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]C[C@@H]1CCCO[C@@H]1C(C)(C)C ZINC000877038843 1125001478 /nfs/dbraw/zinc/00/14/78/1125001478.db2.gz ZGROBPVXOFXJOQ-YOEHRIQHSA-N 1 0 291.435 3.632 20 10 CHCDRO Cc1cnc([C@@H]([NH2+]Cc2ccc(C)cc2O)C2CC2)s1 ZINC000877064406 1125003622 /nfs/dbraw/zinc/00/36/22/1125003622.db2.gz SGKAFSZQIHZUDB-HNNXBMFYSA-N 1 0 288.416 3.706 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2nc(C(C)C)cs2)c(O)c1 ZINC000877107570 1125009913 /nfs/dbraw/zinc/00/99/13/1125009913.db2.gz JDHXPSISTKPNDE-UHFFFAOYSA-N 1 0 276.405 3.570 20 10 CHCDRO Cc1ccc(C[NH+]2CCC(Cc3cccnc3)CC2)c(O)c1 ZINC000877172881 1125016473 /nfs/dbraw/zinc/01/64/73/1125016473.db2.gz YQRABRMMPDSNOW-UHFFFAOYSA-N 1 0 296.414 3.550 20 10 CHCDRO Cc1nc2c(s1)[C@H]([NH2+]Cc1c(C)cccc1O)CCC2 ZINC000877185156 1125018786 /nfs/dbraw/zinc/01/87/86/1125018786.db2.gz QCEHKQJATVQTMI-CYBMUJFWSA-N 1 0 288.416 3.633 20 10 CHCDRO Cc1ccc(C[NH2+][C@H]2CCCc3sccc32)c(O)c1 ZINC000877388179 1125025513 /nfs/dbraw/zinc/02/55/13/1125025513.db2.gz XAKHVXDOAADHSE-AWEZNQCLSA-N 1 0 273.401 3.929 20 10 CHCDRO Cc1nc([C@H]2CCC[N@@H+]2Cc2ccc(C)cc2O)cs1 ZINC000877408717 1125027336 /nfs/dbraw/zinc/02/73/36/1125027336.db2.gz RMFSKCFYSSYTQX-OAHLLOKOSA-N 1 0 288.416 3.803 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC000877498824 1125036847 /nfs/dbraw/zinc/03/68/47/1125036847.db2.gz VHFWGBCYLJHWDH-GFCCVEGCSA-N 1 0 269.335 3.616 20 10 CHCDRO Cc1cccc(O)c1C[NH2+][C@@H]1C[C@@H](C)Oc2ccccc21 ZINC000877561932 1125047194 /nfs/dbraw/zinc/04/71/94/1125047194.db2.gz NRLVNPQPBPWYEH-CZUORRHYSA-N 1 0 283.371 3.703 20 10 CHCDRO Cc1cccc(C[NH2+]C2CCC(OC(C)(C)C)CC2)c1O ZINC000877684032 1125063577 /nfs/dbraw/zinc/06/35/77/1125063577.db2.gz NVCGMICNSXXGBL-UHFFFAOYSA-N 1 0 291.435 3.917 20 10 CHCDRO CN1CCCc2cc(C[NH2+][C@H]3CCc4ccccc43)ccc21 ZINC000126650516 1125064768 /nfs/dbraw/zinc/06/47/68/1125064768.db2.gz KFYMCJKDNJQYSX-IBGZPJMESA-N 1 0 292.426 3.846 20 10 CHCDRO Oc1cccc2c1C[N@H+](C[C@@H]1C[C@@H]1c1ccccc1)C2 ZINC000877702922 1125066569 /nfs/dbraw/zinc/06/65/69/1125066569.db2.gz JZXKFAAQDQFZOF-JKSUJKDBSA-N 1 0 265.356 3.512 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)CCC(F)(F)F)c1ccccc1O ZINC000877755634 1125073096 /nfs/dbraw/zinc/07/30/96/1125073096.db2.gz IUYDFVRXPOUCER-VHSXEESVSA-N 1 0 261.287 3.774 20 10 CHCDRO C[C@H]([NH2+]Cc1cccc2c1OC(C)(C)C2)c1ccccc1O ZINC000877757058 1125073758 /nfs/dbraw/zinc/07/37/58/1125073758.db2.gz DDXRZASDEBICIB-ZDUSSCGKSA-N 1 0 297.398 3.957 20 10 CHCDRO CO[C@H](c1ccccc1)[C@@H](C)[NH2+][C@@H](C)c1ccccc1O ZINC000877758244 1125073957 /nfs/dbraw/zinc/07/39/57/1125073957.db2.gz PBHIDNUGCHXHRW-IYOUNJFTSA-N 1 0 285.387 3.819 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H](CF)c2ccc(F)cc2)c1O ZINC000877758976 1125074014 /nfs/dbraw/zinc/07/40/14/1125074014.db2.gz PEXCNGIKWGFVGZ-HNNXBMFYSA-N 1 0 277.314 3.640 20 10 CHCDRO Cc1ccc(F)cc1C[NH2+][C@@H](C)c1ccccc1O ZINC000877757332 1125074232 /nfs/dbraw/zinc/07/42/32/1125074232.db2.gz QGZLZEPTIBDCJB-LBPRGKRZSA-N 1 0 259.324 3.691 20 10 CHCDRO C[C@H]([NH2+]Cc1scnc1C1CC1)c1ccccc1O ZINC000877757950 1125074799 /nfs/dbraw/zinc/07/47/99/1125074799.db2.gz AJLDYQCNPOHARR-JTQLQIEISA-N 1 0 274.389 3.577 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)c2ccccc2O)cc1C ZINC000877756586 1125074919 /nfs/dbraw/zinc/07/49/19/1125074919.db2.gz VSHQVRWNKTWYBX-CQSZACIVSA-N 1 0 255.361 3.860 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCO[C@@H](C(C)(C)C)C1)c1ccccc1O ZINC000877756885 1125074931 /nfs/dbraw/zinc/07/49/31/1125074931.db2.gz BVOAYNYNDAAAAI-DVOMOZLQSA-N 1 0 277.408 3.637 20 10 CHCDRO C[C@@H]([NH2+]CCCF)c1ccc(N2CCCCC2)c(F)c1 ZINC000126952035 1125127707 /nfs/dbraw/zinc/12/77/07/1125127707.db2.gz ROMNRMPMRBARSB-CYBMUJFWSA-N 1 0 282.378 3.826 20 10 CHCDRO C[N@@H+](Cc1ccccc1O)C[C@@H]1CC[C@H](c2ccccc2)O1 ZINC000878242902 1125133516 /nfs/dbraw/zinc/13/35/16/1125133516.db2.gz WSHAYIXOLUHZTA-PKOBYXMFSA-N 1 0 297.398 3.744 20 10 CHCDRO C[C@@H]([NH2+]CC[C@@H]1CCC2(CCC2)O1)c1ccccc1O ZINC000717108811 1125152038 /nfs/dbraw/zinc/15/20/38/1125152038.db2.gz GJLHTJGZGWOIKF-KGLIPLIRSA-N 1 0 275.392 3.535 20 10 CHCDRO Cc1cscc1C[NH2+]Cc1c(O)cccc1Cl ZINC000127350642 1125179839 /nfs/dbraw/zinc/17/98/39/1125179839.db2.gz LDLUZGVJBNETEE-UHFFFAOYSA-N 1 0 267.781 3.705 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CC[C@@H](c2ccccc2)O1)c1ccccc1O ZINC000879650144 1125223186 /nfs/dbraw/zinc/22/31/86/1125223186.db2.gz LQAOJSDYFQZANJ-ALKREAHSSA-N 1 0 297.398 3.963 20 10 CHCDRO COc1cccc(C[NH2+][C@@H](C)c2ccccc2O)c1Cl ZINC000879650352 1125224488 /nfs/dbraw/zinc/22/44/88/1125224488.db2.gz WCLXJMUIIBSIIZ-NSHDSACASA-N 1 0 291.778 3.905 20 10 CHCDRO CCOc1cccc(C[N@H+](CC)C[C@@H](C)CC)c1O ZINC000211699745 1125321575 /nfs/dbraw/zinc/32/15/75/1125321575.db2.gz ORVSWKKKBWRQAH-ZDUSSCGKSA-N 1 0 265.397 3.659 20 10 CHCDRO CCCc1cccc(C[NH2+]Cc2cc(OC)ccc2O)c1 ZINC000187240757 1125328128 /nfs/dbraw/zinc/32/81/28/1125328128.db2.gz JDTVERUWWBMWSE-UHFFFAOYSA-N 1 0 285.387 3.643 20 10 CHCDRO Oc1ccccc1C[N@H+](Cc1ccncc1)C1CCCC1 ZINC000130611405 1125364571 /nfs/dbraw/zinc/36/45/71/1125364571.db2.gz BAKIDFOLKBXMCH-UHFFFAOYSA-N 1 0 282.387 3.732 20 10 CHCDRO CO[C@@H](C[NH2+][C@H](C)c1ccc(N(C)C)cc1)c1ccccc1 ZINC000131428660 1125391200 /nfs/dbraw/zinc/39/12/00/1125391200.db2.gz MJCZRAPEGVJQPD-BEFAXECRSA-N 1 0 298.430 3.791 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(C)nc2Cl)c1 ZINC000883301965 1125392624 /nfs/dbraw/zinc/39/26/24/1125392624.db2.gz NKFATYXWJFAVSB-GFCCVEGCSA-N 1 0 290.794 3.908 20 10 CHCDRO Oc1ccc(Cl)c(C[NH2+][C@@H]2CCc3cccc(O)c32)c1 ZINC000883327390 1125397055 /nfs/dbraw/zinc/39/70/55/1125397055.db2.gz XRXZWPUSIQDJEZ-CQSZACIVSA-N 1 0 289.762 3.528 20 10 CHCDRO COC[C@H](C)[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000131869100 1125410541 /nfs/dbraw/zinc/41/05/41/1125410541.db2.gz BGYAXMZDXUSCGH-UONOGXRCSA-N 1 0 294.414 3.502 20 10 CHCDRO Cc1cc(C[NH+]2C[C@H]3CCCC[C@@H]3C2)ccc1N(C)C ZINC001139670022 1131357797 /nfs/dbraw/zinc/35/77/97/1131357797.db2.gz VPYBMQNBMVLNFJ-IAGOWNOFSA-N 1 0 272.436 3.683 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]CC[C@@H]1CCC2(CCC2)O1 ZINC000717176107 1125422250 /nfs/dbraw/zinc/42/22/50/1125422250.db2.gz WZOSCJWYMOBHNK-LBPRGKRZSA-N 1 0 295.810 3.627 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]CC[C@@H]1CCC2(CCC2)O1 ZINC000717174131 1125422621 /nfs/dbraw/zinc/42/26/21/1125422621.db2.gz QSWAFWMTBQUSBH-AWEZNQCLSA-N 1 0 295.810 3.627 20 10 CHCDRO Cc1cccc([C@H]2CCC[N@@H+]2Cc2ccc(N)cc2)c1 ZINC001204849090 1125428886 /nfs/dbraw/zinc/42/88/86/1125428886.db2.gz XVBHUSWSXDHJBZ-GOSISDBHSA-N 1 0 266.388 3.914 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1nc(C)cs1 ZINC000105504045 1125436893 /nfs/dbraw/zinc/43/68/93/1125436893.db2.gz HFTOAIRNCGPPDI-OAHLLOKOSA-N 1 0 289.448 3.758 20 10 CHCDRO Cc1cc(C[N@@H+]2CCCC[C@@](C)(F)C2)ccc1N(C)C ZINC001139669740 1131355690 /nfs/dbraw/zinc/35/56/90/1131355690.db2.gz KGWCVRPFWBYCGT-QGZVFWFLSA-N 1 0 278.415 3.775 20 10 CHCDRO CC[C@@H]1CCCC[N@@H+]1Cc1cc(F)cc(Cl)c1[O-] ZINC001237798552 1129186778 /nfs/dbraw/zinc/18/67/78/1129186778.db2.gz JAPJVJBNLDGOBV-GFCCVEGCSA-N 1 0 271.763 3.949 20 10 CHCDRO Cc1cc(C[N@H+]2C[C@@H]3CCCC[C@@H]3C2)ccc1N(C)C ZINC001139670021 1131358206 /nfs/dbraw/zinc/35/82/06/1131358206.db2.gz VPYBMQNBMVLNFJ-CALCHBBNSA-N 1 0 272.436 3.683 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]CCCC(C)(F)F)c1O ZINC000295942738 1129219641 /nfs/dbraw/zinc/21/96/41/1129219641.db2.gz GLBHPVCIXJDRKZ-UHFFFAOYSA-N 1 0 293.741 3.579 20 10 CHCDRO COc1ccc2ccc(O)c(C[N@@H+]3CCCC4(CC4)C3)c2c1 ZINC000184872149 1129260367 /nfs/dbraw/zinc/26/03/67/1129260367.db2.gz STIACSSQWWRMKG-UHFFFAOYSA-N 1 0 297.398 3.930 20 10 CHCDRO CC(=O)Nc1ccc(C[NH2+][C@H](C)c2cc(C)ccc2O)cc1 ZINC000184916074 1129263203 /nfs/dbraw/zinc/26/32/03/1129263203.db2.gz BFWRZBTYPHOCPV-CYBMUJFWSA-N 1 0 298.386 3.510 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1O)c1ccccc1F ZINC000037763988 1129266813 /nfs/dbraw/zinc/26/68/13/1129266813.db2.gz UFCAIHTZFSGTDN-NEPJUHHUSA-N 1 0 259.324 3.943 20 10 CHCDRO Cc1ccccc1C[C@@H](C)[NH2+][C@H](C)c1ccccc1O ZINC000037776899 1129268674 /nfs/dbraw/zinc/26/86/74/1129268674.db2.gz SOQUKHBTNJJRKI-HUUCEWRRSA-N 1 0 269.388 3.982 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H](C)CC(C)(C)OC)cc1 ZINC000766191218 1129281021 /nfs/dbraw/zinc/28/10/21/1129281021.db2.gz LKRZQCCFBDJITF-HUUCEWRRSA-N 1 0 292.467 3.997 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]C1CCCCCC1 ZINC000734512038 1129311505 /nfs/dbraw/zinc/31/15/05/1129311505.db2.gz NCOUZWLGRBQLNP-UHFFFAOYSA-N 1 0 260.425 3.873 20 10 CHCDRO CCCN(CCC)c1ccc(C[NH2+][C@H](C)C(C)(C)O)cc1 ZINC000734841480 1129324716 /nfs/dbraw/zinc/32/47/16/1129324716.db2.gz PTIAUQANYRUUKR-OAHLLOKOSA-N 1 0 292.467 3.562 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C2CCC3(CC3)CC2)cc1C ZINC000766212227 1129337558 /nfs/dbraw/zinc/33/75/58/1129337558.db2.gz FQEYYZHWPASYEX-UHFFFAOYSA-N 1 0 259.393 3.821 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]C2CCC3(CC3)CC2)c1 ZINC000766213549 1129344945 /nfs/dbraw/zinc/34/49/45/1129344945.db2.gz QSBHFGSMVQOWIB-UHFFFAOYSA-N 1 0 275.392 3.603 20 10 CHCDRO C[N@H+](C/C=C/c1ccc(F)cc1)Cc1ccccc1O ZINC000091974480 1129375862 /nfs/dbraw/zinc/37/58/62/1129375862.db2.gz RQHNJRRRPVVDAT-SNAWJCMRSA-N 1 0 271.335 3.677 20 10 CHCDRO C[N@H+](Cc1coc2ccccc12)Cc1ccccc1O ZINC000091956614 1129375995 /nfs/dbraw/zinc/37/59/95/1129375995.db2.gz OPQWGNQNDFIVEB-UHFFFAOYSA-N 1 0 267.328 3.770 20 10 CHCDRO C[C@H]1C[C@@H]1c1ccc(C[N@H+](C)Cc2ccccc2O)o1 ZINC000091974432 1129376096 /nfs/dbraw/zinc/37/60/96/1129376096.db2.gz QFRVYBNEOQMGLH-WFASDCNBSA-N 1 0 271.360 3.741 20 10 CHCDRO CC(C)[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccccn1 ZINC000736648384 1129378730 /nfs/dbraw/zinc/37/87/30/1129378730.db2.gz XVXQMTVMYLYEQA-SFHVURJKSA-N 1 0 283.419 3.635 20 10 CHCDRO Cc1ccc([C@@H](C)C[NH2+]Cc2ccc(N(C)C)cc2)cc1 ZINC000738435865 1129393967 /nfs/dbraw/zinc/39/39/67/1129393967.db2.gz OBNVMHYANHAAAK-INIZCTEOSA-N 1 0 282.431 3.954 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)C2(C)CC2)cc1F ZINC000740004710 1129409087 /nfs/dbraw/zinc/40/90/87/1129409087.db2.gz TXROUFBAYROPLK-ZDUSSCGKSA-N 1 0 278.415 3.950 20 10 CHCDRO C[C@@H](C[NH2+][C@H](C)c1ccc2ccccc2c1O)C[C@H](C)O ZINC000248493051 1129419232 /nfs/dbraw/zinc/41/92/32/1129419232.db2.gz JRLBCKCZCXNKHY-HZSPNIEDSA-N 1 0 287.403 3.603 20 10 CHCDRO CCO[C@@H]1C[C@H]([NH2+][C@H](C)c2cc(F)ccc2O)C12CCC2 ZINC000248515191 1129420098 /nfs/dbraw/zinc/42/00/98/1129420098.db2.gz NYFCLDBDPWWMRK-XFBWCDHKSA-N 1 0 293.382 3.530 20 10 CHCDRO Cc1nc(C)c([C@@H](C)[N@H+](C)Cc2cc(C)ccc2O)s1 ZINC000093275600 1129420411 /nfs/dbraw/zinc/42/04/11/1129420411.db2.gz INPTXEKVHGBAAF-GFCCVEGCSA-N 1 0 290.432 3.967 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+](CCc2nccs2)C(C)C)c1 ZINC000093764306 1129427993 /nfs/dbraw/zinc/42/79/93/1129427993.db2.gz UCUWHMNYOBVETA-UHFFFAOYSA-N 1 0 290.432 3.610 20 10 CHCDRO Oc1cc2c(cc1C[NH+]1CCC3(CCC3)CC1)CCC2 ZINC000795713206 1129439141 /nfs/dbraw/zinc/43/91/41/1129439141.db2.gz GQFUUDZGSASRJQ-UHFFFAOYSA-N 1 0 271.404 3.647 20 10 CHCDRO C[C@H](Cc1ccsc1)[NH2+][C@H](C)c1cc(F)ccc1O ZINC000094617884 1129448238 /nfs/dbraw/zinc/44/82/38/1129448238.db2.gz CKBYQARLIPUVJS-GHMZBOCLSA-N 1 0 279.380 3.875 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(F)cc1F)c1cc(F)ccc1O ZINC000094618060 1129448317 /nfs/dbraw/zinc/44/83/17/1129448317.db2.gz FUDDDHUNXGLQGU-SECBINFHSA-N 1 0 281.277 3.660 20 10 CHCDRO Cc1noc(C)c1[C@H](C)[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000094618497 1129448348 /nfs/dbraw/zinc/44/83/48/1129448348.db2.gz MXLRLZDTOUCPPL-IUCAKERBSA-N 1 0 278.327 3.548 20 10 CHCDRO Cc1cscc1C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000094876952 1129454807 /nfs/dbraw/zinc/45/48/07/1129454807.db2.gz QOJBPBNIYLHPEN-CYBMUJFWSA-N 1 0 274.433 3.973 20 10 CHCDRO COc1ccc(C2([NH2+]Cc3cc(C)c(C)cc3O)CC2)cc1 ZINC000742370083 1129472054 /nfs/dbraw/zinc/47/20/54/1129472054.db2.gz QLRBYROBVZPIEZ-UHFFFAOYSA-N 1 0 297.398 3.797 20 10 CHCDRO Cc1ccc(CC[C@H](C)[NH2+]Cc2ccc(N(C)C)cc2)o1 ZINC000742381520 1129472763 /nfs/dbraw/zinc/47/27/63/1129472763.db2.gz ZCVWSDHOCBMBQG-AWEZNQCLSA-N 1 0 286.419 3.765 20 10 CHCDRO c1cc(C[NH2+][C@H]2C[C@@H]2C2CCCCC2)cc2c1OCC2 ZINC000742375414 1129475599 /nfs/dbraw/zinc/47/55/99/1129475599.db2.gz MHPMXCKHLQIRHO-SJORKVTESA-N 1 0 271.404 3.680 20 10 CHCDRO CC[C@@H](C)C[C@@H](C)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000742379876 1129475962 /nfs/dbraw/zinc/47/59/62/1129475962.db2.gz CDBHMAHYCYLTFI-CHWSQXEVSA-N 1 0 266.404 3.806 20 10 CHCDRO COc1ccc(C[NH2+]C[C@H](C)Oc2ccccc2C)cc1C ZINC000742379554 1129476150 /nfs/dbraw/zinc/47/61/50/1129476150.db2.gz WMHCXYOEHYKASY-INIZCTEOSA-N 1 0 299.414 3.869 20 10 CHCDRO COc1ccc2ccc(O)c(C[N@@H+]3CCC(C)(C)C3)c2c1 ZINC000743390909 1129522003 /nfs/dbraw/zinc/52/20/03/1129522003.db2.gz MDMXGBJBOWVGFU-UHFFFAOYSA-N 1 0 285.387 3.786 20 10 CHCDRO CCC[C@H]1[C@H](C)CCC[N@@H+]1Cc1cc2c(cc1O)OCO2 ZINC000743380216 1129522613 /nfs/dbraw/zinc/52/26/13/1129522613.db2.gz WJAVUZYXYLVFLB-OCCSQVGLSA-N 1 0 291.391 3.522 20 10 CHCDRO Cc1ccccc1C1(C[NH2+]Cc2ccc3c(c2)CCO3)CC1 ZINC000303114367 1129528166 /nfs/dbraw/zinc/52/81/66/1129528166.db2.gz GWFPJJHETIQPQY-UHFFFAOYSA-N 1 0 293.410 3.751 20 10 CHCDRO CC(C)(C[NH2+]Cc1ccc2c(c1)CCO2)c1ccc(F)cc1 ZINC000303214932 1129533627 /nfs/dbraw/zinc/53/36/27/1129533627.db2.gz SSOSGMHWPQTPHM-UHFFFAOYSA-N 1 0 299.389 3.828 20 10 CHCDRO CC(C)O[C@@H]1C[C@H]([NH2+][C@H](C)c2ccccc2O)C1(C)C ZINC000766331756 1129604323 /nfs/dbraw/zinc/60/43/23/1129604323.db2.gz UKWXERANPLTFBU-UHOFOFEASA-N 1 0 277.408 3.635 20 10 CHCDRO C[N@H+](Cc1ccccc1O)Cc1cccc2ncccc12 ZINC001137630522 1131388129 /nfs/dbraw/zinc/38/81/29/1131388129.db2.gz BNKUEZHKCVHSNA-UHFFFAOYSA-N 1 0 278.355 3.572 20 10 CHCDRO CSC1CCC(C[NH2+]Cc2cc(F)ccc2O)CC1 ZINC000720525627 1129652396 /nfs/dbraw/zinc/65/23/96/1129652396.db2.gz WWMZGNNVJHOXLT-UHFFFAOYSA-N 1 0 283.412 3.543 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CC[C@H]1C)c1cc(Br)ccc1O ZINC000379795250 1129660068 /nfs/dbraw/zinc/66/00/68/1129660068.db2.gz LASLYGYMQKFTAU-JIMOISOXSA-N 1 0 298.224 3.994 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C(C)(C)c2ccccc2)cc1 ZINC000380312440 1129715489 /nfs/dbraw/zinc/71/54/89/1129715489.db2.gz WPTZCTBMGQNPJD-UHFFFAOYSA-N 1 0 268.404 3.778 20 10 CHCDRO C[C@H]1SCC[C@@H]1[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000380317769 1129728585 /nfs/dbraw/zinc/72/85/85/1129728585.db2.gz MUZAAWIRWFSXJD-PBHICJAKSA-N 1 0 290.476 3.661 20 10 CHCDRO Cc1ccc([C@H](O)[C@H](C)[NH2+]Cc2cc(C)c(C)cc2O)cc1 ZINC000796484433 1129748566 /nfs/dbraw/zinc/74/85/66/1129748566.db2.gz YGZBPXYVAUNJHL-HNAYVOBHSA-N 1 0 299.414 3.529 20 10 CHCDRO CCCC[N@@H+](Cc1ccccc1O)C[C@@H](O)CCC(C)C ZINC001169754355 1129754667 /nfs/dbraw/zinc/75/46/67/1129754667.db2.gz LIGMCWXVASDFKG-KRWDZBQOSA-N 1 0 293.451 3.791 20 10 CHCDRO C[C@@H]1CC[C@H]1[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000796525764 1129772762 /nfs/dbraw/zinc/77/27/62/1129772762.db2.gz FVDPHERHQKOKLB-CXAGYDPISA-N 1 0 267.372 3.947 20 10 CHCDRO CCc1cccc(C[NH2+]C[C@@H]2CCCCC2(F)F)c1O ZINC000691436602 1129783906 /nfs/dbraw/zinc/78/39/06/1129783906.db2.gz SDWKBQXVMBNXIM-AWEZNQCLSA-N 1 0 283.362 3.870 20 10 CHCDRO CCOc1ccc(O)c(C[NH+]2CCCCCCC2)c1 ZINC000768143856 1129833019 /nfs/dbraw/zinc/83/30/19/1129833019.db2.gz PRQOFMHMNSWOJQ-UHFFFAOYSA-N 1 0 263.381 3.557 20 10 CHCDRO CC[N@H+](Cc1occc1C)Cc1ccc(N(C)C)cc1 ZINC000768132694 1129834689 /nfs/dbraw/zinc/83/46/89/1129834689.db2.gz ILTYKSFOCZKBKQ-UHFFFAOYSA-N 1 0 272.392 3.676 20 10 CHCDRO CO[C@@H](C[NH2+]Cc1c(O)cccc1Cl)c1ccccc1 ZINC000113326354 1129835875 /nfs/dbraw/zinc/83/58/75/1129835875.db2.gz UTKWIDAFXNJHAB-INIZCTEOSA-N 1 0 291.778 3.523 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CCCC[C@@H]2CC)c(O)c1 ZINC000768138524 1129835995 /nfs/dbraw/zinc/83/59/95/1129835995.db2.gz NRUPOFBQFSLZQR-AWEZNQCLSA-N 1 0 263.381 3.555 20 10 CHCDRO COc1cccc(O)c1C[N@@H+]1CCc2sccc2[C@@H]1C ZINC000768208049 1129840338 /nfs/dbraw/zinc/84/03/38/1129840338.db2.gz MDJHGTBKTXLPOG-NSHDSACASA-N 1 0 289.400 3.582 20 10 CHCDRO C[C@H]([NH2+]CC[C@@H]1CC1(Cl)Cl)c1ccccc1O ZINC000822812692 1131401253 /nfs/dbraw/zinc/40/12/53/1131401253.db2.gz KOOYSADABAENAR-VHSXEESVSA-N 1 0 274.191 3.627 20 10 CHCDRO CC(C)[N@H+](Cc1ccco1)Cc1ccc(N(C)C)cc1 ZINC000768249427 1129847760 /nfs/dbraw/zinc/84/77/60/1129847760.db2.gz FWEQGCKBQATBEV-UHFFFAOYSA-N 1 0 272.392 3.756 20 10 CHCDRO C[N@H+](Cc1cc(-c2ccccc2)ccc1O)[C@H]1CCSC1 ZINC000768262092 1129849119 /nfs/dbraw/zinc/84/91/19/1129849119.db2.gz GJECRCDWCKRRQL-KRWDZBQOSA-N 1 0 299.439 3.997 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)c(F)c1)C1CCCC1 ZINC000768334259 1129851359 /nfs/dbraw/zinc/85/13/59/1129851359.db2.gz CNTZZSPKNFHNMK-UHFFFAOYSA-N 1 0 264.388 3.656 20 10 CHCDRO CC[N@H+](Cc1ccc(C)cc1)Cc1cccc(OC)c1O ZINC000768334413 1129851380 /nfs/dbraw/zinc/85/13/80/1129851380.db2.gz IRCCGHBSPXXBTP-UHFFFAOYSA-N 1 0 285.387 3.731 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CC[C@@H](c3ccccc3)C2)cc1 ZINC000768360663 1129852998 /nfs/dbraw/zinc/85/29/98/1129852998.db2.gz NYOVTVUVJYHAQY-GOSISDBHSA-N 1 0 280.415 3.742 20 10 CHCDRO C[C@@H](F)CC[NH2+][C@H](C)c1cc(Br)ccc1O ZINC000382155182 1129855071 /nfs/dbraw/zinc/85/50/71/1129855071.db2.gz QZBJXBYRVGLUSW-RKDXNWHRSA-N 1 0 290.176 3.553 20 10 CHCDRO CC[N@H+](Cc1cc(OC)c(C)cc1O)[C@H](C)C(C)C ZINC000768439022 1129855992 /nfs/dbraw/zinc/85/59/92/1129855992.db2.gz DGQFLWNFHMAEHF-CYBMUJFWSA-N 1 0 265.397 3.576 20 10 CHCDRO COc1cccc(O)c1C[N@H+](C)[C@H](C)c1cccs1 ZINC000768417314 1129857699 /nfs/dbraw/zinc/85/76/99/1129857699.db2.gz MWBHRLACPRAUDI-LLVKDONJSA-N 1 0 277.389 3.655 20 10 CHCDRO CC[C@H](C)C[N@H+](CC)Cc1cc(OC)c(C)cc1O ZINC000768463784 1129859425 /nfs/dbraw/zinc/85/94/25/1129859425.db2.gz MEVIZCVRIMRJFH-LBPRGKRZSA-N 1 0 265.397 3.577 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@@H]2CCCC(F)(F)C2)cc1C ZINC000800274449 1129861474 /nfs/dbraw/zinc/86/14/74/1129861474.db2.gz NKSWDQHCXZOLKA-CYBMUJFWSA-N 1 0 283.362 3.924 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]CC2CCC(F)(F)CC2)c1 ZINC000800293418 1129865408 /nfs/dbraw/zinc/86/54/08/1129865408.db2.gz DKANJEYGZVOBHB-UHFFFAOYSA-N 1 0 299.361 3.706 20 10 CHCDRO CC1(C)COCC[N@@H+]1Cc1cc(-c2ccccc2)ccc1O ZINC000769007632 1129888122 /nfs/dbraw/zinc/88/81/22/1129888122.db2.gz VYFOEGQADBLXFM-UHFFFAOYSA-N 1 0 297.398 3.670 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CCC[C@H]3CCC[C@@H]32)c(O)c1 ZINC000769102524 1129889049 /nfs/dbraw/zinc/88/90/49/1129889049.db2.gz OLAOKXHOLFKVDL-CJNGLKHVSA-N 1 0 275.392 3.555 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H]3CCC[C@H]32)cc1 ZINC000769101751 1129890252 /nfs/dbraw/zinc/89/02/52/1129890252.db2.gz GDGFQFJFZKAEAN-DOTOQJQBSA-N 1 0 258.409 3.517 20 10 CHCDRO Cc1ccc(C)n1C1CC[NH+](Cc2cc(C)ccc2O)CC1 ZINC000769210199 1129896242 /nfs/dbraw/zinc/89/62/42/1129896242.db2.gz ZCKJKLVMQBZGOA-UHFFFAOYSA-N 1 0 298.430 3.956 20 10 CHCDRO CCC1(CC)[C@H]([NH2+]Cc2ccc(OC)c(C)c2)C[C@H]1OC ZINC001170002532 1129896598 /nfs/dbraw/zinc/89/65/98/1129896598.db2.gz NQOCRLZEELBZLZ-IAGOWNOFSA-N 1 0 291.435 3.687 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[NH2+][C@@H]1CC[C@H]1C1CCC1 ZINC000800967808 1129900768 /nfs/dbraw/zinc/90/07/68/1129900768.db2.gz RZEFBHMRMYWPGD-RBUKOAKNSA-N 1 0 284.447 3.955 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CCCc3ccccc3C2)c(O)c1 ZINC000769334256 1129903107 /nfs/dbraw/zinc/90/31/07/1129903107.db2.gz ZSDXKMAQUWAMMP-UHFFFAOYSA-N 1 0 297.398 3.739 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CC[C@@H](c2ccco2)C1 ZINC000769389692 1129906176 /nfs/dbraw/zinc/90/61/76/1129906176.db2.gz NGIRKFWJDGUECV-LLVKDONJSA-N 1 0 277.751 3.628 20 10 CHCDRO CC1(C)CC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000769397151 1129909358 /nfs/dbraw/zinc/90/93/58/1129909358.db2.gz AZENXEVFZXSWCZ-UHFFFAOYSA-N 1 0 272.436 3.909 20 10 CHCDRO CC1=CC[N@H+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000769446268 1129910374 /nfs/dbraw/zinc/91/03/74/1129910374.db2.gz LQNOBUXXOVVAHD-UHFFFAOYSA-N 1 0 270.420 3.829 20 10 CHCDRO C[C@H]1C[C@H](C)[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000769470967 1129912602 /nfs/dbraw/zinc/91/26/02/1129912602.db2.gz PJASNOMUHAWEBT-HOTGVXAUSA-N 1 0 272.436 3.907 20 10 CHCDRO COc1cccc(C[N@@H+]2CC[C@](C)(c3ccccc3)C2)c1O ZINC000769502827 1129914199 /nfs/dbraw/zinc/91/41/99/1129914199.db2.gz ALNNGHYZUMBUGU-IBGZPJMESA-N 1 0 297.398 3.564 20 10 CHCDRO CCS[C@@H]1CC[C@@H]([N@H+](C)Cc2ccc(N(C)C)cc2)C1 ZINC000769550334 1129916910 /nfs/dbraw/zinc/91/69/10/1129916910.db2.gz RBZKDZDHJWWRNA-IAGOWNOFSA-N 1 0 292.492 3.859 20 10 CHCDRO CC(=O)c1cc(F)cc(C[NH2+][C@H](C)c2ccsc2)c1O ZINC000801570620 1129928101 /nfs/dbraw/zinc/92/81/01/1129928101.db2.gz STFHOLIIMFCMBX-SECBINFHSA-N 1 0 293.363 3.646 20 10 CHCDRO C[C@@H]1C[C@@H](CC[NH2+]Cc2c(O)cccc2Cl)C[C@H](C)O1 ZINC000801731312 1129940680 /nfs/dbraw/zinc/94/06/80/1129940680.db2.gz XWNDHESKSKINEX-CLLJXQQHSA-N 1 0 297.826 3.729 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CCCC[C@@H](SC)C2)c(O)c1 ZINC000770351675 1129945900 /nfs/dbraw/zinc/94/59/00/1129945900.db2.gz UDOVJFVDOLEOQC-OAHLLOKOSA-N 1 0 295.448 3.508 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2CCCC3(CC3)C2)c1O ZINC000770674774 1129955084 /nfs/dbraw/zinc/95/50/84/1129955084.db2.gz MHEWUKIZBZNBNS-UHFFFAOYSA-N 1 0 265.784 3.730 20 10 CHCDRO COc1cccc(C[NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)c1O ZINC000770740556 1129958176 /nfs/dbraw/zinc/95/81/76/1129958176.db2.gz JAKDNRVROOBBOU-NVXWUHKLSA-N 1 0 297.398 3.827 20 10 CHCDRO CN(C)c1ccc(C[NH2+]Cc2cscc2Cl)cc1 ZINC000771943712 1129997787 /nfs/dbraw/zinc/99/77/87/1129997787.db2.gz QITQACYVKJFNMG-UHFFFAOYSA-N 1 0 280.824 3.757 20 10 CHCDRO CC1=CCC[C@@H](C)[C@H]1C[N@H+](C)Cc1ccccc1O ZINC000785978262 1130070606 /nfs/dbraw/zinc/07/06/06/1130070606.db2.gz SNTRQCPGVUVARL-ZBFHGGJFSA-N 1 0 259.393 3.816 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC3(CCCC3)OC(C)(C)C2)c1 ZINC000785988885 1130073173 /nfs/dbraw/zinc/07/31/73/1130073173.db2.gz QKYXZUDSLDYPNV-UHFFFAOYSA-N 1 0 289.419 3.624 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)CC[C@@H]2CCCO2)cc1 ZINC000786577871 1130106760 /nfs/dbraw/zinc/10/67/60/1130106760.db2.gz 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1130186078 /nfs/dbraw/zinc/18/60/78/1130186078.db2.gz BSLFXJUKEQPUCY-INIZCTEOSA-N 1 0 299.370 3.680 20 10 CHCDRO COc1ccccc1CC[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000788507350 1130191931 /nfs/dbraw/zinc/19/19/31/1130191931.db2.gz ZZCCMZSDCDVJDB-HNNXBMFYSA-N 1 0 299.414 3.911 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2cc(F)c(Cl)cc2F)c1 ZINC000788532011 1130194342 /nfs/dbraw/zinc/19/43/42/1130194342.db2.gz KBWAWCSPFNTKFS-UHFFFAOYSA-N 1 0 297.732 3.922 20 10 CHCDRO CC1(C)Nc2ccccc2[C@@H]1[NH2+]Cc1cc(F)ccc1O ZINC000903948954 1130211559 /nfs/dbraw/zinc/21/15/59/1130211559.db2.gz WMCKAAKZUXLUGT-INIZCTEOSA-N 1 0 286.350 3.566 20 10 CHCDRO CCC(O)(CC)CC[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000788779592 1130211864 /nfs/dbraw/zinc/21/18/64/1130211864.db2.gz XIFIHYRTSVVIFG-CQSZACIVSA-N 1 0 279.424 3.601 20 10 CHCDRO C[C@@H](C[NH2+][C@@H](C)c1ccc(N(C)C)cc1)CC(F)(F)F ZINC000397035354 1130216017 /nfs/dbraw/zinc/21/60/17/1130216017.db2.gz ZRVGBYZJPIIRMK-NEPJUHHUSA-N 1 0 288.357 3.992 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@H](C)C2CCC(F)(F)CC2)c1 ZINC000788983480 1130221471 /nfs/dbraw/zinc/22/14/71/1130221471.db2.gz JCCXXMYOFVNXME-LLVKDONJSA-N 1 0 299.361 3.704 20 10 CHCDRO CCOC[C@@H]([NH2+][C@H](CC)c1ccc(N(C)C)cc1)C(C)C ZINC000788983654 1130221802 /nfs/dbraw/zinc/22/18/02/1130221802.db2.gz FCJYOMHWVNIJEU-QZTJIDSGSA-N 1 0 292.467 3.854 20 10 CHCDRO CC(C)=CC[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000790698569 1130326250 /nfs/dbraw/zinc/32/62/50/1130326250.db2.gz PIUNMRZTTGARML-CYBMUJFWSA-N 1 0 259.393 3.888 20 10 CHCDRO C[C@@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1ccc(N(C)C)cc1 ZINC000791580331 1130383246 /nfs/dbraw/zinc/38/32/46/1130383246.db2.gz ZZZDAFJNEJVSHX-BXUZGUMPSA-N 1 0 286.341 3.525 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+]2CCSCC[C@H]2C)c1O ZINC000792197252 1130437390 /nfs/dbraw/zinc/43/73/90/1130437390.db2.gz SETXAOIORXIOSA-LLVKDONJSA-N 1 0 285.840 3.681 20 10 CHCDRO CC[C@H]1C[C@H]([N@H+](CC)Cc2ccc(N(C)C)cc2)CCO1 ZINC001170239923 1130465668 /nfs/dbraw/zinc/46/56/68/1130465668.db2.gz OIHHOOZBWYOPON-MSOLQXFVSA-N 1 0 290.451 3.532 20 10 CHCDRO Cc1cc(C[N@H+]2CCCOC[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC000772822574 1130501890 /nfs/dbraw/zinc/50/18/90/1130501890.db2.gz QECBAIJMCHBMSL-CQSZACIVSA-N 1 0 291.435 3.609 20 10 CHCDRO COc1ccc([C@H](C)[C@@H](C)[NH2+]Cc2cc(C)ccc2O)cc1 ZINC000747100328 1130517692 /nfs/dbraw/zinc/51/76/92/1130517692.db2.gz XCDORORDGGZGOB-HUUCEWRRSA-N 1 0 299.414 3.991 20 10 CHCDRO C[C@H]1C[C@H](C)[NH+]1Cc1ccc(N2CCCCC2)cc1 ZINC000793227618 1130531656 /nfs/dbraw/zinc/53/16/56/1130531656.db2.gz FJGXTJVFMSEGNY-GJZGRUSLSA-N 1 0 258.409 3.660 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](C)[C@H]2CCC(C)(C)C2)c1 ZINC000793359311 1130544754 /nfs/dbraw/zinc/54/47/54/1130544754.db2.gz VZXOYPZJVUZACB-AWEZNQCLSA-N 1 0 277.408 3.801 20 10 CHCDRO COc1cccc(O)c1C[N@@H+]1CCC[C@H](C(C)(C)C)C1 ZINC000793371785 1130547821 /nfs/dbraw/zinc/54/78/21/1130547821.db2.gz YQPXOZXIWXXMPA-ZDUSSCGKSA-N 1 0 277.408 3.659 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CCCc2ccccc2F)cc1C ZINC000793347281 1130548786 /nfs/dbraw/zinc/54/87/86/1130548786.db2.gz OIKKSRAOWNFARG-UHFFFAOYSA-N 1 0 287.378 3.871 20 10 CHCDRO COc1cccc(C[N@H+]2CC=C(C(C)(C)C)CC2)c1O ZINC000770386758 1130607255 /nfs/dbraw/zinc/60/72/55/1130607255.db2.gz VEFXGWWREAAGAK-UHFFFAOYSA-N 1 0 275.392 3.579 20 10 CHCDRO CCC[C@H]1C[N@H+](Cc2cc(C(C)C)c(C)cc2O)CCO1 ZINC000758389854 1130609858 /nfs/dbraw/zinc/60/98/58/1130609858.db2.gz LKNUBOFRLFDRCA-INIZCTEOSA-N 1 0 291.435 3.825 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CC2(CCC2)[C@H]1C1CC1 ZINC000811513366 1130619029 /nfs/dbraw/zinc/61/90/29/1130619029.db2.gz HBNOMFLVGNUDAN-OAHLLOKOSA-N 1 0 277.795 3.810 20 10 CHCDRO CC[NH+]1CCN(c2ccc(OC3CCCCC3)cc2)CC1 ZINC001234657644 1130669701 /nfs/dbraw/zinc/66/97/01/1130669701.db2.gz FUIJZMOYZMFTJN-UHFFFAOYSA-N 1 0 288.435 3.540 20 10 CHCDRO Cc1cccc(C2=CC[N@H+](Cc3ccccc3O)CC2)c1 ZINC000780780628 1130691787 /nfs/dbraw/zinc/69/17/87/1130691787.db2.gz XLEAGOYOXSJHML-UHFFFAOYSA-N 1 0 279.383 3.990 20 10 CHCDRO C[N@H+](Cc1cccc(-c2ccccc2)c1O)[C@H]1CCCOC1 ZINC001235000288 1130700103 /nfs/dbraw/zinc/70/01/03/1130700103.db2.gz QENFVDXHWUYBAX-KRWDZBQOSA-N 1 0 297.398 3.670 20 10 CHCDRO CC(=O)[C@@H]1CCC[N@@H+]1Cc1cccc(-c2ccccc2)c1O ZINC001235000939 1130701033 /nfs/dbraw/zinc/70/10/33/1130701033.db2.gz RJTOZANFKZITLP-SFHVURJKSA-N 1 0 295.382 3.613 20 10 CHCDRO O=C1CCC[N@@H+](Cc2cccc(-c3ccccc3)c2O)CC1 ZINC001235003700 1130703536 /nfs/dbraw/zinc/70/35/36/1130703536.db2.gz XBXQOWFZCKEIGL-UHFFFAOYSA-N 1 0 295.382 3.614 20 10 CHCDRO COc1ccc(O)c([C@@H](C)Nc2cc3c(c[nH+]2)CCCC3)c1 ZINC000812738893 1130710029 /nfs/dbraw/zinc/71/00/29/1130710029.db2.gz DMSONRYIPBVZNZ-GFCCVEGCSA-N 1 0 298.386 3.848 20 10 CHCDRO COc1ccc(O)c([C@H](C)Nc2cc3c(c[nH+]2)CCCC3)c1 ZINC000812738894 1130710471 /nfs/dbraw/zinc/71/04/71/1130710471.db2.gz DMSONRYIPBVZNZ-LBPRGKRZSA-N 1 0 298.386 3.848 20 10 CHCDRO COc1ccc2c(c1)C[C@H](C)[N@@H+](Cc1ccccc1O)[C@@H]2C ZINC000781925938 1130748988 /nfs/dbraw/zinc/74/89/88/1130748988.db2.gz CJTVZJDFYBRCEK-UONOGXRCSA-N 1 0 297.398 3.909 20 10 CHCDRO Nc1ccc(C[N@@H+]2CCC[C@H](c3ccccc3)C2)cc1 ZINC001235667420 1130763592 /nfs/dbraw/zinc/76/35/92/1130763592.db2.gz YHNHJLLNMSWBEL-KRWDZBQOSA-N 1 0 266.388 3.648 20 10 CHCDRO Nc1ccc(C[NH+]2CCC(c3ccccc3F)CC2)cc1 ZINC001235677946 1130768940 /nfs/dbraw/zinc/76/89/40/1130768940.db2.gz JVYBZXRWOQYISG-UHFFFAOYSA-N 1 0 284.378 3.788 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@H+]2Cc3ccccc3OC[C@H]2C)c1 ZINC000782290883 1130769485 /nfs/dbraw/zinc/76/94/85/1130769485.db2.gz UEFXYLJQAOZSJE-OAHLLOKOSA-N 1 0 297.398 3.792 20 10 CHCDRO Cc1ccc(O[C@H]2CCC[N@H+](Cc3ccc(N)cc3)C2)cc1 ZINC001235687987 1130770233 /nfs/dbraw/zinc/77/02/33/1130770233.db2.gz LHYVSQIGNDBXGD-IBGZPJMESA-N 1 0 296.414 3.621 20 10 CHCDRO COc1cccc(O)c1C[NH2+]C[C@@H]1CCCCC(F)(F)C1 ZINC000813782098 1130784020 /nfs/dbraw/zinc/78/40/20/1130784020.db2.gz MNHNOWSSVCKSNO-GFCCVEGCSA-N 1 0 299.361 3.706 20 10 CHCDRO C[C@H](COc1cccc(F)c1)[NH2+][C@H](C)c1ccccc1O ZINC000783503524 1130830394 /nfs/dbraw/zinc/83/03/94/1130830394.db2.gz FKVLOGOWRSITBB-CHWSQXEVSA-N 1 0 289.350 3.649 20 10 CHCDRO Cc1cccc(C)c1OCC[NH2+][C@@H](C)c1ccccc1O ZINC000783500475 1130831217 /nfs/dbraw/zinc/83/12/17/1130831217.db2.gz HJWLIUIWNNGDJO-HNNXBMFYSA-N 1 0 285.387 3.739 20 10 CHCDRO COC[C@@H](C)C[N@H+](Cc1ccccc1O)C1CCCCC1 ZINC000783506575 1130831943 /nfs/dbraw/zinc/83/19/43/1130831943.db2.gz MNANPGDIIYUYTQ-HNNXBMFYSA-N 1 0 291.435 3.809 20 10 CHCDRO C[C@H]([NH2+][C@@H]1C[C@@H]1Cc1ccccc1)c1ccccc1O ZINC000783516089 1130833099 /nfs/dbraw/zinc/83/30/99/1130833099.db2.gz AXMLVLCJUQBXJM-JLJPHGGASA-N 1 0 267.372 3.674 20 10 CHCDRO CCC1(CC)[C@H]([NH2+][C@@H](C)c2ccccc2O)C[C@@H]1OC ZINC000783518666 1130834028 /nfs/dbraw/zinc/83/40/28/1130834028.db2.gz NKBBZSUPYLATIM-MAZHCROVSA-N 1 0 277.408 3.637 20 10 CHCDRO C[C@H]([NH2+]CC1(C)Cc2ccccc2C1)c1ccccc1O ZINC000783526537 1130835747 /nfs/dbraw/zinc/83/57/47/1130835747.db2.gz WBYUIFPDMABPJQ-AWEZNQCLSA-N 1 0 281.399 3.848 20 10 CHCDRO Cc1cc(C)c(C[NH2+][C@@H]2C[C@@H]3[C@H](C2)C3(C)C)c(O)c1 ZINC001170730863 1130836977 /nfs/dbraw/zinc/83/69/77/1130836977.db2.gz LYMIRHBGUSJAFP-XMQYKBBCSA-N 1 0 259.393 3.533 20 10 CHCDRO Cc1ccc(O)c(C[N@H+]2C[C@H](C)[C@H]3CCCC[C@@H]32)c1 ZINC000783593532 1130841476 /nfs/dbraw/zinc/84/14/76/1130841476.db2.gz VPXYHHVXVDHGJR-IMJJTQAJSA-N 1 0 259.393 3.711 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCCC3(CCCC3)C2)c1 ZINC000783742984 1130852212 /nfs/dbraw/zinc/85/22/12/1130852212.db2.gz CVZPHABCNIGXPZ-UHFFFAOYSA-N 1 0 259.393 3.857 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H]2C[C@H](c3ccc(F)cc3)C2)cc1 ZINC000814301399 1130862663 /nfs/dbraw/zinc/86/26/63/1130862663.db2.gz YLNYHHYLHAHXFO-SAABIXHNSA-N 1 0 298.405 3.928 20 10 CHCDRO C[N@@H+](Cc1c(O)ccc2ccncc21)C[C@H]1CC=CCC1 ZINC000784013125 1130868401 /nfs/dbraw/zinc/86/84/01/1130868401.db2.gz UEXMHCLAXUHMIW-AWEZNQCLSA-N 1 0 282.387 3.729 20 10 CHCDRO C[N@H+](Cc1ccc(N)cc1)C(C)(C)Cc1ccccc1 ZINC001236155836 1130876457 /nfs/dbraw/zinc/87/64/57/1130876457.db2.gz QSVVIFUPNQUMPN-UHFFFAOYSA-N 1 0 268.404 3.722 20 10 CHCDRO COc1ccc(C[NH2+]C[C@@H](SC)C(C)(C)C)cc1C ZINC000784626240 1130914182 /nfs/dbraw/zinc/91/41/82/1130914182.db2.gz PGUWAMYJRIZDHP-OAHLLOKOSA-N 1 0 281.465 3.871 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H]1CCCSC1 ZINC000168816118 1130948585 /nfs/dbraw/zinc/94/85/85/1130948585.db2.gz GSEQTXFDZZPBCO-UPJWGTAASA-N 1 0 277.433 3.734 20 10 CHCDRO CCc1ccc([C@H](O)C[NH2+][C@H](C)c2cc(C)ccc2O)cc1 ZINC000797027495 1130954280 /nfs/dbraw/zinc/95/42/80/1130954280.db2.gz UQAALQJVSDGIPB-AUUYWEPGSA-N 1 0 299.414 3.647 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CCC[C@H]2c2cccnc2)cc1 ZINC000815076415 1130955897 /nfs/dbraw/zinc/95/58/97/1130955897.db2.gz FEVGJDWMHPEXQL-IBGZPJMESA-N 1 0 295.430 3.875 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)c(C)c1)c1nccs1 ZINC000815088161 1130957723 /nfs/dbraw/zinc/95/77/23/1130957723.db2.gz AEJLNHXDFQACFW-CQSZACIVSA-N 1 0 289.448 3.758 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)[C@@H](O)c1ccc(C)cc1)c1ccccc1O ZINC000797061396 1130958013 /nfs/dbraw/zinc/95/80/13/1130958013.db2.gz PXCASXXCQVZULN-UCLAIMLFSA-N 1 0 299.414 3.863 20 10 CHCDRO CCN(C)c1ccc(C[N@H+](C)Cc2occc2C)cc1 ZINC000815121811 1130959353 /nfs/dbraw/zinc/95/93/53/1130959353.db2.gz XYWFJXPHPQXMGB-UHFFFAOYSA-N 1 0 272.392 3.676 20 10 CHCDRO Cc1nc(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)cs1 ZINC000815561304 1130999306 /nfs/dbraw/zinc/99/93/06/1130999306.db2.gz DAZWVMFWTUDMAN-NSHDSACASA-N 1 0 276.405 3.625 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@H]2Cc3ccccc32)c(O)c1 ZINC000815576077 1131001961 /nfs/dbraw/zinc/00/19/61/1131001961.db2.gz IVFVTHOSSCDDLC-GOEBONIOSA-N 1 0 281.399 4.000 20 10 CHCDRO CCc1ccc(C[N@@H+]2CCC(F)(F)C(C)(C)C2)c(O)c1 ZINC001236783693 1131006587 /nfs/dbraw/zinc/00/65/87/1131006587.db2.gz OHAAJJSFQQAISN-UHFFFAOYSA-N 1 0 283.362 3.822 20 10 CHCDRO CCc1ccc(C[N@@H+]2CCc3ccc(C)cc3C2)c(O)c1 ZINC001236782549 1131006923 /nfs/dbraw/zinc/00/69/23/1131006923.db2.gz CEEZQBAYKSDCMO-UHFFFAOYSA-N 1 0 281.399 3.821 20 10 CHCDRO CCc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(C)nc2)c(O)c1 ZINC001236792367 1131009904 /nfs/dbraw/zinc/00/99/04/1131009904.db2.gz QELHBZBLIFPXCJ-GOSISDBHSA-N 1 0 296.414 3.995 20 10 CHCDRO CC[N@H+](Cc1cc(Cl)c(Cl)cc1[O-])C(C)C ZINC001236795001 1131010284 /nfs/dbraw/zinc/01/02/84/1131010284.db2.gz ZKDQZZXOOGJKTC-UHFFFAOYSA-N 1 0 262.180 3.929 20 10 CHCDRO COc1cc(C)c(C[N@H+](C)CCc2ccc(C)cc2)c(O)c1 ZINC001236810433 1131010547 /nfs/dbraw/zinc/01/05/47/1131010547.db2.gz GWKMGNZRWHEQID-UHFFFAOYSA-N 1 0 299.414 3.692 20 10 CHCDRO COc1cc(C)c(C[N@@H+]2Cc3cccc(C)c3C2)c(O)c1 ZINC001236807270 1131010584 /nfs/dbraw/zinc/01/05/84/1131010584.db2.gz FMDYJAJKSPWGFY-UHFFFAOYSA-N 1 0 283.371 3.533 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CCSC(C)C)c(O)c1 ZINC000815625597 1131010794 /nfs/dbraw/zinc/01/07/94/1131010794.db2.gz HVWJUHFTVXTMDQ-CYBMUJFWSA-N 1 0 267.438 3.801 20 10 CHCDRO COc1cc(O)c(C[NH+]2CC3CCC(CC3)C2)c(Cl)c1 ZINC001236807064 1131011068 /nfs/dbraw/zinc/01/10/68/1131011068.db2.gz DQQBOTWGITVCNZ-UHFFFAOYSA-N 1 0 295.810 3.676 20 10 CHCDRO COc1cc(C)c(C[N@@H+]2CC[C@H]2c2ccccc2)c(O)c1 ZINC001236812015 1131012998 /nfs/dbraw/zinc/01/29/98/1131012998.db2.gz XVFITVLNJXMSKE-KRWDZBQOSA-N 1 0 283.371 3.656 20 10 CHCDRO COc1cc(C)c(C[NH+]2CCCCCCCC2)c(O)c1 ZINC001236816747 1131013821 /nfs/dbraw/zinc/01/38/21/1131013821.db2.gz WDBVWAAMQVXMDZ-UHFFFAOYSA-N 1 0 277.408 3.865 20 10 CHCDRO COC1(CC[NH2+][C@@H](C)c2c(C)cc(C)cc2O)CCC1 ZINC000815642147 1131014302 /nfs/dbraw/zinc/01/43/02/1131014302.db2.gz TURAPLPMLGRROR-AWEZNQCLSA-N 1 0 277.408 3.619 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1cc[nH]c(=O)c1)c1ccc(N(C)C)cc1 ZINC000815642648 1131015166 /nfs/dbraw/zinc/01/51/66/1131015166.db2.gz IRCAFAWERXVAEY-CXAGYDPISA-N 1 0 299.418 3.655 20 10 CHCDRO Oc1cc2ccccc2cc1CN1CCC(F)(F)[C@H](F)C1 ZINC001236827528 1131016247 /nfs/dbraw/zinc/01/62/47/1131016247.db2.gz UORYYDYKUOXCFQ-OAHLLOKOSA-N 1 0 295.304 3.725 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2c(F)cc(F)cc2F)c(O)c1 ZINC000815649060 1131016408 /nfs/dbraw/zinc/01/64/08/1131016408.db2.gz GOYKVWQTPGFSFK-SNVBAGLBSA-N 1 0 295.304 3.969 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](OC)C1CC1)c1cc(Cl)ccc1O ZINC000815651269 1131018055 /nfs/dbraw/zinc/01/80/55/1131018055.db2.gz OVSYPNZUPXOXHW-UKRRQHHQSA-N 1 0 283.799 3.511 20 10 CHCDRO C[C@H]1CCCC[N@@H+]1Cc1cc2ccccc2cc1O ZINC001236838724 1131018914 /nfs/dbraw/zinc/01/89/14/1131018914.db2.gz DTIYCBVTEANKPF-ZDUSSCGKSA-N 1 0 255.361 3.920 20 10 CHCDRO Oc1cc2ccccc2cc1C[N@@H+]1CCC2(C1)CCOCC2 ZINC001236842471 1131020769 /nfs/dbraw/zinc/02/07/69/1131020769.db2.gz VHIKYCPRQAZQEA-UHFFFAOYSA-N 1 0 297.398 3.548 20 10 CHCDRO C[N@@H+](Cc1cc2ccccc2cc1O)CC1CCC1 ZINC001236841656 1131021003 /nfs/dbraw/zinc/02/10/03/1131021003.db2.gz OHOSTLDVSVQBDM-UHFFFAOYSA-N 1 0 255.361 3.777 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CCC[C@H]3CCCC[C@@H]32)c(O)c1 ZINC001237042041 1131037692 /nfs/dbraw/zinc/03/76/92/1131037692.db2.gz DPWWKKQNAOAYEG-PBHICJAKSA-N 1 0 289.419 3.946 20 10 CHCDRO CC(C)c1ccc(C[N@H+]2C[C@H]3[C@H](CCC3(F)F)C2)c(O)c1 ZINC001237050681 1131040180 /nfs/dbraw/zinc/04/01/80/1131040180.db2.gz GMORVPWGPQQCCU-HIFRSBDPSA-N 1 0 295.373 3.993 20 10 CHCDRO Cc1cnc2c(c1)C[N@H+](Cc1ccc(C(C)C)cc1O)CC2 ZINC001237054935 1131042987 /nfs/dbraw/zinc/04/29/87/1131042987.db2.gz IPAAMVVSKBLINI-UHFFFAOYSA-N 1 0 296.414 3.777 20 10 CHCDRO CCCOC1CC[NH+](Cc2ccc(C(C)C)cc2O)CC1 ZINC001237053994 1131043399 /nfs/dbraw/zinc/04/33/99/1131043399.db2.gz SGMKLODQRXKHJN-UHFFFAOYSA-N 1 0 291.435 3.907 20 10 CHCDRO CC(C)c1ccc(C[N@H+]2C[C@H]3CC[C@@H](C2)C3(F)F)c(O)c1 ZINC001237052336 1131043890 /nfs/dbraw/zinc/04/38/90/1131043890.db2.gz UPQBEECRTTXMBU-GASCZTMLSA-N 1 0 295.373 3.993 20 10 CHCDRO CCC[N@H+](Cc1ccc(C(C)C)cc1O)C1CCOCC1 ZINC001237055380 1131044320 /nfs/dbraw/zinc/04/43/20/1131044320.db2.gz NPHINZQYYFKRNU-UHFFFAOYSA-N 1 0 291.435 3.907 20 10 CHCDRO CC1(C)CCC[N@@H+]1Cc1c(O)ccc(F)c1Cl ZINC001237119721 1131052791 /nfs/dbraw/zinc/05/27/91/1131052791.db2.gz FBYJVABZPJRYQD-UHFFFAOYSA-N 1 0 257.736 3.559 20 10 CHCDRO C[C@H]1CCCC[N@@H+]1Cc1c(O)cccc1OC(F)(F)F ZINC001237120563 1131054260 /nfs/dbraw/zinc/05/42/60/1131054260.db2.gz QLWIDNMGLVDLFL-JTQLQIEISA-N 1 0 289.297 3.665 20 10 CHCDRO Oc1ccc(C(F)(F)F)cc1C[NH+]1CCCCCC1 ZINC001237135155 1131056534 /nfs/dbraw/zinc/05/65/34/1131056534.db2.gz GBQUEWPYTMDTMH-UHFFFAOYSA-N 1 0 273.298 3.787 20 10 CHCDRO C[N@H+](Cc1cc(C(F)(F)F)ccc1O)C(C)(C)C ZINC001237139752 1131057822 /nfs/dbraw/zinc/05/78/22/1131057822.db2.gz OLLGKGJIPJFENP-UHFFFAOYSA-N 1 0 261.287 3.641 20 10 CHCDRO Oc1ccc(C(F)(F)F)cc1C[NH+]1CCC(CF)CC1 ZINC001237139022 1131058914 /nfs/dbraw/zinc/05/89/14/1131058914.db2.gz BRRSKOKWAAUENO-UHFFFAOYSA-N 1 0 291.288 3.593 20 10 CHCDRO C[C@@H]1c2cccn2CC[N@H+]1Cc1ccc2ccccc2c1O ZINC000816481363 1131096819 /nfs/dbraw/zinc/09/68/19/1131096819.db2.gz RZLGZXWHDJQJLN-CQSZACIVSA-N 1 0 292.382 3.924 20 10 CHCDRO CC[C@H]1CO[C@@H](C)C[N@@H+]1Cc1ccc2ccccc2c1O ZINC000816480986 1131098583 /nfs/dbraw/zinc/09/85/83/1131098583.db2.gz DIEQCCLEXRYXLF-BBRMVZONSA-N 1 0 285.387 3.545 20 10 CHCDRO CC[C@@H]1CC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816520005 1131102192 /nfs/dbraw/zinc/10/21/92/1131102192.db2.gz CKHSRNYJDKUMMX-CYBMUJFWSA-N 1 0 255.361 3.777 20 10 CHCDRO C[C@@H]1[C@@H](C)CC[N@@H+]1Cc1ccc2ccccc2c1O ZINC000816520447 1131102502 /nfs/dbraw/zinc/10/25/02/1131102502.db2.gz PRZBPLSCZLNKTC-QWHCGFSZSA-N 1 0 255.361 3.776 20 10 CHCDRO Cc1cccc(CC[N@@H+](C)Cc2c(C)cccc2O)c1 ZINC001237488448 1131103704 /nfs/dbraw/zinc/10/37/04/1131103704.db2.gz XYVGHKRJONNUNY-UHFFFAOYSA-N 1 0 269.388 3.684 20 10 CHCDRO Cc1cccc(O)c1C[N@H+](C)Cc1cccc(Cl)c1 ZINC001237489104 1131103882 /nfs/dbraw/zinc/10/38/82/1131103882.db2.gz FIXPLMQJUFLRHB-UHFFFAOYSA-N 1 0 275.779 3.986 20 10 CHCDRO Cc1nocc1C[N@H+](Cc1ccccc1O)C1CCCC1 ZINC000816508869 1131104482 /nfs/dbraw/zinc/10/44/82/1131104482.db2.gz XHIIZRDNFHUSQS-UHFFFAOYSA-N 1 0 286.375 3.633 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+]1CCSC[C@H]1c1ccccc1 ZINC001237487816 1131104583 /nfs/dbraw/zinc/10/45/83/1131104583.db2.gz NJIAHYYRFFZFCT-KRWDZBQOSA-N 1 0 299.439 3.991 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+]1CCSC[C@@H]1c1ccccc1 ZINC001237487824 1131104718 /nfs/dbraw/zinc/10/47/18/1131104718.db2.gz NJIAHYYRFFZFCT-QGZVFWFLSA-N 1 0 299.439 3.991 20 10 CHCDRO Cc1ccc(CC[N@@H+](C)Cc2c(C)cccc2O)cc1 ZINC001237488450 1131105087 /nfs/dbraw/zinc/10/50/87/1131105087.db2.gz YBMSYBMLSUFBML-UHFFFAOYSA-N 1 0 269.388 3.684 20 10 CHCDRO CO[C@H]1CCCC[C@@H]1[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000799728889 1131105589 /nfs/dbraw/zinc/10/55/89/1131105589.db2.gz GFOPLWHWELVLNN-XEGUGMAKSA-N 1 0 283.799 3.654 20 10 CHCDRO CO[C@]1(C)CCC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816594572 1131109539 /nfs/dbraw/zinc/10/95/39/1131109539.db2.gz IVFJQVYRWFOQBS-GOSISDBHSA-N 1 0 285.387 3.546 20 10 CHCDRO CCCN(Cc1ccsc1C)c1ccc(C[NH3+])cc1 ZINC000816592193 1131109969 /nfs/dbraw/zinc/10/99/69/1131109969.db2.gz BMCXACXMZMYJJX-UHFFFAOYSA-N 1 0 274.433 3.932 20 10 CHCDRO Oc1c(C[NH2+][C@@H]2CCO[C@@H](C3CC3)C2)ccc2ccccc21 ZINC000816570130 1131112352 /nfs/dbraw/zinc/11/23/52/1131112352.db2.gz JSWFFEBIFZIVDJ-SJLPKXTDSA-N 1 0 297.398 3.593 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CC(C)(C)[C@H]2C(C)C)c(O)c1 ZINC000816625248 1131113282 /nfs/dbraw/zinc/11/32/82/1131113282.db2.gz YEOQOWGVZUDKBN-MRXNPFEDSA-N 1 0 277.408 3.657 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+][C@H]1C[C@H](c2ccc(F)cc2)C1 ZINC000816625218 1131113324 /nfs/dbraw/zinc/11/33/24/1131113324.db2.gz XCXVUELLGDAXHE-YGUOUDRMSA-N 1 0 289.325 3.706 20 10 CHCDRO CCSCCC[NH2+]Cc1ccc2ccccc2c1O ZINC000816599321 1131114483 /nfs/dbraw/zinc/11/44/83/1131114483.db2.gz IWQGYLCOMDXIPJ-UHFFFAOYSA-N 1 0 275.417 3.778 20 10 CHCDRO CC1(C)SC[C@@H]1[NH2+]Cc1ccc2ccccc2c1O ZINC000816601134 1131114789 /nfs/dbraw/zinc/11/47/89/1131114789.db2.gz SNBOOZAZSPQPHI-AWEZNQCLSA-N 1 0 273.401 3.529 20 10 CHCDRO COc1ccc(O)c(C[NH2+]C[C@@H](c2ccccc2)C2CC2)c1 ZINC000816619046 1131116098 /nfs/dbraw/zinc/11/60/98/1131116098.db2.gz RCEWSDPUCYVCKI-SFHVURJKSA-N 1 0 297.398 3.684 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2CCCO[C@H](C(C)C)C2)c1O ZINC000816676133 1131123802 /nfs/dbraw/zinc/12/38/02/1131123802.db2.gz TZMXULKOOKLXOK-HNNXBMFYSA-N 1 0 297.826 3.601 20 10 CHCDRO C[C@@H]1CC[C@@H]([NH2+]Cc2c(O)cccc2Cl)C[C@H]1C ZINC000252503631 1131125720 /nfs/dbraw/zinc/12/57/20/1131125720.db2.gz NCJLENPLKJFLPH-IJLUTSLNSA-N 1 0 267.800 3.960 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@H](F)CC2)c1O ZINC001237681344 1131127006 /nfs/dbraw/zinc/12/70/06/1131127006.db2.gz NGPQOEVINWWBFH-CYBMUJFWSA-N 1 0 271.763 3.678 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2C[C@@H](C)C[C@H]2CF)c1O ZINC001237682062 1131127435 /nfs/dbraw/zinc/12/74/35/1131127435.db2.gz WITIMURFRZIJHT-ZANVPECISA-N 1 0 271.763 3.534 20 10 CHCDRO C[C@H]1CCCC[N@@H+]1Cc1cc(F)cc(Cl)c1[O-] ZINC001237810054 1131142437 /nfs/dbraw/zinc/14/24/37/1131142437.db2.gz MSLTVFZSSXTSNN-VIFPVBQESA-N 1 0 257.736 3.559 20 10 CHCDRO CSCC[C@H](C)[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001116445412 1131146664 /nfs/dbraw/zinc/14/66/64/1131146664.db2.gz MBCGXBLLOAXUCK-HNNXBMFYSA-N 1 0 292.492 3.860 20 10 CHCDRO C[C@@H]([N@H+](C)Cc1ccc(N2CCCC2)cc1)C1(C)CC1 ZINC001116448805 1131147128 /nfs/dbraw/zinc/14/71/28/1131147128.db2.gz FYIRJIHSJSWBGA-OAHLLOKOSA-N 1 0 272.436 3.907 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[NH+]1C[C@@H]2CCCC[C@H]2C1 ZINC001116442911 1131147194 /nfs/dbraw/zinc/14/71/94/1131147194.db2.gz WRPDXNRXZGIYHS-ROUUACIJSA-N 1 0 284.447 3.909 20 10 CHCDRO CC[C@H]1CCCC[N@@H+]1Cc1cc(F)c(Cl)cc1[O-] ZINC001237939357 1131153009 /nfs/dbraw/zinc/15/30/09/1131153009.db2.gz BFYTUDPHSNSKNO-NSHDSACASA-N 1 0 271.763 3.949 20 10 CHCDRO [O-]c1cc(Cl)c(F)cc1C[N@@H+]1CCC12CCCC2 ZINC001237933547 1131153826 /nfs/dbraw/zinc/15/38/26/1131153826.db2.gz CHDTZLQODGBSBD-UHFFFAOYSA-N 1 0 269.747 3.703 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000817412060 1131160546 /nfs/dbraw/zinc/16/05/46/1131160546.db2.gz BZBBHTANOTVSFX-JTQLQIEISA-N 1 0 291.288 3.696 20 10 CHCDRO Cc1cc(F)cc(C[NH+]2CCC3(CCCC3)CC2)c1O ZINC001238065632 1131166326 /nfs/dbraw/zinc/16/63/26/1131166326.db2.gz WREPMXXTJNAHMN-UHFFFAOYSA-N 1 0 277.383 3.996 20 10 CHCDRO Cc1cc(F)cc(C[NH+]2CCC3(CC(F)C3)CC2)c1O ZINC001238059247 1131166462 /nfs/dbraw/zinc/16/64/62/1131166462.db2.gz BHGNSOXBLBSBTR-UHFFFAOYSA-N 1 0 281.346 3.554 20 10 CHCDRO Cc1cc(F)cc(C[N@@H+]2CCC[C@H]3CCCC[C@H]32)c1O ZINC001238062397 1131166811 /nfs/dbraw/zinc/16/68/11/1131166811.db2.gz PNONNUMUZBVPTL-CZUORRHYSA-N 1 0 277.383 3.994 20 10 CHCDRO Cc1cc(F)cc(C[N@H+](C)CCc2ccc(F)cc2)c1O ZINC001238061793 1131166922 /nfs/dbraw/zinc/16/69/22/1131166922.db2.gz IJSRGKZOQFGHTM-UHFFFAOYSA-N 1 0 291.341 3.653 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2cc(C)nc(C)c2)c(O)c1 ZINC000817590186 1131175291 /nfs/dbraw/zinc/17/52/91/1131175291.db2.gz VVYICWUHLTWWPR-HNNXBMFYSA-N 1 0 284.403 3.872 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccc(N)cc1)c1ccc(Cl)s1 ZINC000817955493 1131190630 /nfs/dbraw/zinc/19/06/30/1131190630.db2.gz CCAWGCPMLQOKAB-SNVBAGLBSA-N 1 0 280.824 3.877 20 10 CHCDRO Nc1ccc(CC[NH2+][C@@H]2CCSc3ccccc32)cc1 ZINC000817955685 1131190634 /nfs/dbraw/zinc/19/06/34/1131190634.db2.gz FITGHRWOAWXMJU-MRXNPFEDSA-N 1 0 284.428 3.638 20 10 CHCDRO Cc1ccsc1[C@@H](C)[NH2+]CCc1ccc(N)cc1 ZINC000817955762 1131190647 /nfs/dbraw/zinc/19/06/47/1131190647.db2.gz HEHUBRAZSOTDCY-GFCCVEGCSA-N 1 0 260.406 3.532 20 10 CHCDRO CC(C)c1ccc([C@H](N)C[NH2+][C@H](C)c2ccccc2O)cc1 ZINC000817953405 1131190691 /nfs/dbraw/zinc/19/06/91/1131190691.db2.gz MXSDVMPWIABDOC-RDTXWAMCSA-N 1 0 298.430 3.866 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccc(N)cc1)c1ccccc1F ZINC000817957015 1131191127 /nfs/dbraw/zinc/19/11/27/1131191127.db2.gz HJAFXPDYQXOTJI-KRWDZBQOSA-N 1 0 272.367 3.691 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccc(N)cc1)c1cccc(F)c1 ZINC000817957832 1131191156 /nfs/dbraw/zinc/19/11/56/1131191156.db2.gz PORHNTHIENRIEW-KRWDZBQOSA-N 1 0 272.367 3.691 20 10 CHCDRO CC1(C)[C@@H]([NH2+]CCc2ccc(N)cc2)C[C@H]1c1ccccc1 ZINC000817956958 1131191227 /nfs/dbraw/zinc/19/12/27/1131191227.db2.gz GLLIRRKXLLEOEO-OALUTQOASA-N 1 0 294.442 3.983 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H](CN)C2CCCCC2)c(O)c1C ZINC000817957602 1131191343 /nfs/dbraw/zinc/19/13/43/1131191343.db2.gz DFNINISITYHVCI-PBHICJAKSA-N 1 0 290.451 3.567 20 10 CHCDRO Cc1ccc2c(c1)[C@H]([NH2+]CCc1ccc(N)cc1)[C@H](C)C2 ZINC000817958525 1131191429 /nfs/dbraw/zinc/19/14/29/1131191429.db2.gz WRPYGDGZZADKQW-AUUYWEPGSA-N 1 0 280.415 3.643 20 10 CHCDRO CCOc1cccc([C@@H](C)[NH2+]CCc2ccc(N)cc2)c1 ZINC000817956217 1131191663 /nfs/dbraw/zinc/19/16/63/1131191663.db2.gz UCBBVEQQBBNBDK-CQSZACIVSA-N 1 0 284.403 3.561 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCCC[C@@H]1C[NH3+])c1cccc(Cl)c1[O-] ZINC000817960640 1131192168 /nfs/dbraw/zinc/19/21/68/1131192168.db2.gz ONGWKWJENMMPBO-BYCMXARLSA-N 1 0 296.842 3.604 20 10 CHCDRO CC[C@H]([NH2+]Cc1cccc2c1CCCN2)c1ccccc1O ZINC000817975705 1131193648 /nfs/dbraw/zinc/19/36/48/1131193648.db2.gz QEUHVRFBZXCREN-KRWDZBQOSA-N 1 0 296.414 3.991 20 10 CHCDRO CC[C@@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1cccc(Cl)c1[O-] ZINC000817979770 1131194872 /nfs/dbraw/zinc/19/48/72/1131194872.db2.gz FCBOZYKVWGTIJU-IUODEOHRSA-N 1 0 296.842 3.619 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc(C)cc(N)c1)c1ccc(N(C)C)cc1 ZINC000817982070 1131195546 /nfs/dbraw/zinc/19/55/46/1131195546.db2.gz XBCWZKPSIQIJQZ-LJQANCHMSA-N 1 0 297.446 3.884 20 10 CHCDRO Oc1ccc(-c2ccccc2)cc1C[NH2+][C@H]1CC12CC2 ZINC000818229966 1131205327 /nfs/dbraw/zinc/20/53/27/1131205327.db2.gz JYCQNRGNXKAGHS-KRWDZBQOSA-N 1 0 265.356 3.701 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@@H]1C[C@H](C)O[C@H]1C ZINC001118005823 1131208205 /nfs/dbraw/zinc/20/82/05/1131208205.db2.gz CRVDQFJJBISXOI-QTVXIADOSA-N 1 0 289.419 3.652 20 10 CHCDRO Cc1cc(Br)cc([C@@H](C)[NH2+][C@@H]2CC23CC3)c1O ZINC000818355367 1131210435 /nfs/dbraw/zinc/21/04/35/1131210435.db2.gz DORZBRTWZYHRAG-BXKDBHETSA-N 1 0 296.208 3.666 20 10 CHCDRO COCC1(CC[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)CC1 ZINC001118238515 1131215926 /nfs/dbraw/zinc/21/59/26/1131215926.db2.gz JPSQWNMPYJOZLL-UONOGXRCSA-N 1 0 289.419 3.655 20 10 CHCDRO CO[C@@H]1CCC[N@H+](Cc2cc(C)n(-c3ccccc3)c2C)C1 ZINC001137854015 1131424202 /nfs/dbraw/zinc/42/42/02/1131424202.db2.gz DZHWAWLRBDAIAV-LJQANCHMSA-N 1 0 298.430 3.705 20 10 CHCDRO Cc1cc(C[N@@H+](C)[C@@H]2CCCOC2)c(C)n1-c1ccccc1 ZINC001137859327 1131425402 /nfs/dbraw/zinc/42/54/02/1131425402.db2.gz TYRPVCASDHOTAN-LJQANCHMSA-N 1 0 298.430 3.705 20 10 CHCDRO CCCC[N@H+](Cc1ccccc1O)Cc1ccncc1F ZINC000824345318 1131465024 /nfs/dbraw/zinc/46/50/24/1131465024.db2.gz ZCZDAIVVDSYKLM-UHFFFAOYSA-N 1 0 288.366 3.729 20 10 CHCDRO COC1(C[NH2+]Cc2ccc3ccccc3c2O)CCCC1 ZINC000824445594 1131469470 /nfs/dbraw/zinc/46/94/70/1131469470.db2.gz GOBSNAPRSZZLAG-UHFFFAOYSA-N 1 0 285.387 3.594 20 10 CHCDRO C[C@H]1CC[C@H]([N@H+](C)Cc2cccc(F)c2[O-])CC1 ZINC001138131413 1131470357 /nfs/dbraw/zinc/47/03/57/1131470357.db2.gz ZJHDBJQLEIBRIE-AULYBMBSSA-N 1 0 251.345 3.542 20 10 CHCDRO Fc1cccc2c1CCC[C@H]2[NH2+]Cc1ccc2c(c1)CCO2 ZINC000824468198 1131471708 /nfs/dbraw/zinc/47/17/08/1131471708.db2.gz FZEWRULTVASGJR-GOSISDBHSA-N 1 0 297.373 3.928 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H](C)c2ccc(F)c(C)c2)c1 ZINC000824548377 1131475218 /nfs/dbraw/zinc/47/52/18/1131475218.db2.gz HGMROZYRYNDUJV-CYBMUJFWSA-N 1 0 273.351 3.999 20 10 CHCDRO Cc1c(C[N@H+]2C[C@H]3[C@H](CC3(F)F)C2)c2ccccc2n1C ZINC001138254484 1131483095 /nfs/dbraw/zinc/48/30/95/1131483095.db2.gz YXNOXJBLUFEZTQ-DOMZBBRYSA-N 1 0 290.357 3.574 20 10 CHCDRO Cc1c(C[N@H+](CC2CC2)C2CC2)c2ccccc2n1C ZINC001138259499 1131483259 /nfs/dbraw/zinc/48/32/59/1131483259.db2.gz IOHULNVKHMHGSE-UHFFFAOYSA-N 1 0 268.404 3.861 20 10 CHCDRO CSC1CC[NH+](Cc2c(C)n(C)c3ccccc32)CC1 ZINC001138256753 1131483596 /nfs/dbraw/zinc/48/35/96/1131483596.db2.gz JIDVUOHDTDGVRZ-UHFFFAOYSA-N 1 0 288.460 3.814 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCO[C@@H](C(C)C)C1)c1ccccc1O ZINC000824798827 1131484730 /nfs/dbraw/zinc/48/47/30/1131484730.db2.gz GRYVLRAUADSDTG-UWWQBHOKSA-N 1 0 291.435 3.884 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@H]2CCCC2(F)F)cc1C ZINC000824800192 1131484899 /nfs/dbraw/zinc/48/48/99/1131484899.db2.gz UZGZBUDTFYHSKM-CYBMUJFWSA-N 1 0 269.335 3.534 20 10 CHCDRO CN1CCCc2cc(C[N@H+](C)Cc3ccc(F)cc3)ccc21 ZINC001138354485 1131494030 /nfs/dbraw/zinc/49/40/30/1131494030.db2.gz LJSNFKNAGVKPMN-UHFFFAOYSA-N 1 0 298.405 3.840 20 10 CHCDRO CN1CCCc2cc(C[NH+]3C[C@@H]4CCCC[C@H]4C3)ccc21 ZINC001138354687 1131494266 /nfs/dbraw/zinc/49/42/66/1131494266.db2.gz PTVKESFNLJYYMK-ROUUACIJSA-N 1 0 284.447 3.691 20 10 CHCDRO C[C@@H](CN1CCCCC1)[NH2+]Cc1ccc2ccccc2c1O ZINC000825101953 1131495610 /nfs/dbraw/zinc/49/56/10/1131495610.db2.gz IRNGJUWHCQWAGY-HNNXBMFYSA-N 1 0 298.430 3.509 20 10 CHCDRO CC[C@@H](C)[N@H+](C)Cc1ccc(N(CC)CC)cc1OC ZINC001138386515 1131497243 /nfs/dbraw/zinc/49/72/43/1131497243.db2.gz PGXPDUWBWSKLGH-CQSZACIVSA-N 1 0 278.440 3.772 20 10 CHCDRO Oc1c(C[N@@H+]2CCC[C@@]3(CCOC3)C2)ccc2ccccc21 ZINC000825134154 1131499945 /nfs/dbraw/zinc/49/99/45/1131499945.db2.gz WCNPWICGVMIWIQ-LJQANCHMSA-N 1 0 297.398 3.548 20 10 CHCDRO CC[C@@H]([NH2+]C1CCC(OC(F)F)CC1)c1ccccc1O ZINC000825143596 1131500021 /nfs/dbraw/zinc/50/00/21/1131500021.db2.gz GXYYGOFFVYACMG-ORHYLEIMSA-N 1 0 299.361 3.983 20 10 CHCDRO Cc1nc(C)c(C[NH2+]Cc2cc(Cl)c(C)cc2O)s1 ZINC000825316482 1131506746 /nfs/dbraw/zinc/50/67/46/1131506746.db2.gz VDOICYXRKLUURL-UHFFFAOYSA-N 1 0 296.823 3.717 20 10 CHCDRO C[N@H+](Cc1ccccc1O)Cc1ccc(F)c(Cl)c1F ZINC001143627158 1131519596 /nfs/dbraw/zinc/51/95/96/1131519596.db2.gz DHXUDASZHAZGLG-UHFFFAOYSA-N 1 0 297.732 3.956 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)Cc2ccc(N(C)C)cc2C)o1 ZINC001202860746 1131545326 /nfs/dbraw/zinc/54/53/26/1131545326.db2.gz SVFSBRMUNJRIFO-CQSZACIVSA-N 1 0 286.419 3.683 20 10 CHCDRO Cc1cc(C[N@H+]2CCCCC[C@H]2C)ccc1N(C)C ZINC001139672452 1131626989 /nfs/dbraw/zinc/62/69/89/1131626989.db2.gz XLVFBEDBGUXFIR-OAHLLOKOSA-N 1 0 260.425 3.826 20 10 CHCDRO Cc1cc(C[N@H+](C)CC2CCCC2)ccc1N(C)C ZINC001139672836 1131628042 /nfs/dbraw/zinc/62/80/42/1131628042.db2.gz IKJRCGKXYSLBQE-UHFFFAOYSA-N 1 0 260.425 3.683 20 10 CHCDRO Cc1cc(C[N@@H+]2CCC[C@@H](C(F)F)C2)ccc1N(C)C ZINC001139672808 1131628058 /nfs/dbraw/zinc/62/80/58/1131628058.db2.gz GOMQVGZXWQQPEI-CQSZACIVSA-N 1 0 282.378 3.538 20 10 CHCDRO Cc1cccc(CC[N@@H+](C)Cc2cc(F)ccc2O)c1 ZINC001140055201 1131660251 /nfs/dbraw/zinc/66/02/51/1131660251.db2.gz NQFXTIBGPRECKI-UHFFFAOYSA-N 1 0 273.351 3.514 20 10 CHCDRO CCC[N@@H+](Cc1c(O)cccc1Br)CC1CC1 ZINC001140098796 1131664569 /nfs/dbraw/zinc/66/45/69/1131664569.db2.gz LLPIYFUDWIUMES-UHFFFAOYSA-N 1 0 298.224 3.777 20 10 CHCDRO CC(C)n1cc([C@@H](C)[NH2+][C@H]2CCc3cccc(O)c32)cn1 ZINC000834581913 1131685072 /nfs/dbraw/zinc/68/50/72/1131685072.db2.gz QYKSPHGAFFMKNU-DOMZBBRYSA-N 1 0 285.391 3.508 20 10 CHCDRO C[C@@H]1Cc2ccccc2[C@@H]1[NH2+][C@H]1CCc2cccc(O)c21 ZINC000834645506 1131690260 /nfs/dbraw/zinc/69/02/60/1131690260.db2.gz FTRHKNCZKVAFKU-RNRVQEDPSA-N 1 0 279.383 3.903 20 10 CHCDRO CCC1(C[NH2+][C@@H](C)c2cccc(OC)c2O)CCC1 ZINC000846150880 1131691305 /nfs/dbraw/zinc/69/13/05/1131691305.db2.gz SFWQLVOKVWSKCD-LBPRGKRZSA-N 1 0 263.381 3.632 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CCc2ccc(C)cc2C)c1O ZINC000846148115 1131691441 /nfs/dbraw/zinc/69/14/41/1131691441.db2.gz ZPLAIDAXFXNGHW-OAHLLOKOSA-N 1 0 299.414 3.911 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CCc2c(C)cccc2C)c1O ZINC000846152709 1131691880 /nfs/dbraw/zinc/69/18/80/1131691880.db2.gz CQHYPZNRJPXOCV-HNNXBMFYSA-N 1 0 299.414 3.911 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@@H]2CCCC(F)(F)C2)c1O ZINC000846157002 1131691963 /nfs/dbraw/zinc/69/19/63/1131691963.db2.gz RISDDHMSSRJNIS-GHMZBOCLSA-N 1 0 285.334 3.629 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H]2CC3CCC2CC3)c1O ZINC000846160089 1131692375 /nfs/dbraw/zinc/69/23/75/1131692375.db2.gz MROUAVXCCRWZJT-CLTVBZQCSA-N 1 0 275.392 3.630 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H]2C[C@@H]2Cc2ccccc2)c1O ZINC000846155978 1131692430 /nfs/dbraw/zinc/69/24/30/1131692430.db2.gz RIUVCNGIYRAMAI-QRTARXTBSA-N 1 0 297.398 3.683 20 10 CHCDRO COc1cccc([C@@H](C)Nc2cc(C3CC3)ccn2)c1O ZINC000846168375 1131693110 /nfs/dbraw/zinc/69/31/10/1131693110.db2.gz AJPAMCSOMHOTNS-LLVKDONJSA-N 1 0 284.359 3.846 20 10 CHCDRO CC(C)(C[NH2+][C@@H]1CCc2cccc(O)c21)[C@H]1CCCCO1 ZINC000834680625 1131693403 /nfs/dbraw/zinc/69/34/03/1131693403.db2.gz CYDLMTYWJCUSEO-GDBMZVCRSA-N 1 0 289.419 3.564 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@@H](c1cccnc1)C1CC1)CC2 ZINC000834693476 1131694543 /nfs/dbraw/zinc/69/45/43/1131694543.db2.gz OWSOUMZZFFBLED-CRAIPNDOSA-N 1 0 280.371 3.515 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H](C)Cc2ccsc2)c1O ZINC000846143129 1131694773 /nfs/dbraw/zinc/69/47/73/1131694773.db2.gz HWQQTFXHSFEITH-NEPJUHHUSA-N 1 0 291.416 3.744 20 10 CHCDRO CCC(CC)(C[NH2+][C@H](C)c1cccc(OC)c1O)SC ZINC000846143093 1131694905 /nfs/dbraw/zinc/69/49/05/1131694905.db2.gz APROTUHMBKTMPH-GFCCVEGCSA-N 1 0 297.464 3.973 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H]2CCCC[C@H]2SC)c1O ZINC000846178528 1131696943 /nfs/dbraw/zinc/69/69/43/1131696943.db2.gz DEYATYKUEVAQFS-NJZAAPMLSA-N 1 0 295.448 3.726 20 10 CHCDRO Cc1cccc(C[N@@H+](C)Cc2c(O)cccc2Cl)c1 ZINC001140337972 1131702120 /nfs/dbraw/zinc/70/21/20/1131702120.db2.gz PGLCHZWRQAKJSX-UHFFFAOYSA-N 1 0 275.779 3.986 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CC[C@@H]2CCC[C@@H]2C1 ZINC001140339494 1131702585 /nfs/dbraw/zinc/70/25/85/1131702585.db2.gz VNMPEGHADDFPAQ-NWDGAFQWSA-N 1 0 265.784 3.668 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CC[C@@H](c2ccccc2)O1)c1ccccc1O ZINC000846210217 1131702841 /nfs/dbraw/zinc/70/28/41/1131702841.db2.gz LQAOJSDYFQZANJ-QOKNQOGYSA-N 1 0 297.398 3.963 20 10 CHCDRO CC(C)O[C@@H]1C[C@H]([NH2+][C@H]2CCc3cccc(O)c32)C1(C)C ZINC000834766239 1131703626 /nfs/dbraw/zinc/70/36/26/1131703626.db2.gz RLDPWWKMHGJSLX-CWRNSKLLSA-N 1 0 289.419 3.561 20 10 CHCDRO COC1(C[NH2+][C@H]2CCc3cccc(O)c32)CCC(C)CC1 ZINC000834790659 1131705040 /nfs/dbraw/zinc/70/50/40/1131705040.db2.gz UIQZCMGSJHPIMH-DBQDNQAGSA-N 1 0 289.419 3.564 20 10 CHCDRO C[C@@H]1C[C@@H](CC[NH2+][C@@H]2CCc3cccc(O)c32)C[C@H](C)O1 ZINC000834794118 1131706751 /nfs/dbraw/zinc/70/67/51/1131706751.db2.gz ORLFOERHPUEFIF-HLPPOEQASA-N 1 0 289.419 3.563 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccnc(C)c1)c1ccc(C)cc1O ZINC000834860419 1131713227 /nfs/dbraw/zinc/71/32/27/1131713227.db2.gz RJZIFDWOKCBYDA-INIZCTEOSA-N 1 0 270.376 3.645 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCOC3(CCC3)C2)c(O)c1 ZINC000834882427 1131716622 /nfs/dbraw/zinc/71/66/22/1131716622.db2.gz JVXMDQORWLRIAK-GJZGRUSLSA-N 1 0 289.419 3.701 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCOC3(CCC3)C2)c1 ZINC000834882654 1131716856 /nfs/dbraw/zinc/71/68/56/1131716856.db2.gz NJEFFEIJSDWJFF-LSDHHAIUSA-N 1 0 289.419 3.701 20 10 CHCDRO CO[C@@](C)(C[NH2+][C@H](C)c1ccc(C)cc1O)c1ccccc1 ZINC000834885012 1131718632 /nfs/dbraw/zinc/71/86/32/1131718632.db2.gz RTOFEVAQZBBSCR-BEFAXECRSA-N 1 0 299.414 3.913 20 10 CHCDRO CCn1ccnc1[C@@H](C)[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000834897005 1131721387 /nfs/dbraw/zinc/72/13/87/1131721387.db2.gz XXCHQMAKUXEDRX-UONOGXRCSA-N 1 0 287.407 3.637 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1nccn1CC)c1ccc(C)cc1O ZINC000834897181 1131721496 /nfs/dbraw/zinc/72/14/96/1131721496.db2.gz YLMHBZVYPRBFCT-HIFRSBDPSA-N 1 0 287.407 3.719 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H]2C[C@@H](C)n3ccnc32)cc1 ZINC000834896819 1131721652 /nfs/dbraw/zinc/72/16/52/1131721652.db2.gz OBQLUQQGZLRMIB-KEYYUXOJSA-N 1 0 298.434 3.696 20 10 CHCDRO CCc1ncc(C[NH2+][C@H](CC)c2cc(Cl)ccc2O)o1 ZINC000834898430 1131722153 /nfs/dbraw/zinc/72/21/53/1131722153.db2.gz CXOLHZFSHBXYFG-CYBMUJFWSA-N 1 0 294.782 3.837 20 10 CHCDRO CCCc1ncc(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)o1 ZINC000834901232 1131725828 /nfs/dbraw/zinc/72/58/28/1131725828.db2.gz YYCLYSBPTRMOSM-CYBMUJFWSA-N 1 0 288.391 3.800 20 10 CHCDRO CO[C@@H]([C@H](C)[NH2+][C@@H](C)c1cc(Cl)ccc1O)C1CC1 ZINC000834905368 1131728336 /nfs/dbraw/zinc/72/83/36/1131728336.db2.gz UDZGSNVBTNRHEK-YHAQOWFVSA-N 1 0 283.799 3.510 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+]CCC[C@@H]2CCOC2)c1O ZINC000834906620 1131728689 /nfs/dbraw/zinc/72/86/89/1131728689.db2.gz YOVRQTABWLWIMD-QWHCGFSZSA-N 1 0 297.826 3.821 20 10 CHCDRO Cc1ccc(CC[NH2+][C@@H](C)c2cc(Cl)ccc2O)nc1 ZINC000834908402 1131730664 /nfs/dbraw/zinc/73/06/64/1131730664.db2.gz DPLNFPPPFUEBDC-LBPRGKRZSA-N 1 0 290.794 3.642 20 10 CHCDRO C[C@]1(F)CCCC[N@H+](Cc2ccc(Cl)cc2O)C1 ZINC001140462210 1131749142 /nfs/dbraw/zinc/74/91/42/1131749142.db2.gz AKXOKRYHFAVDSN-AWEZNQCLSA-N 1 0 271.763 3.760 20 10 CHCDRO C[N@H+](Cc1cccs1)Cc1ccc(Cl)cc1O ZINC001140467596 1131752863 /nfs/dbraw/zinc/75/28/63/1131752863.db2.gz YXQHHJZJCMFYEI-UHFFFAOYSA-N 1 0 267.781 3.739 20 10 CHCDRO CN(C)c1ccc(/C=C\C[N@H+](C)Cc2cccc(O)c2)cc1 ZINC000835025409 1131759617 /nfs/dbraw/zinc/75/96/17/1131759617.db2.gz STVNISYSFTUFPA-ALCCZGGFSA-N 1 0 296.414 3.603 20 10 CHCDRO CN(C)c1ccc(/C=C\C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)cc1 ZINC000835025436 1131759934 /nfs/dbraw/zinc/75/99/34/1131759934.db2.gz VJSMIJQBRIRMEH-GJEJWFRCSA-N 1 0 295.430 3.931 20 10 CHCDRO C[C@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)C1(C)CC1 ZINC000835037255 1131760634 /nfs/dbraw/zinc/76/06/34/1131760634.db2.gz PGKVVWHNWCTQFK-GXMNPTEKSA-N 1 0 258.409 3.544 20 10 CHCDRO CS[C@@H]1CC[C@H]([NH2+]C/C=C/c2ccc(N(C)C)cc2)C1 ZINC000835044264 1131763675 /nfs/dbraw/zinc/76/36/75/1131763675.db2.gz YPUWRFKVWAIYPL-PQAMPZAHSA-N 1 0 290.476 3.640 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]C[C@@H]2CCCCS2)cc1 ZINC000835048290 1131765250 /nfs/dbraw/zinc/76/52/50/1131765250.db2.gz PRJSCGTUBCTHTN-RTRPANQVSA-N 1 0 290.476 3.641 20 10 CHCDRO CC[C@H]([NH2+]CCOCCC(C)C)c1ccc(C)cc1O ZINC000794805287 1131767003 /nfs/dbraw/zinc/76/70/03/1131767003.db2.gz PVTDUPZRSWELEA-INIZCTEOSA-N 1 0 279.424 3.804 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCC[C@H]2c2ccc(C)nc2)c1 ZINC001140623619 1131833528 /nfs/dbraw/zinc/83/35/28/1131833528.db2.gz YHSZRMVDAUNEJD-KRWDZBQOSA-N 1 0 282.387 3.741 20 10 CHCDRO Cc1c(O)ccc(C[N@@H+]2CCCC[C@H]2c2cccnc2)c1O ZINC001140746034 1131904964 /nfs/dbraw/zinc/90/49/64/1131904964.db2.gz SWWWCDVEVKFUFJ-INIZCTEOSA-N 1 0 298.386 3.528 20 10 CHCDRO Cc1c(O)ccc(C[N@@H+]2CCCC3(CCCC3)C2)c1O ZINC001140744287 1131905704 /nfs/dbraw/zinc/90/57/04/1131905704.db2.gz RZUYWXQOICMAEZ-UHFFFAOYSA-N 1 0 275.392 3.562 20 10 CHCDRO CC[C@H](c1ccccc1)[N@H+](C)Cc1ccc(O)c(C)c1O ZINC001140749273 1131906255 /nfs/dbraw/zinc/90/62/55/1131906255.db2.gz UXENTHMSJJROIZ-MRXNPFEDSA-N 1 0 285.387 3.989 20 10 CHCDRO Cc1c(O)ccc(CN2Cc3ccc(Cl)cc3C2)c1O ZINC001140748357 1131906359 /nfs/dbraw/zinc/90/63/59/1131906359.db2.gz XCEOIQXHGNZIKU-UHFFFAOYSA-N 1 0 289.762 3.575 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H]2CC=CCC2)cc1 ZINC000772999047 1131910181 /nfs/dbraw/zinc/91/01/81/1131910181.db2.gz HVSIBKLBLDUEKK-HOCLYGCPSA-N 1 0 258.409 3.902 20 10 CHCDRO CC[C@@H]([NH2+]CC(CC)(CC)CO)c1ccc(N(C)C)cc1 ZINC000773102538 1131945602 /nfs/dbraw/zinc/94/56/02/1131945602.db2.gz ODUWDFJYROCJBV-QGZVFWFLSA-N 1 0 292.467 3.592 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](CC2CC2)C(C)C)c(O)c1 ZINC001140855192 1131947694 /nfs/dbraw/zinc/94/76/94/1131947694.db2.gz QUFWOXLBQCDNLM-UHFFFAOYSA-N 1 0 290.451 3.859 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCCCC23CC3)c(O)c1 ZINC001140855504 1131949068 /nfs/dbraw/zinc/94/90/68/1131949068.db2.gz BTVBTLHGTWMEBM-UHFFFAOYSA-N 1 0 288.435 3.757 20 10 CHCDRO Oc1ccccc1C[NH2+]C[C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000712975640 1131960041 /nfs/dbraw/zinc/96/00/41/1131960041.db2.gz WIUOUKNTUFDRDB-YPMHNXCESA-N 1 0 287.325 3.851 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC[C@H](CF)C2)c(Cl)c1 ZINC001140926003 1131966056 /nfs/dbraw/zinc/96/60/56/1131966056.db2.gz XAWFYASJTIOTCT-GFCCVEGCSA-N 1 0 284.806 3.588 20 10 CHCDRO Cc1ccc(C[N@H+](C)C/C=C/c2ccccc2)c(O)c1 ZINC001140958313 1131973696 /nfs/dbraw/zinc/97/36/96/1131973696.db2.gz XOUFLZIUATVNMK-RMKNXTFCSA-N 1 0 267.372 3.846 20 10 CHCDRO CC(C)C1CC([NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC000714736107 1131976128 /nfs/dbraw/zinc/97/61/28/1131976128.db2.gz MVBFMWYOVOTNOQ-UHFFFAOYSA-N 1 0 272.436 3.811 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)Cc1ccco1)c1ccccc1O ZINC000036993590 1131985644 /nfs/dbraw/zinc/98/56/44/1131985644.db2.gz WUNCNCKKLKQFEO-IUODEOHRSA-N 1 0 259.349 3.657 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1ccns1 ZINC000715897689 1131994460 /nfs/dbraw/zinc/99/44/60/1131994460.db2.gz DAFCMDSWWVZZIF-NWDGAFQWSA-N 1 0 275.421 3.621 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2ccns2)c1 ZINC000715964023 1132000229 /nfs/dbraw/zinc/00/02/29/1132000229.db2.gz CLEYIIDOCHDEFG-GHMZBOCLSA-N 1 0 262.378 3.569 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccns1 ZINC000716023447 1132001655 /nfs/dbraw/zinc/00/16/55/1132001655.db2.gz WYEHCEGGPHLUKT-ZDUSSCGKSA-N 1 0 287.432 3.594 20 10 CHCDRO C[C@H]1CCCC[N@@H+]1Cc1cc2c3c(c1)CCCN3CCC2 ZINC001141074555 1132005552 /nfs/dbraw/zinc/00/55/52/1132005552.db2.gz LYOFXBJYXKNNHU-HNNXBMFYSA-N 1 0 284.447 3.760 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CC2CCCC2)cc1 ZINC000037252142 1132023028 /nfs/dbraw/zinc/02/30/28/1132023028.db2.gz RUKYLXHXDBDYGM-UHFFFAOYSA-N 1 0 260.425 3.813 20 10 CHCDRO Oc1ccc(O)c(C[N@@H+]2CCC[C@H]2C2CCCCC2)c1 ZINC001141160943 1132030952 /nfs/dbraw/zinc/03/09/52/1132030952.db2.gz KIYZGSMCBVSFSZ-INIZCTEOSA-N 1 0 275.392 3.643 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)Cc1cccc(OC)c1F ZINC001141222466 1132047357 /nfs/dbraw/zinc/04/73/57/1132047357.db2.gz CMBBOZKXCDZSCE-UHFFFAOYSA-N 1 0 289.350 3.562 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CCC[C@@H](OC(C)C)C2)cc1 ZINC001171741103 1132098587 /nfs/dbraw/zinc/09/85/87/1132098587.db2.gz LPUPDBVVOKNQJZ-GOSISDBHSA-N 1 0 290.451 3.532 20 10 CHCDRO CO[C@H]1CC[N@H+](Cc2cc(Cl)c(C(C)(C)C)cc2O)C1 ZINC001248880808 1132151212 /nfs/dbraw/zinc/15/12/12/1132151212.db2.gz NLKYEAKSFSEJGL-LBPRGKRZSA-N 1 0 297.826 3.564 20 10 CHCDRO CC[C@H](C)OCC[C@@H](C)[NH2+][C@@H](C)c1ccccc1O ZINC001172328847 1132172889 /nfs/dbraw/zinc/17/28/89/1132172889.db2.gz QFMXGXDHTJRTLG-RDBSUJKOSA-N 1 0 265.397 3.637 20 10 CHCDRO C[C@H]([NH2+]CC[C@@H](O)c1ccccc1)c1ccc(N(C)C)cc1 ZINC000839563850 1132223416 /nfs/dbraw/zinc/22/34/16/1132223416.db2.gz PEBVMBGJJWIHPA-HNAYVOBHSA-N 1 0 298.430 3.527 20 10 CHCDRO CC(C)COCC[C@@H](C)[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001172483189 1132228894 /nfs/dbraw/zinc/22/88/94/1132228894.db2.gz JGHRBOBUSASWOC-MRXNPFEDSA-N 1 0 292.467 3.636 20 10 CHCDRO Oc1cccc(C[NH2+][C@@H]2CCC[C@@H](c3ccccc3)C2)c1O ZINC001172541156 1132277753 /nfs/dbraw/zinc/27/77/53/1132277753.db2.gz UJMGORGLAIDEMT-NVXWUHKLSA-N 1 0 297.398 3.914 20 10 CHCDRO Oc1ccc(C[NH2+][C@@H]2CCC[C@@H](c3ccccc3)C2)c(O)c1 ZINC001172544427 1132278893 /nfs/dbraw/zinc/27/88/93/1132278893.db2.gz YSXKREUYIIRKHO-NVXWUHKLSA-N 1 0 297.398 3.914 20 10 CHCDRO Cc1ncc(C[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)o1 ZINC000840796929 1132288845 /nfs/dbraw/zinc/28/88/45/1132288845.db2.gz PEPPMDQHODSJDO-CQSZACIVSA-N 1 0 299.418 3.824 20 10 CHCDRO CC[C@@H]1OCC[C@H]1[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O ZINC000840821579 1132290006 /nfs/dbraw/zinc/29/00/06/1132290006.db2.gz OGWVFPQEUJQLMT-GDLCADMTSA-N 1 0 283.799 3.572 20 10 CHCDRO CO[C@@](C)([C@@H](C)[NH2+][C@H](C)c1ccc(C)c(C)c1O)C1CC1 ZINC000840860575 1132295949 /nfs/dbraw/zinc/29/59/49/1132295949.db2.gz OHBRPUUEMLWHQU-LBTNJELSSA-N 1 0 291.435 3.863 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1C[C@@H](C)O[C@@H]1C)c1ccc(C)cc1O ZINC000840872308 1132298635 /nfs/dbraw/zinc/29/86/35/1132298635.db2.gz KHQXXYSVLPZEMF-NYTXWWLZSA-N 1 0 277.408 3.555 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1C[C@@H](C)O[C@H]1C)c1cc(Cl)ccc1O ZINC000840871916 1132298973 /nfs/dbraw/zinc/29/89/73/1132298973.db2.gz ICDBPFDSTWLQQD-NOOOWODRSA-N 1 0 283.799 3.510 20 10 CHCDRO C[C@@H]([NH2+]CC(C)(C)OCC1CC1)c1cc(Cl)ccc1O ZINC000840876486 1132299000 /nfs/dbraw/zinc/29/90/00/1132299000.db2.gz NDUQEKMGANCWPD-LLVKDONJSA-N 1 0 297.826 3.901 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1C[C@H](C)O[C@H]1C)c1cc(Cl)ccc1O ZINC000840873077 1132299074 /nfs/dbraw/zinc/29/90/74/1132299074.db2.gz QQEMLXISZUKMSK-ASHKBJFXSA-N 1 0 297.826 3.900 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC(C)(C)OCC2CC2)c(O)c1 ZINC000840876409 1132299137 /nfs/dbraw/zinc/29/91/37/1132299137.db2.gz MIYBBPHXABEKJZ-ZDUSSCGKSA-N 1 0 277.408 3.556 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+][C@@H]2CCCC[C@H]2F)c(O)c1 ZINC000840876344 1132300247 /nfs/dbraw/zinc/30/02/47/1132300247.db2.gz PAOFBKRAELMJMV-MGPQQGTHSA-N 1 0 265.372 3.940 20 10 CHCDRO COC1([C@@H](C)[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)CCC1 ZINC000840883497 1132303002 /nfs/dbraw/zinc/30/30/02/1132303002.db2.gz DIZCIWZZYRJFPR-VXGBXAGGSA-N 1 0 297.826 3.962 20 10 CHCDRO COC1([C@H](C)[NH2+][C@@H](C)c2ccc(C)c(C)c2O)CCC1 ZINC000840884661 1132303087 /nfs/dbraw/zinc/30/30/87/1132303087.db2.gz ONEABDYFJSHKQR-KBPBESRZSA-N 1 0 277.408 3.617 20 10 CHCDRO CSCCCC[NH2+]Cc1c(O)cc(C)cc1Cl ZINC000840899448 1132306070 /nfs/dbraw/zinc/30/60/70/1132306070.db2.gz MWQLCYHEQMQLHX-UHFFFAOYSA-N 1 0 273.829 3.587 20 10 CHCDRO Cc1occc1C[N@@H+](C)Cc1ccc(N(C)C)cc1C ZINC000840911984 1132307701 /nfs/dbraw/zinc/30/77/01/1132307701.db2.gz WQAZUSVIKZJCLE-UHFFFAOYSA-N 1 0 272.392 3.594 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]C1(c2cccc(F)c2)CC1 ZINC000840933642 1132309582 /nfs/dbraw/zinc/30/95/82/1132309582.db2.gz IVAAHNGPXDMJGN-UHFFFAOYSA-N 1 0 298.405 3.979 20 10 CHCDRO Cc1cscc1C[NH2+]Cc1ccc(N(C)C)cc1C ZINC000840940553 1132310785 /nfs/dbraw/zinc/31/07/85/1132310785.db2.gz FVCGDHIMAPNWJT-UHFFFAOYSA-N 1 0 274.433 3.721 20 10 CHCDRO CC[N@H+](Cc1ccncc1)Cc1c(O)cc(C)cc1Cl ZINC000840946888 1132311969 /nfs/dbraw/zinc/31/19/69/1132311969.db2.gz XGLQBRGLMKBINP-UHFFFAOYSA-N 1 0 290.794 3.771 20 10 CHCDRO CO[C@H]1CC[N@H+](Cc2c(O)cc(C)cc2Cl)CC1(C)C ZINC000840950728 1132312115 /nfs/dbraw/zinc/31/21/15/1132312115.db2.gz NKXNNASLUYCHRH-HNNXBMFYSA-N 1 0 297.826 3.601 20 10 CHCDRO CSC[C@@H]1CCC[N@H+](Cc2ccc(N(C)C)cc2C)C1 ZINC000840950630 1132312323 /nfs/dbraw/zinc/31/23/23/1132312323.db2.gz PPSUIORROIFJJA-OAHLLOKOSA-N 1 0 292.492 3.636 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CCSC(C)C)c(Cl)c1 ZINC000840946569 1132312532 /nfs/dbraw/zinc/31/25/32/1132312532.db2.gz RRYLOKQHVJLDEW-UHFFFAOYSA-N 1 0 273.829 3.585 20 10 CHCDRO C[C@H]1CC[N@H+](Cc2c(O)ccc3ccccc32)CC[C@@]1(C)O ZINC001231587454 1132317456 /nfs/dbraw/zinc/31/74/56/1132317456.db2.gz CLLFOENVRJMTDX-IFXJQAMLSA-N 1 0 299.414 3.528 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CCCC[C@H](F)C1 ZINC001231588824 1132317898 /nfs/dbraw/zinc/31/78/98/1132317898.db2.gz VSBKONZPPDHTOC-AWEZNQCLSA-N 1 0 273.351 3.869 20 10 CHCDRO CC[N@H+](Cc1c(O)ccc2ccccc21)C1CCOCC1 ZINC001231590163 1132318230 /nfs/dbraw/zinc/31/82/30/1132318230.db2.gz NXJXQBQGXXZAKP-UHFFFAOYSA-N 1 0 285.387 3.546 20 10 CHCDRO C[N@H+](Cc1cncs1)Cc1c(O)ccc2ccccc21 ZINC001231589006 1132318340 /nfs/dbraw/zinc/31/83/40/1132318340.db2.gz AHMZVKJQRBKIEI-UHFFFAOYSA-N 1 0 284.384 3.634 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CC[C@]2(C1)CCCCO2 ZINC001231586362 1132319251 /nfs/dbraw/zinc/31/92/51/1132319251.db2.gz FWOLVBZJZHIFIH-IBGZPJMESA-N 1 0 297.398 3.690 20 10 CHCDRO CC1(C)C[N@H+](Cc2c(O)ccc3ccccc32)[C@@](C)(CO)C1 ZINC001231587620 1132319401 /nfs/dbraw/zinc/31/94/01/1132319401.db2.gz WSCZROIFCKLRNX-LJQANCHMSA-N 1 0 299.414 3.528 20 10 CHCDRO C[C@@H](CCCC(F)(F)F)[NH2+]CCc1ccc(N)cc1 ZINC000841033788 1132321283 /nfs/dbraw/zinc/32/12/83/1132321283.db2.gz BEFCTLUDFJDWBH-NSHDSACASA-N 1 0 274.330 3.522 20 10 CHCDRO CC[C@@H](Cc1ccc(C)cc1)[NH2+]CCc1ccc(N)cc1 ZINC000841033821 1132321292 /nfs/dbraw/zinc/32/12/92/1132321292.db2.gz BSTKEAIGXHOCFO-IBGZPJMESA-N 1 0 282.431 3.731 20 10 CHCDRO Nc1ccc(CC[NH2+][C@H]2CCC[C@@H]2c2ccccc2)cc1 ZINC000841034068 1132321360 /nfs/dbraw/zinc/32/13/60/1132321360.db2.gz GEQDQDVKPBXLNI-MOPGFXCFSA-N 1 0 280.415 3.737 20 10 CHCDRO Nc1ccc(CC[NH2+][C@H]2CCC[C@@H]2c2ccc(F)cc2)cc1 ZINC000841034604 1132321773 /nfs/dbraw/zinc/32/17/73/1132321773.db2.gz IDWTWYRUZOZVPX-MOPGFXCFSA-N 1 0 298.405 3.876 20 10 CHCDRO CCC[C@H](C[NH2+]CCc1ccc(N)cc1)c1ccccc1 ZINC000841036512 1132322570 /nfs/dbraw/zinc/32/25/70/1132322570.db2.gz UBLBBYODXUBZHU-GOSISDBHSA-N 1 0 282.431 3.985 20 10 CHCDRO Nc1ccc(CC[NH2+][C@H]2CCC[C@@H](C(F)(F)F)C2)cc1 ZINC000841038035 1132323547 /nfs/dbraw/zinc/32/35/47/1132323547.db2.gz GANKSUVCWDPLMZ-OCCSQVGLSA-N 1 0 286.341 3.522 20 10 CHCDRO CC[NH2+]Cc1ccccc1NCc1cc(C)c(C)cc1O ZINC000841044250 1132323864 /nfs/dbraw/zinc/32/38/64/1132323864.db2.gz YBYLHKLVEYJDJY-UHFFFAOYSA-N 1 0 284.403 3.731 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H]2CCCc3cc(N)ccc32)cc1C ZINC000841057327 1132324291 /nfs/dbraw/zinc/32/42/91/1132324291.db2.gz GCGDKCIIYAWVMV-SFHVURJKSA-N 1 0 296.414 3.758 20 10 CHCDRO Cc1ccc2c(c1)C[C@H]([NH2+]Cc1c(C)cc(C)cc1O)CC2 ZINC001172832203 1132324544 /nfs/dbraw/zinc/32/45/44/1132324544.db2.gz REDUAPHVJXPSBF-GOSISDBHSA-N 1 0 295.426 3.965 20 10 CHCDRO C[NH2+]Cc1ccc(NC/C=C/c2ccc(N(C)C)cc2)cc1 ZINC000841069765 1132325101 /nfs/dbraw/zinc/32/51/01/1132325101.db2.gz DLFBBWALESSSBS-SNAWJCMRSA-N 1 0 295.430 3.597 20 10 CHCDRO Cc1cc(O)c(C[NH2+]Cc2cccc3c2CCCN3)cc1C ZINC000841084490 1132325802 /nfs/dbraw/zinc/32/58/02/1132325802.db2.gz ZIQZVNKZOVFPRZ-UHFFFAOYSA-N 1 0 296.414 3.657 20 10 CHCDRO Cc1cc(N)cc(C[NH2+]Cc2cc(Cl)cc(C)c2O)c1 ZINC000841071245 1132326004 /nfs/dbraw/zinc/32/60/04/1132326004.db2.gz LJEBCBJCXQIDKL-UHFFFAOYSA-N 1 0 290.794 3.534 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CC[C@@H](F)C(F)(F)CC2)c(O)c1 ZINC001231841883 1132375498 /nfs/dbraw/zinc/37/54/98/1132375498.db2.gz FOBLZDBYCMREFU-CQSZACIVSA-N 1 0 287.325 3.578 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCC[C@H]2c2ccncc2)c(O)c1 ZINC001231843812 1132376379 /nfs/dbraw/zinc/37/63/79/1132376379.db2.gz BIXMIWNXXDQTOW-KRWDZBQOSA-N 1 0 282.387 3.741 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCC(F)(F)C(C)(C)C2)c(O)c1 ZINC001231842104 1132376467 /nfs/dbraw/zinc/37/64/67/1132376467.db2.gz JTJUZSTWZCPGGF-UHFFFAOYSA-N 1 0 283.362 3.876 20 10 CHCDRO COc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@H](C)[C@H](C)C1 ZINC001231849413 1132378095 /nfs/dbraw/zinc/37/80/95/1132378095.db2.gz SGSBCSGXVOAHJA-LSDHHAIUSA-N 1 0 290.451 3.629 20 10 CHCDRO Cc1cc(C)c(C[NH+]2CCC(c3cccnc3)CC2)c(O)c1 ZINC001231846134 1132378310 /nfs/dbraw/zinc/37/83/10/1132378310.db2.gz BRVDNNYHNMUQPK-UHFFFAOYSA-N 1 0 296.414 3.784 20 10 CHCDRO CCC(CC)[N@H+](C)Cc1cc(Cl)c(C)cc1O ZINC001231870398 1132385872 /nfs/dbraw/zinc/38/58/72/1132385872.db2.gz YHZWUBIRDOOPMA-UHFFFAOYSA-N 1 0 255.789 3.974 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CC[C@@H](C(F)(F)F)C2)cc1Cl ZINC001231870609 1132383217 /nfs/dbraw/zinc/38/32/17/1132383217.db2.gz LSRXWGFHNWCUJY-SNVBAGLBSA-N 1 0 293.716 3.738 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)CC2CCCC2)cc1Cl ZINC001231870364 1132383237 /nfs/dbraw/zinc/38/32/37/1132383237.db2.gz WBDIYQPCGVMWJX-UHFFFAOYSA-N 1 0 267.800 3.976 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2cc(Cl)c(C)cc2O)cn1 ZINC001231870234 1132384401 /nfs/dbraw/zinc/38/44/01/1132384401.db2.gz PHOCOFZAWVKPGG-UHFFFAOYSA-N 1 0 290.794 3.689 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)c1ccccn1 ZINC000841743135 1132386907 /nfs/dbraw/zinc/38/69/07/1132386907.db2.gz CTYYDKACWIMJOF-WDEREUQCSA-N 1 0 276.767 3.852 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)n1 ZINC000841745245 1132387430 /nfs/dbraw/zinc/38/74/30/1132387430.db2.gz OWEARXXEUSOGSS-NSHDSACASA-N 1 0 276.767 3.600 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1cccnc1)c1ccc(Cl)cc1O ZINC000841743430 1132388244 /nfs/dbraw/zinc/38/82/44/1132388244.db2.gz GFZDCCWMDQNEOX-WDEREUQCSA-N 1 0 276.767 3.852 20 10 CHCDRO CCCCOCC[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841746994 1132390848 /nfs/dbraw/zinc/39/08/48/1132390848.db2.gz MJGGZSFMVUEKIV-LLVKDONJSA-N 1 0 271.788 3.513 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2ccc3ccccc3c2O)CCC[C@]1(C)O ZINC001231879575 1132391583 /nfs/dbraw/zinc/39/15/83/1132391583.db2.gz IZCXNJXCKWVHOW-KUHUBIRLSA-N 1 0 299.414 3.528 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCC(C)(C)O1)c1ccc(Cl)cc1O ZINC000841751764 1132392653 /nfs/dbraw/zinc/39/26/53/1132392653.db2.gz IZISXESKBINDPY-PWSUYJOCSA-N 1 0 283.799 3.654 20 10 CHCDRO CCn1ccnc1[C@@H](C)[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841756750 1132393449 /nfs/dbraw/zinc/39/34/49/1132393449.db2.gz JXWMBCWPLPBNOC-GHMZBOCLSA-N 1 0 293.798 3.674 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1COCc2ccccc21)c1ccccc1O ZINC000841758360 1132393476 /nfs/dbraw/zinc/39/34/76/1132393476.db2.gz AOTZWCWURABLGJ-DLBZAZTESA-N 1 0 283.371 3.704 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)c1ccc(Cl)cc1O)c1cc[nH]c(=O)c1 ZINC000841757256 1132394083 /nfs/dbraw/zinc/39/40/83/1132394083.db2.gz MWEJKWMZYRUSLJ-NXEZZACHSA-N 1 0 292.766 3.558 20 10 CHCDRO Oc1ccccc1C[NH2+]C1CCC(Oc2ccccc2)CC1 ZINC001173195880 1132409151 /nfs/dbraw/zinc/40/91/51/1132409151.db2.gz ZMBAHAQRRABIGD-UHFFFAOYSA-N 1 0 297.398 3.872 20 10 CHCDRO Oc1cc(O)c(C[N@@H+]2CCC3(C2)CCCCC3)cc1Cl ZINC001232264444 1132444775 /nfs/dbraw/zinc/44/47/75/1132444775.db2.gz HKPVTNMLOYGGRK-UHFFFAOYSA-N 1 0 295.810 3.907 20 10 CHCDRO CC[C@H]1CCCC[N@@H+]1Cc1cc(Cl)c(O)cc1O ZINC001232262980 1132445148 /nfs/dbraw/zinc/44/51/48/1132445148.db2.gz YVZQMVUPAJWXFL-NSHDSACASA-N 1 0 269.772 3.516 20 10 CHCDRO COc1cc(O)c(C[NH+]2C[C@H]3CCCC[C@@H]3C2)cc1Cl ZINC001232266592 1132446215 /nfs/dbraw/zinc/44/62/15/1132446215.db2.gz PLWHVYIKGYPSHS-VXGBXAGGSA-N 1 0 295.810 3.676 20 10 CHCDRO CCC(CC)[N@H+](C)Cc1cc(Cl)c(OC)cc1[O-] ZINC001232269102 1132447217 /nfs/dbraw/zinc/44/72/17/1132447217.db2.gz QPTMCOARTJKRRU-UHFFFAOYSA-N 1 0 271.788 3.675 20 10 CHCDRO COc1ccc(C[NH2+]CC2CCC(F)CC2)cc1C ZINC000842774713 1132461116 /nfs/dbraw/zinc/46/11/16/1132461116.db2.gz KVKPRLRYNGRKCI-UHFFFAOYSA-N 1 0 265.372 3.622 20 10 CHCDRO CCCCOCC[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC000040506505 1132472965 /nfs/dbraw/zinc/47/29/65/1132472965.db2.gz DABXSXAFOQJTNB-KGLIPLIRSA-N 1 0 277.408 3.655 20 10 CHCDRO COc1ccccc1C1([NH2+][C@H]2CCc3cccc(O)c32)CC1 ZINC000842900764 1132474546 /nfs/dbraw/zinc/47/45/46/1132474546.db2.gz HMWMEBGRKGEBJI-HNNXBMFYSA-N 1 0 295.382 3.667 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCS[C@@H]1C)c1ccc(N(C)C)cc1 ZINC000842927357 1132476551 /nfs/dbraw/zinc/47/65/51/1132476551.db2.gz CNDVQMSDWTWLTN-KCXAZCMYSA-N 1 0 278.465 3.687 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CC[C@@H]3C[C@@H]3C2)c(O)c1C ZINC000842930761 1132477951 /nfs/dbraw/zinc/47/79/51/1132477951.db2.gz WKLFXUBGUODIBW-GBJTYRQASA-N 1 0 259.393 3.848 20 10 CHCDRO CC[N@H+](Cc1nc2ccccc2o1)Cc1ccccc1O ZINC001232558392 1132487925 /nfs/dbraw/zinc/48/79/25/1132487925.db2.gz KJEOTRPGHHFRAZ-UHFFFAOYSA-N 1 0 282.343 3.556 20 10 CHCDRO COC1(C)CC[NH+](Cc2cccc(C(C)(C)C)c2O)CC1 ZINC001143103835 1132501990 /nfs/dbraw/zinc/50/19/90/1132501990.db2.gz LMLFIVYTSOONJO-UHFFFAOYSA-N 1 0 291.435 3.691 20 10 CHCDRO CCO[C@H]1CCC[N@H+](Cc2cccc(C(C)(C)C)c2O)C1 ZINC001143110411 1132503536 /nfs/dbraw/zinc/50/35/36/1132503536.db2.gz FMBSCLTUWRSNDU-HNNXBMFYSA-N 1 0 291.435 3.691 20 10 CHCDRO C[N@@H+](Cc1cccc(C(C)(C)C)c1O)C[C@@H]1CCCCO1 ZINC001143110511 1132503838 /nfs/dbraw/zinc/50/38/38/1132503838.db2.gz HNJKQACTDZLQHA-HNNXBMFYSA-N 1 0 291.435 3.691 20 10 CHCDRO CCCO[C@@H]1CC[N@H+](Cc2cccc(C(C)(C)C)c2O)C1 ZINC001143110598 1132504959 /nfs/dbraw/zinc/50/49/59/1132504959.db2.gz KTQVCCBKXBRFEZ-OAHLLOKOSA-N 1 0 291.435 3.691 20 10 CHCDRO CCC[C@@H]1CCCC[N@@H+]1Cc1ccc(N(C)C)cc1O ZINC001232838184 1132529261 /nfs/dbraw/zinc/52/92/61/1132529261.db2.gz BDEPODQEZZOFOF-OAHLLOKOSA-N 1 0 276.424 3.613 20 10 CHCDRO COc1ccc(O)c(C[NH2+]C2(c3cccc(C)c3)CCC2)c1 ZINC000843424658 1132532985 /nfs/dbraw/zinc/53/29/85/1132532985.db2.gz FYMWFJKDDAYMOT-UHFFFAOYSA-N 1 0 297.398 3.878 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CCCC[C@@H]2C2CCC2)c1 ZINC000843437338 1132534226 /nfs/dbraw/zinc/53/42/26/1132534226.db2.gz CIINJVYYTJEMEI-MRXNPFEDSA-N 1 0 275.392 3.555 20 10 CHCDRO CN(C)c1ccc(C[NH2+]Cc2cccc(C(F)F)c2)cc1 ZINC000131763294 1132571409 /nfs/dbraw/zinc/57/14/09/1132571409.db2.gz FWQXNDLRXXAKMP-UHFFFAOYSA-N 1 0 290.357 3.980 20 10 CHCDRO Cc1cc(Br)cc(C[N@@H+]2CCCC23CC3)c1O ZINC001233106859 1132571311 /nfs/dbraw/zinc/57/13/11/1132571311.db2.gz RMXRPVYWOPEKTQ-UHFFFAOYSA-N 1 0 296.208 3.592 20 10 CHCDRO C[N@H+](CCc1cccnc1)Cc1cc(C(C)(C)C)ccc1O ZINC001233286105 1132594962 /nfs/dbraw/zinc/59/49/62/1132594962.db2.gz FTMYTUSXFPFFID-UHFFFAOYSA-N 1 0 298.430 3.759 20 10 CHCDRO C[N@@H+](Cc1cc(C(C)(C)C)ccc1O)CC1CCC1 ZINC001233286547 1132595221 /nfs/dbraw/zinc/59/52/21/1132595221.db2.gz YIRXKKBLCRRNTH-UHFFFAOYSA-N 1 0 261.409 3.922 20 10 CHCDRO CCc1c(Cl)cc(Nc2cc[nH+]cc2)c(O)c1Cl ZINC001173884879 1132625651 /nfs/dbraw/zinc/62/56/51/1132625651.db2.gz WHOPKNAWFFVZKE-UHFFFAOYSA-N 1 0 283.158 3.822 20 10 CHCDRO CC1(C)CCC[N@@H+]1Cc1ccc(C(F)(F)F)cc1O ZINC001233452014 1132625990 /nfs/dbraw/zinc/62/59/90/1132625990.db2.gz HQAPXPXBCWSYIC-UHFFFAOYSA-N 1 0 273.298 3.785 20 10 CHCDRO CC(C)CC[NH+](CCC(C)C)Cc1cc(O)c(O)cc1O ZINC001233487204 1132627171 /nfs/dbraw/zinc/62/71/71/1132627171.db2.gz UQMRYPYONNBCML-UHFFFAOYSA-N 1 0 295.423 3.698 20 10 CHCDRO CCSCC[C@@H](C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000135292155 1132656578 /nfs/dbraw/zinc/65/65/78/1132656578.db2.gz VKXOFGXAWFOZCA-OAHLLOKOSA-N 1 0 292.492 3.908 20 10 CHCDRO C[C@H]1CCC[N@H+](Cc2cccc(OC(F)(F)F)c2O)C1 ZINC001233726499 1132670667 /nfs/dbraw/zinc/67/06/67/1132670667.db2.gz FBHHCFZJVBQDNE-JTQLQIEISA-N 1 0 289.297 3.523 20 10 CHCDRO C[C@@H]1C[C@H]([NH3+])C[C@@H](c2ccncc2Nc2ccc(N)cc2)C1 ZINC001159383713 1132836996 /nfs/dbraw/zinc/83/69/96/1132836996.db2.gz KOUCOAKKGDTORZ-YDHLFZDLSA-N 1 0 296.418 3.638 20 10 CHCDRO Cc1c[nH+]ccc1Nc1ccccc1Cc1ccc(N)cc1 ZINC001174539270 1132900013 /nfs/dbraw/zinc/90/00/13/1132900013.db2.gz AMBOSYMJSIQUDS-UHFFFAOYSA-N 1 0 289.382 3.729 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(N[C@H]2CCC[C@H]([NH3+])C2)cc1 ZINC001162397592 1133074548 /nfs/dbraw/zinc/07/45/48/1133074548.db2.gz WQLQFRUFKWBORA-RDJZCZTQSA-N 1 0 283.419 3.776 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]CCC[C@@H]1C=CCC1 ZINC001203554135 1133338670 /nfs/dbraw/zinc/33/86/70/1133338670.db2.gz WUGADQOOTRDOCT-GFCCVEGCSA-N 1 0 265.784 3.882 20 10 CHCDRO CCCCC1CC[NH+](Cc2cccc(OC)c2O)CC1 ZINC001203589775 1133343237 /nfs/dbraw/zinc/34/32/37/1133343237.db2.gz OILMFYFESFGVMG-UHFFFAOYSA-N 1 0 277.408 3.803 20 10 CHCDRO CC[C@H](c1ccccc1)[N@H+](C)Cc1cccc(OC)c1O ZINC001203596508 1133344080 /nfs/dbraw/zinc/34/40/80/1133344080.db2.gz FPNBTCJWWGTBDA-MRXNPFEDSA-N 1 0 285.387 3.984 20 10 CHCDRO COc1cccc(C[NH+]2CCC3(CC[C@@H](F)C3)CC2)c1O ZINC001203596854 1133344468 /nfs/dbraw/zinc/34/44/68/1133344468.db2.gz PBSGZZNSLCQHGM-CQSZACIVSA-N 1 0 293.382 3.505 20 10 CHCDRO COc1ccc(C[N@@H+]2CC[C@@H](C3CCCCC3)C2)c(O)c1 ZINC001203629331 1133345844 /nfs/dbraw/zinc/34/58/44/1133345844.db2.gz WOQDGARIUNGGFF-OAHLLOKOSA-N 1 0 289.419 3.803 20 10 CHCDRO CCN(CC)c1ccc(CN2CC[C@@](C)(F)[C@@H](F)C2)cc1 ZINC001203939951 1133386133 /nfs/dbraw/zinc/38/61/33/1133386133.db2.gz GUSXOEQCQBWSMQ-DLBZAZTESA-N 1 0 296.405 3.805 20 10 CHCDRO CN(C)c1ccc(C[NH+]2CCC3(CCCC3)CC2)cc1 ZINC001203931949 1133387089 /nfs/dbraw/zinc/38/70/89/1133387089.db2.gz ZBFKFFWHIXULJQ-UHFFFAOYSA-N 1 0 272.436 3.909 20 10 CHCDRO C[C@H]1CC[N@@H+]1Cc1ccc(N(C)C)c2ccccc12 ZINC001204233139 1133422830 /nfs/dbraw/zinc/42/28/30/1133422830.db2.gz ODUYHVPWNMDPMB-ZDUSSCGKSA-N 1 0 254.377 3.500 20 10 CHCDRO CCCCC1CC[NH+](Cc2ccc(O)cc2O)CC1 ZINC001204276254 1133426679 /nfs/dbraw/zinc/42/66/79/1133426679.db2.gz IPRHGWOOAMSUFO-UHFFFAOYSA-N 1 0 263.381 3.500 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[NH+]1C[C@@H]2CCC[C@H]2C1 ZINC001204319855 1133436606 /nfs/dbraw/zinc/43/66/06/1133436606.db2.gz HTAFZEACNRAANY-IRXDYDNUSA-N 1 0 270.420 3.519 20 10 CHCDRO FC(F)[C@@H]1CCC[N@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001204323044 1133437093 /nfs/dbraw/zinc/43/70/93/1133437093.db2.gz ZPTYACMHSGTLRB-OAHLLOKOSA-N 1 0 294.389 3.764 20 10 CHCDRO CC1(C)CC[N@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001204326486 1133438170 /nfs/dbraw/zinc/43/81/70/1133438170.db2.gz IPFZRRJRYXJFJA-UHFFFAOYSA-N 1 0 258.409 3.519 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](C)CC(C)(C)C)c(Cl)c1 ZINC001204374257 1133441734 /nfs/dbraw/zinc/44/17/34/1133441734.db2.gz HAXRIAKOKNHEKQ-UHFFFAOYSA-N 1 0 255.789 3.832 20 10 CHCDRO Cc1ccc(C[N@H+]2CCC[C@H](CC(C)C)C2)c(O)c1 ZINC001204580183 1133464538 /nfs/dbraw/zinc/46/45/38/1133464538.db2.gz MWWGCDTUBUXCET-OAHLLOKOSA-N 1 0 261.409 3.959 20 10 CHCDRO CC[C@H](C)[C@@H]1CCCC[N@@H+]1Cc1cc(OC)ccc1O ZINC001204690691 1133476727 /nfs/dbraw/zinc/47/67/27/1133476727.db2.gz XKLNVBRAKLMMFC-BBRMVZONSA-N 1 0 277.408 3.801 20 10 CHCDRO CC(C)c1ccc(O)c(C[N@@H+]2CCC[C@H](c3cc[nH]n3)C2)c1 ZINC001204841245 1133491093 /nfs/dbraw/zinc/49/10/93/1133491093.db2.gz RVFOBKSJXUXTME-HNNXBMFYSA-N 1 0 299.418 3.618 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CC[C@H](C)[C@H]3CCCC[C@H]32)c1 ZINC001204880676 1133494742 /nfs/dbraw/zinc/49/47/42/1133494742.db2.gz FGRXADFAOURPCU-IAOVAPTHSA-N 1 0 289.419 3.801 20 10 CHCDRO CN(C)c1cc(F)c(C[NH+]2CCCCCCC2)cc1F ZINC001205108248 1133530931 /nfs/dbraw/zinc/53/09/31/1133530931.db2.gz OCMNWISZDTYBDO-UHFFFAOYSA-N 1 0 282.378 3.797 20 10 CHCDRO Cn1cccc1[C@H]1CCC[N@@H+]1Cc1ccc(Cl)cc1O ZINC001205162412 1133539339 /nfs/dbraw/zinc/53/93/39/1133539339.db2.gz NZHLVHLHKCPICL-OAHLLOKOSA-N 1 0 290.794 3.721 20 10 CHCDRO Nc1ccc(C[N@@H+]2CCCC[C@H]2c2ccccc2)cc1 ZINC001205171684 1133541095 /nfs/dbraw/zinc/54/10/95/1133541095.db2.gz VSKWNOAEBIZKIY-SFHVURJKSA-N 1 0 266.388 3.996 20 10 CHCDRO COc1cc(C)cc(C[NH2+]C[C@@H](SC)C(C)(C)C)c1O ZINC001205394542 1133573423 /nfs/dbraw/zinc/57/34/23/1133573423.db2.gz RYGXOGYRNLBVAX-CQSZACIVSA-N 1 0 297.464 3.577 20 10 CHCDRO CC[N@H+](Cc1occc1C)Cc1ccc(N(C)C)cc1C ZINC001206321185 1133689092 /nfs/dbraw/zinc/68/90/92/1133689092.db2.gz QCFBETONBPLSIB-UHFFFAOYSA-N 1 0 286.419 3.985 20 10 CHCDRO Cc1cccc(C[C@H](C)[NH2+][C@@H](C)c2ccccc2O)c1 ZINC001207161622 1133774109 /nfs/dbraw/zinc/77/41/09/1133774109.db2.gz ZRVAJJZOKMKWLF-GJZGRUSLSA-N 1 0 269.388 3.982 20 10 CHCDRO Oc1cccc2c1C[N@H+](CCc1cccc(Cl)c1)CC2 ZINC001207426406 1133801343 /nfs/dbraw/zinc/80/13/43/1133801343.db2.gz WWLMBOHVUHBUQJ-UHFFFAOYSA-N 1 0 287.790 3.646 20 10 CHCDRO Oc1c(C[NH2+]C[C@]23C[C@H]2CCC3)ccc2ccccc21 ZINC001207638190 1133835744 /nfs/dbraw/zinc/83/57/44/1133835744.db2.gz ABSBPZSTIIXJNM-QAPCUYQASA-N 1 0 267.372 3.825 20 10 CHCDRO C[C@H](CCCC(C)(C)O)CC[N@H+](C)Cc1ccccc1O ZINC001207677924 1133837701 /nfs/dbraw/zinc/83/77/01/1133837701.db2.gz ADRMTFQDWNLJJL-OAHLLOKOSA-N 1 0 293.451 3.791 20 10 CHCDRO CC1=C[C@@H](C)[C@@H](C[N@H+](C)Cc2ccccc2O)CC1 ZINC001208179760 1133898780 /nfs/dbraw/zinc/89/87/80/1133898780.db2.gz BZTRLSXBPHQPQB-HUUCEWRRSA-N 1 0 259.393 3.816 20 10 CHCDRO CC[N@H+](CCCc1ccccc1OC)Cc1ccccc1O ZINC001208841340 1133949672 /nfs/dbraw/zinc/94/96/72/1133949672.db2.gz WVFQRVRGQLCDBT-UHFFFAOYSA-N 1 0 299.414 3.856 20 10 CHCDRO COC(C)(C)CC[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001209407638 1134013598 /nfs/dbraw/zinc/01/35/98/1134013598.db2.gz NNNMKZGTLULQDC-UHFFFAOYSA-N 1 0 290.451 3.534 20 10 CHCDRO COC[C@@H]1CCC[N@@H+]1Cc1ccc(-n2c(C)ccc2C)cc1 ZINC001209516443 1134031871 /nfs/dbraw/zinc/03/18/71/1134031871.db2.gz GSWFOQRMFIGOAW-IBGZPJMESA-N 1 0 298.430 3.705 20 10 CHCDRO COc1ccc(C[NH2+]C[C@H]2CC3CCC2CC3)cc1C ZINC000400032291 1134577531 /nfs/dbraw/zinc/57/75/31/1134577531.db2.gz TUEICAMIAIHUNZ-BDVYOWHSSA-N 1 0 273.420 3.920 20 10 CHCDRO CC[C@@H](C[NH2+][C@H]1CCc2cccc(O)c21)CC(F)(F)F ZINC000402657304 1134669592 /nfs/dbraw/zinc/66/95/92/1134669592.db2.gz JJSWRISMMWBODV-PWSUYJOCSA-N 1 0 287.325 3.948 20 10 CHCDRO CC[C@@H](C[NH2+][C@@H]1CCc2cccc(O)c21)CC(F)(F)F ZINC000402657307 1134669794 /nfs/dbraw/zinc/66/97/94/1134669794.db2.gz JJSWRISMMWBODV-ZYHUDNBSSA-N 1 0 287.325 3.948 20 10 CHCDRO CC[C@H]1C[N@H+](Cc2c(O)ccc3ccccc32)[C@@H](C)CO1 ZINC000403825823 1134877442 /nfs/dbraw/zinc/87/74/42/1134877442.db2.gz MLRPVNSDAAPNMU-ZFWWWQNUSA-N 1 0 285.387 3.545 20 10 CHCDRO COc1cccc(C[N@@H+]2CCc3ccccc3[C@@H](C)C2)c1O ZINC000404870085 1134949867 /nfs/dbraw/zinc/94/98/67/1134949867.db2.gz XNPXRMZIPKYSSR-AWEZNQCLSA-N 1 0 297.398 3.563 20 10 CHCDRO O=C1C=CC=CC1=NNc1ccccc1O[C@H]1CC[NH2+]C1 ZINC001218183183 1135063759 /nfs/dbraw/zinc/06/37/59/1135063759.db2.gz MNTGTUFYLUVSDC-RUWSDDDDSA-N 1 0 283.331 3.548 20 10 CHCDRO O=C1C=CC(=NNc2ccc(O[C@H]3C=CC[NH2+]C3)cc2)C=C1 ZINC001218334084 1135090061 /nfs/dbraw/zinc/09/00/61/1135090061.db2.gz LDAFODTZUVOSND-KRWDZBQOSA-N 1 0 295.342 3.714 20 10 CHCDRO CCOC1(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)CCCC1 ZINC000315301038 1135153527 /nfs/dbraw/zinc/15/35/27/1135153527.db2.gz XVWHCQWGSNRPDU-HNNXBMFYSA-N 1 0 290.451 3.753 20 10 CHCDRO Oc1ccc(F)cc1C[NH+]1CCC(Cc2ccccc2)CC1 ZINC000319309392 1135183347 /nfs/dbraw/zinc/18/33/47/1135183347.db2.gz DUYMIIWTBLAPHZ-UHFFFAOYSA-N 1 0 299.389 3.986 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(C)cc1)c1ccccc1O ZINC000019962603 170944183 /nfs/dbraw/zinc/94/41/83/170944183.db2.gz FBRZEGQRBREKRX-INIZCTEOSA-N 1 0 255.361 3.942 20 10 CHCDRO COc1cccc(C[NH2+][C@H](C)c2ccc(Cl)cc2)c1O ZINC000020121944 171002100 /nfs/dbraw/zinc/00/21/00/171002100.db2.gz RIYAQNSEIKXUBL-LLVKDONJSA-N 1 0 291.778 3.905 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@@H](C)c1ccccn1 ZINC000020123635 171004933 /nfs/dbraw/zinc/00/49/33/171004933.db2.gz VJCKLPAXBOICMR-VNHYZAJKSA-N 1 0 282.387 3.995 20 10 CHCDRO C[C@H]([NH2+]Cc1ccccc1O)c1ccccc1Cl ZINC000020124013 171005371 /nfs/dbraw/zinc/00/53/71/171005371.db2.gz BOEHZUFHLVLHNB-NSHDSACASA-N 1 0 261.752 3.896 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2cccnc2)c(O)c1 ZINC000020127992 171013856 /nfs/dbraw/zinc/01/38/56/171013856.db2.gz YNWWYPKVRNJELE-STQMWFEESA-N 1 0 256.349 3.507 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)c1ccccc1O)c1cccc(F)c1 ZINC000020147846 171035279 /nfs/dbraw/zinc/03/52/79/171035279.db2.gz KFKFKPMWWUOILU-VXGBXAGGSA-N 1 0 259.324 3.943 20 10 CHCDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]Cc1ccco1 ZINC000022146687 171356702 /nfs/dbraw/zinc/35/67/02/171356702.db2.gz MYTCQOLVZRPEPD-AAEUAGOBSA-N 1 0 257.333 3.632 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H]2CCCc3ccccc32)c1O ZINC000074335936 260165013 /nfs/dbraw/zinc/16/50/13/260165013.db2.gz NUULBERGHCXUQD-QGZVFWFLSA-N 1 0 297.398 3.958 20 10 CHCDRO CC[C@@H](COC)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000079758220 260176446 /nfs/dbraw/zinc/17/64/46/260176446.db2.gz AXJILDIAQNQPLA-JSGCOSHPSA-N 1 0 273.376 3.621 20 10 CHCDRO CS[C@@H](C)C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000128001944 260370767 /nfs/dbraw/zinc/37/07/67/260370767.db2.gz JYOYJKAZYHEAQP-AWEZNQCLSA-N 1 0 278.465 3.518 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCO[C@H]1C1CC1)c1ccc2ccccc2c1O ZINC000318395553 261065551 /nfs/dbraw/zinc/06/55/51/261065551.db2.gz ILJUUQFEJJHNEW-WILYLXEWSA-N 1 0 297.398 3.764 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(COC)cc1)c1ccccc1O ZINC000155013524 261097241 /nfs/dbraw/zinc/09/72/41/261097241.db2.gz QUPKTXQZFKHJEG-KRWDZBQOSA-N 1 0 285.387 3.780 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](COC)c1ccc(C)o1)c1ccccc1O ZINC000156179724 261116043 /nfs/dbraw/zinc/11/60/43/261116043.db2.gz VMVLJNJKIDYHSP-CABCVRRESA-N 1 0 289.375 3.722 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCO[C@H](C3CC3)C2)c(O)c1C ZINC000157885876 261154768 /nfs/dbraw/zinc/15/47/68/261154768.db2.gz IXMIHGNVQVAYBV-QRTARXTBSA-N 1 0 289.419 3.617 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCO[C@H](C3CC3)C2)c(O)c1C ZINC000157885438 261154954 /nfs/dbraw/zinc/15/49/54/261154954.db2.gz IXMIHGNVQVAYBV-UNEWFSDZSA-N 1 0 289.419 3.617 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(C)nc1)c1ccc(N(C)C)cc1 ZINC000161293852 261242874 /nfs/dbraw/zinc/24/28/74/261242874.db2.gz XMRZUEKBRLZDAK-GOSISDBHSA-N 1 0 283.419 3.697 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccoc1)c1ccc(N(C)C)cc1 ZINC000178475616 261744438 /nfs/dbraw/zinc/74/44/38/261744438.db2.gz OJUCYSYRKNRJAN-INIZCTEOSA-N 1 0 258.365 3.587 20 10 CHCDRO COc1cc(C)cc(C[NH2+][C@@H](C)c2ccccc2O)c1 ZINC000183626233 261982576 /nfs/dbraw/zinc/98/25/76/261982576.db2.gz PWNFHSKSNOFJAT-ZDUSSCGKSA-N 1 0 271.360 3.560 20 10 CHCDRO COCc1ccc(C[NH2+][C@H](C)c2ccc(F)cc2[O-])cc1 ZINC000184941875 262035104 /nfs/dbraw/zinc/03/51/04/262035104.db2.gz PKGKLHVIOXWYRG-GFCCVEGCSA-N 1 0 289.350 3.529 20 10 CHCDRO CO[C@@H](C[NH2+][C@@H](C)c1ccc(C)cc1O)c1ccccc1 ZINC000185102026 262041030 /nfs/dbraw/zinc/04/10/30/262041030.db2.gz NCKDFIKUZPOZOO-KSSFIOAISA-N 1 0 285.387 3.739 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCCCNc2ccccn2)c(O)c1 ZINC000185325731 262050865 /nfs/dbraw/zinc/05/08/65/262050865.db2.gz BDOSLJYMSDUQBW-OAHLLOKOSA-N 1 0 299.418 3.639 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)Cc2ccc(O)cc2)c1 ZINC000185351586 262051718 /nfs/dbraw/zinc/05/17/18/262051718.db2.gz OLWNIBXIKYWFBI-KGLIPLIRSA-N 1 0 285.387 3.688 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCC[C@H](SC)C2)c1 ZINC000185483902 262055788 /nfs/dbraw/zinc/05/57/88/262055788.db2.gz QHIBNKLCLCGPRY-DYEKYZERSA-N 1 0 295.448 3.726 20 10 CHCDRO COC[C@@H]([NH2+][C@@H](C)c1ccc(C)cc1O)c1ccccc1 ZINC000186034996 262076173 /nfs/dbraw/zinc/07/61/73/262076173.db2.gz WSCIRYJZTHGHLW-WMLDXEAASA-N 1 0 285.387 3.739 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc([C@@H](C)O)cc1)c1ccccc1O ZINC000186127362 262080782 /nfs/dbraw/zinc/08/07/82/262080782.db2.gz QOZSRGOEINITQY-CXAGYDPISA-N 1 0 285.387 3.686 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCOC2(CCCC2)C1)c1cc(F)ccc1O ZINC000186130165 262081050 /nfs/dbraw/zinc/08/10/50/262081050.db2.gz ZGZKOAMUOBOERS-JSGCOSHPSA-N 1 0 293.382 3.674 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCOC3(CCCC3)C2)c1 ZINC000186129099 262081099 /nfs/dbraw/zinc/08/10/99/262081099.db2.gz FTQATLPYURFWKM-CABCVRRESA-N 1 0 289.419 3.843 20 10 CHCDRO Cc1noc(C)c1[C@@H](C)C[NH2+][C@H](C)c1cc(C)ccc1O ZINC000186157516 262082523 /nfs/dbraw/zinc/08/25/23/262082523.db2.gz DDOIQOYHEZYWBM-NWDGAFQWSA-N 1 0 288.391 3.760 20 10 CHCDRO Cc1noc(C)c1[C@H](C)C[NH2+][C@H](C)c1cc(C)ccc1O ZINC000186157481 262082757 /nfs/dbraw/zinc/08/27/57/262082757.db2.gz DDOIQOYHEZYWBM-VXGBXAGGSA-N 1 0 288.391 3.760 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(C(C)(C)O)cc1)c1ccccc1O ZINC000186602856 262101807 /nfs/dbraw/zinc/10/18/07/262101807.db2.gz APFDNCDCKOVMTG-QGZVFWFLSA-N 1 0 299.414 3.861 20 10 CHCDRO C[C@H](C[NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1nccs1 ZINC000186737962 262321670 /nfs/dbraw/zinc/32/16/70/262321670.db2.gz GJTPUJYIUBPCDB-OLZOCXBDSA-N 1 0 289.448 3.663 20 10 CHCDRO COc1cccc(C[NH2+]Cc2ccc(C3CCC3)cc2)c1O ZINC000277006630 263039254 /nfs/dbraw/zinc/03/92/54/263039254.db2.gz XIGDKUUJRNMJNR-UHFFFAOYSA-N 1 0 297.398 3.958 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CCC(F)(F)C2)c1 ZINC000280750772 263064101 /nfs/dbraw/zinc/06/41/01/263064101.db2.gz BQCZFLGKRNKCAS-NEPJUHHUSA-N 1 0 269.335 3.787 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC2(c3ccccn3)CCC2)c(O)c1 ZINC000367712812 267112273 /nfs/dbraw/zinc/11/22/73/267112273.db2.gz NRHOEKBSGLISME-OAHLLOKOSA-N 1 0 296.414 3.868 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CN(C)Cc3ccccc32)c1 ZINC000370372739 267313388 /nfs/dbraw/zinc/31/33/88/267313388.db2.gz CYTPNGANDHPGCV-RDTXWAMCSA-N 1 0 296.414 3.538 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(Cl)nc1)c1ccccc1O ZINC000183326258 327819331 /nfs/dbraw/zinc/81/93/31/327819331.db2.gz JUBUWZTVURLPFU-CYBMUJFWSA-N 1 0 276.767 3.682 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)Cc2ccc(O)cc2)c(O)c1 ZINC000185351779 327838243 /nfs/dbraw/zinc/83/82/43/327838243.db2.gz PHGRNITXQXJBFA-KBPBESRZSA-N 1 0 285.387 3.688 20 10 CHCDRO COC(C)(C)C[C@H](C)[NH2+][C@H](C)c1ccc(C)cc1O ZINC000185564737 327841343 /nfs/dbraw/zinc/84/13/43/327841343.db2.gz BTCXRNYNKLCSOK-QWHCGFSZSA-N 1 0 265.397 3.555 20 10 CHCDRO Cc1cccc(C[NH2+][C@H]2CCOC3(CCCCC3)C2)c1O ZINC000271866084 328198654 /nfs/dbraw/zinc/19/86/54/328198654.db2.gz WGHHWMWWDMFOHL-INIZCTEOSA-N 1 0 289.419 3.672 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@H]2CCOC3(CCC3)C2)c(O)c1 ZINC000285134378 328247432 /nfs/dbraw/zinc/24/74/32/328247432.db2.gz LOFPBIHZDGZPAZ-GJZGRUSLSA-N 1 0 289.419 3.761 20 10 CHCDRO C[C@H]1Oc2ccccc2[C@H]1[NH2+]Cc1cc(Cl)ccc1O ZINC000377407995 329014423 /nfs/dbraw/zinc/01/44/23/329014423.db2.gz OHDFMOXIBNRVPJ-HWPZZCPQSA-N 1 0 289.762 3.657 20 10 CHCDRO COc1ccc2c(c1)OCC[C@@H]2[NH2+][C@@H](C)c1ccccc1O ZINC000378629395 329057057 /nfs/dbraw/zinc/05/70/57/329057057.db2.gz DJZVSASDSGFIDJ-LRDDRELGSA-N 1 0 299.370 3.575 20 10 CHCDRO COc1ccc2c(c1)OCC[C@H]2[NH2+][C@H](C)c1ccccc1O ZINC000378629397 329057205 /nfs/dbraw/zinc/05/72/05/329057205.db2.gz DJZVSASDSGFIDJ-MLGOLLRUSA-N 1 0 299.370 3.575 20 10 CHCDRO Cc1cccc2c1OCC[C@H]2[NH2+]Cc1cc(C)c(C)cc1O ZINC000188877467 329374147 /nfs/dbraw/zinc/37/41/47/329374147.db2.gz VFGDNWAKGBWTBB-QGZVFWFLSA-N 1 0 297.398 3.931 20 10 CHCDRO COCCC1CC[NH+]([C@H](C)c2ccc(C)c(C)c2O)CC1 ZINC000527932432 330297520 /nfs/dbraw/zinc/29/75/20/330297520.db2.gz CFXQZUURMUQGGU-OAHLLOKOSA-N 1 0 291.435 3.819 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]CC[C@@H]2CC=CCC2)c1 ZINC000527975903 330301971 /nfs/dbraw/zinc/30/19/71/330301971.db2.gz BKCMGXZARXWJII-UONOGXRCSA-N 1 0 275.392 3.798 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1[C@H](C)O[C@H](C)[C@H]1C)c1ccc(C)cc1O ZINC000528008986 330303838 /nfs/dbraw/zinc/30/38/38/330303838.db2.gz UWXLVSPUGDMGAA-UWRURVRSSA-N 1 0 277.408 3.553 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1cccc(O)c1 ZINC000195287393 331166120 /nfs/dbraw/zinc/16/61/20/331166120.db2.gz BLNTZBJDKIHNBX-AWEZNQCLSA-N 1 0 296.414 3.625 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2cc(F)ccc2O)cc1 ZINC000226585351 333265513 /nfs/dbraw/zinc/26/55/13/333265513.db2.gz OKCGVGPKLBJTQI-GFCCVEGCSA-N 1 0 259.324 3.691 20 10 CHCDRO CCC([NH2+]Cc1cccc(C)c1O)(C1CC1)C1CC1 ZINC000529644099 333503333 /nfs/dbraw/zinc/50/33/33/333503333.db2.gz NAHAYSZVGXQBLT-UHFFFAOYSA-N 1 0 259.393 3.759 20 10 CHCDRO C[C@H]([NH2+]CCSC(C)(C)C)c1ccccc1O ZINC000272887913 334757257 /nfs/dbraw/zinc/75/72/57/334757257.db2.gz RYZPVBRQCHVJFK-NSHDSACASA-N 1 0 253.411 3.575 20 10 CHCDRO CCC[N@H+](Cc1cnc(Cl)s1)Cc1ccccc1O ZINC000079334312 521691593 /nfs/dbraw/zinc/69/15/93/521691593.db2.gz UKCWAHUYVKZLAX-UHFFFAOYSA-N 1 0 296.823 3.914 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCCCCOC)cc1 ZINC000122652782 520284615 /nfs/dbraw/zinc/28/46/15/520284615.db2.gz WTMZWFICGCKCEL-OAHLLOKOSA-N 1 0 278.440 3.610 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C2CC(F)(F)C2)cc1F ZINC000277660174 520905319 /nfs/dbraw/zinc/90/53/19/520905319.db2.gz NYQOJPBCNXSGIQ-UHFFFAOYSA-N 1 0 286.341 3.559 20 10 CHCDRO CCOc1cccc(C[NH2+][C@H]2C[C@H](c3ccccc3)C2)c1O ZINC000280623175 521376181 /nfs/dbraw/zinc/37/61/81/521376181.db2.gz LFIZERWENODHSR-QAQDUYKDSA-N 1 0 297.398 3.827 20 10 CHCDRO CCOCCC1(C[NH2+][C@@H](CC)c2ccc(C)cc2O)CC1 ZINC000280128275 521691022 /nfs/dbraw/zinc/69/10/22/521691022.db2.gz OTRWDXABLOZNKY-INIZCTEOSA-N 1 0 291.435 3.948 20 10 CHCDRO CCOCCCC[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000263685502 521703319 /nfs/dbraw/zinc/70/33/19/521703319.db2.gz NOYQTROQATVMLU-UHFFFAOYSA-N 1 0 299.414 3.966 20 10 CHCDRO CCc1ccccc1C[NH2+][C@H](C)c1cc(OC)ccc1O ZINC000084200328 521843517 /nfs/dbraw/zinc/84/35/17/521843517.db2.gz CTZZIGWIJUKESY-CYBMUJFWSA-N 1 0 285.387 3.814 20 10 CHCDRO CN(C)c1ccc(C[NH2+]Cc2ccoc2)c(C(F)(F)F)c1 ZINC000280088544 522210250 /nfs/dbraw/zinc/21/02/50/522210250.db2.gz YXVNVONIDOEZGS-UHFFFAOYSA-N 1 0 298.308 3.654 20 10 CHCDRO CC[C@H]([NH2+]CC1(C)CCOCC1)c1ccc(C)cc1O ZINC000280074059 522570832 /nfs/dbraw/zinc/57/08/32/522570832.db2.gz LGMYEXHWUBWNCY-HNNXBMFYSA-N 1 0 277.408 3.558 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1COc2ccccc21)c1ccccc1O ZINC000289846602 522622284 /nfs/dbraw/zinc/62/22/84/522622284.db2.gz BBSPWPUSPVSTJL-CJNGLKHVSA-N 1 0 283.371 3.609 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCC[C@@H]2OCC[C@@H]21)c1ccc(C)cc1O ZINC000280036850 522711839 /nfs/dbraw/zinc/71/18/39/522711839.db2.gz IOLQICUMMHZGQI-HPFXQQBRSA-N 1 0 289.419 3.699 20 10 CHCDRO CC[C@@H]([NH2+]CC1CCSCC1)c1ccccc1O ZINC000229221995 522823047 /nfs/dbraw/zinc/82/30/47/522823047.db2.gz GTSDKQUMWYZWMS-CQSZACIVSA-N 1 0 265.422 3.576 20 10 CHCDRO CC[C@H](c1ccncc1)[N@H+](C)Cc1cc(F)ccc1O ZINC000290293420 522964751 /nfs/dbraw/zinc/96/47/51/522964751.db2.gz APQIASJZCRWSBE-OAHLLOKOSA-N 1 0 274.339 3.509 20 10 CHCDRO CO[C@@H](C)[C@@H](C)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000290234609 523431020 /nfs/dbraw/zinc/43/10/20/523431020.db2.gz RZZCKOGAOBSDNJ-UPJWGTAASA-N 1 0 273.376 3.619 20 10 CHCDRO CO[C@@H](C)[C@H](C)[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000191647791 523444377 /nfs/dbraw/zinc/44/43/77/523444377.db2.gz KPUFIJGNYMBTOP-XHSDSOJGSA-N 1 0 290.451 3.751 20 10 CHCDRO CO[C@H](C)[C@H](C)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000191655548 523898643 /nfs/dbraw/zinc/89/86/43/523898643.db2.gz RZZCKOGAOBSDNJ-RWMBFGLXSA-N 1 0 273.376 3.619 20 10 CHCDRO C[C@H](CCc1ccc(O)cc1)[NH2+][C@@H](C)c1ccccc1O ZINC000037140277 524233976 /nfs/dbraw/zinc/23/39/76/524233976.db2.gz KVFOKGGRXHSFIB-KGLIPLIRSA-N 1 0 285.387 3.770 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2cccc3c2OCO3)c(O)c1 ZINC000293242528 524331786 /nfs/dbraw/zinc/33/17/86/524331786.db2.gz BGGISYGKRZYDFW-CYBMUJFWSA-N 1 0 299.370 3.589 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2ccsc2)c1 ZINC000061360735 524772905 /nfs/dbraw/zinc/77/29/05/524772905.db2.gz IVIFEZNDICHTPX-QWRGUYRKSA-N 1 0 277.389 3.874 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H]2CCC[C@H](C(F)(F)F)C2)c1 ZINC000071407913 525353148 /nfs/dbraw/zinc/35/31/48/525353148.db2.gz WMPYGTADAPGMGI-QWHCGFSZSA-N 1 0 287.325 3.911 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(F)cc2F)c1 ZINC000051016753 525365160 /nfs/dbraw/zinc/36/51/60/525365160.db2.gz OHGQKBJDZMBOBO-NSHDSACASA-N 1 0 277.314 3.830 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1COc2ccccc21)c1ccc(N(C)C)cc1 ZINC000289824646 525506401 /nfs/dbraw/zinc/50/64/01/525506401.db2.gz AIVDGJZDVZVQTE-ZBFHGGJFSA-N 1 0 296.414 3.579 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccccn1 ZINC000037218854 525526075 /nfs/dbraw/zinc/52/60/75/525526075.db2.gz DJCWAKDOFLTLMW-OAHLLOKOSA-N 1 0 281.403 3.533 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccccn1)c1ccc(N(C)C)cc1 ZINC000037218844 525614134 /nfs/dbraw/zinc/61/41/34/525614134.db2.gz GJDMBMGVBMYBJA-KGLIPLIRSA-N 1 0 269.392 3.559 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCC(C)(F)F)c(O)c1C ZINC000297255612 525919511 /nfs/dbraw/zinc/91/95/11/525919511.db2.gz JPNPYKKOGDOGOW-NSHDSACASA-N 1 0 257.324 3.705 20 10 CHCDRO COc1cccc(C[NH2+][C@H](C)c2cc(C)sc2C)c1O ZINC000037123005 526037587 /nfs/dbraw/zinc/03/75/87/526037587.db2.gz SJPVEUIMAZIKPB-LLVKDONJSA-N 1 0 291.416 3.930 20 10 CHCDRO Oc1ccccc1C[NH2+][C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000037141683 526373460 /nfs/dbraw/zinc/37/34/60/526373460.db2.gz SVSPKHMHTROQBZ-NWDGAFQWSA-N 1 0 273.298 3.603 20 10 CHCDRO Cc1n[nH]c(C)c1[C@H]1CCC[N@@H+]1Cc1cc(C)c(C)cc1O ZINC000290343623 526523670 /nfs/dbraw/zinc/52/36/70/526523670.db2.gz FPEAINRNZQGIHU-MRXNPFEDSA-N 1 0 299.418 3.686 20 10 CHCDRO CCC1CCC([N@H+](C)Cc2cc(OC)ccc2O)CC1 ZINC000133532270 1125468337 /nfs/dbraw/zinc/46/83/37/1125468337.db2.gz DDOKGGORDAAKHL-UHFFFAOYSA-N 1 0 277.408 3.801 20 10 CHCDRO CCSCC[C@@H](C)[NH2+][C@H](C)c1cc(OC)ccc1O ZINC000168808264 1119478745 /nfs/dbraw/zinc/47/87/45/1119478745.db2.gz VPBHBRJHDNBSSD-VXGBXAGGSA-N 1 0 283.437 3.583 20 10 CHCDRO CC(C)CC[C@](C)(O)C[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000756606154 1120595766 /nfs/dbraw/zinc/59/57/66/1120595766.db2.gz VXBMAZZACBQRHO-WBMJQRKESA-N 1 0 299.842 3.883 20 10 CHCDRO CSCCCCCC[NH2+][C@H]1CCc2cccc(O)c21 ZINC000312099989 1120991159 /nfs/dbraw/zinc/99/11/59/1120991159.db2.gz UBDFUPNESYLWLK-AWEZNQCLSA-N 1 0 279.449 3.893 20 10 CHCDRO C[C@H](F)CC[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000702625089 1121205808 /nfs/dbraw/zinc/20/58/08/1121205808.db2.gz XEGXMCDWRDVZBQ-AWEZNQCLSA-N 1 0 264.388 3.515 20 10 CHCDRO C[C@H]([NH2+]CC[C@H]1CCSC1)c1ccc(N(C)C)cc1 ZINC000704775137 1121368014 /nfs/dbraw/zinc/36/80/14/1121368014.db2.gz KJOJWSSDGJHCCY-KBPBESRZSA-N 1 0 278.465 3.546 20 10 CHCDRO COc1ccc(C[NH2+]C[C@]2(C)C[C@H]3C[C@H]3C2)cc1C ZINC001179316509 1121872192 /nfs/dbraw/zinc/87/21/92/1121872192.db2.gz XWYPAEXDVPATJT-SCAQPMJSSA-N 1 0 259.393 3.529 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+][C@@H](C)CC2CCC2)c1O ZINC000710248644 1121962537 /nfs/dbraw/zinc/96/25/37/1121962537.db2.gz MWCZYJAOTPWGQZ-JTQLQIEISA-N 1 0 283.799 3.723 20 10 CHCDRO CCCCC[C@H](C)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000733322941 1121976383 /nfs/dbraw/zinc/97/63/83/1121976383.db2.gz GONYLUTUIWPCHX-ZDUSSCGKSA-N 1 0 266.404 3.950 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@@H]2CCCCC2(F)F)cc1C ZINC000824543427 1131474997 /nfs/dbraw/zinc/47/49/97/1131474997.db2.gz KBHVSJBCZVFLDQ-AWEZNQCLSA-N 1 0 283.362 3.924 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]CC[C@@]1(C)C[C@@]1(F)Cl ZINC000846030124 1131679974 /nfs/dbraw/zinc/67/99/74/1131679974.db2.gz QDXDEXVPUNKHFG-HOTGVXAUSA-N 1 0 298.833 3.855 20 10 CHCDRO CC[C@@H]([NH2+]C[C@](C)(CC)OC)c1ccc(C)cc1O ZINC000834883179 1131717307 /nfs/dbraw/zinc/71/73/07/1131717307.db2.gz ZQWUEEBDEVZVNO-ZBFHGGJFSA-N 1 0 265.397 3.556 20 10 CHCDRO Cc1cc(O)c(C[NH+]2CC3(C2)CCCC3)cc1Cl ZINC001231867493 1132384704 /nfs/dbraw/zinc/38/47/04/1132384704.db2.gz LGVNSCQCHGZEGN-UHFFFAOYSA-N 1 0 265.784 3.730 20 10 CHCDRO COCC1(CC[NH2+][C@H](C)c2ccc(Cl)cc2[O-])CC1 ZINC000842890732 1132472745 /nfs/dbraw/zinc/47/27/45/1132472745.db2.gz KKGJZRGGQACPLT-LLVKDONJSA-N 1 0 283.799 3.513 20 10 CHCDRO COc1c(Cl)cccc1C[NH2+]Cc1c(C)cccc1O ZINC000897482385 1125531112 /nfs/dbraw/zinc/53/11/12/1125531112.db2.gz RJSLABALMAYHHA-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO C[C@H]1C[C@H](C)[N@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000134957826 1125570402 /nfs/dbraw/zinc/57/04/02/1125570402.db2.gz UZIDCXPKQQTGEZ-STQMWFEESA-N 1 0 255.361 3.776 20 10 CHCDRO C[C@@H]1C[C@H](C)[N@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000134957805 1125570773 /nfs/dbraw/zinc/57/07/73/1125570773.db2.gz UZIDCXPKQQTGEZ-OLZOCXBDSA-N 1 0 255.361 3.776 20 10 CHCDRO Fc1ccc(C2([NH2+]Cc3ccc4c(c3)CCO4)CC2)cc1 ZINC000729685755 1125577352 /nfs/dbraw/zinc/57/73/52/1125577352.db2.gz NWHZJPKADPDAIU-UHFFFAOYSA-N 1 0 283.346 3.540 20 10 CHCDRO CC[N@H+](Cc1cccs1)Cc1ccc(N(C)C)cc1 ZINC000216351098 1125593425 /nfs/dbraw/zinc/59/34/25/1125593425.db2.gz HAXUMHMQXFSESB-UHFFFAOYSA-N 1 0 274.433 3.836 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCC[C@H]([NH+](C)C)C1)c1ccc(Cl)cc1[O-] ZINC000841756183 1125593861 /nfs/dbraw/zinc/59/38/61/1125593861.db2.gz UTTZCKQSJWDYEQ-UBHSHLNASA-N 1 0 296.842 3.569 20 10 CHCDRO CCC(C)(C)OCC[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841757645 1125597174 /nfs/dbraw/zinc/59/71/74/1125597174.db2.gz OEPOVWNBPJXOLK-NSHDSACASA-N 1 0 285.815 3.901 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCc3cccnc32)cc1 ZINC000886506460 1125681960 /nfs/dbraw/zinc/68/19/60/1125681960.db2.gz UMSZBKRRANNBEH-GOSISDBHSA-N 1 0 295.430 3.705 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2cc(C3CC3)no2)cc1 ZINC000886684528 1125707543 /nfs/dbraw/zinc/70/75/43/1125707543.db2.gz NEKNNPAQAIIFGS-CYBMUJFWSA-N 1 0 299.418 3.859 20 10 CHCDRO CC[C@H]([NH2+]CC(C1CC1)C1CC1)c1ccccc1O ZINC000088456007 1129205722 /nfs/dbraw/zinc/20/57/22/1129205722.db2.gz UHQIDRUKKXRKHT-INIZCTEOSA-N 1 0 259.393 3.869 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](C)c1nccs1)c1ccccc1O ZINC000158098593 1126745753 /nfs/dbraw/zinc/74/57/53/1126745753.db2.gz XRCIKVZWVASLAY-YPMHNXCESA-N 1 0 276.405 3.693 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](C)c2ccccn2)cc1 ZINC000152337620 1126756990 /nfs/dbraw/zinc/75/69/90/1126756990.db2.gz XGIFCUZZXLMOAI-GJZGRUSLSA-N 1 0 283.419 3.950 20 10 CHCDRO Nc1ccc(CC[NH2+]Cc2ccc(C(F)F)c(F)c2)cc1 ZINC000904352800 1126848022 /nfs/dbraw/zinc/84/80/22/1126848022.db2.gz BFWVVZCEWIWNLI-UHFFFAOYSA-N 1 0 294.320 3.678 20 10 CHCDRO CC[C@](C)([NH2+]Cc1cccc(C)c1O)c1nccs1 ZINC000182371427 1126871298 /nfs/dbraw/zinc/87/12/98/1126871298.db2.gz WWQXUIXTJPQBTM-HNNXBMFYSA-N 1 0 276.405 3.572 20 10 CHCDRO CCOc1ccc(C[NH2+][C@H](C)c2ccccc2O)cc1F ZINC000183499607 1126887936 /nfs/dbraw/zinc/88/79/36/1126887936.db2.gz DWQIOBQSVOIYNM-GFCCVEGCSA-N 1 0 289.350 3.781 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCc2cc(F)ccc21)c1ccccc1O ZINC000183466092 1126888017 /nfs/dbraw/zinc/88/80/17/1126888017.db2.gz LDOXOMPBHXQCNG-ZBEGNZNMSA-N 1 0 271.335 3.869 20 10 CHCDRO C[C@@H]([NH2+][C@H](CCCO)c1ccccc1)c1ccccc1O ZINC000183527401 1126888787 /nfs/dbraw/zinc/88/87/87/1126888787.db2.gz IAMRWERTWKTRCU-RHSMWYFYSA-N 1 0 285.387 3.557 20 10 CHCDRO C[C@H]([NH2+]Cc1nc(C2CC2)cs1)c1ccccc1O ZINC000183619238 1126889746 /nfs/dbraw/zinc/88/97/46/1126889746.db2.gz SGBRUKJODPWPOF-JTQLQIEISA-N 1 0 274.389 3.577 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC[C@](C)(O)c2ccccc2)c(O)c1 ZINC000187927016 1126917515 /nfs/dbraw/zinc/91/75/15/1126917515.db2.gz MGJOUWPESOIRTI-BEFAXECRSA-N 1 0 299.414 3.649 20 10 CHCDRO CCOC(C)(C)C[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000188686549 1126925414 /nfs/dbraw/zinc/92/54/14/1126925414.db2.gz NFONEUHNJJMOBV-JTQLQIEISA-N 1 0 271.788 3.511 20 10 CHCDRO C[C@@H]([NH2+][C@H]1C[C@@H]1c1cccc(F)c1)c1ccccc1O ZINC000906594270 1126961017 /nfs/dbraw/zinc/96/10/17/1126961017.db2.gz CTSXMOLYWGBIOE-LYRGGWFBSA-N 1 0 271.335 3.738 20 10 CHCDRO COc1cccc(C[NH2+][C@@H]2CC(C)(C)CC[C@@H]2C)c1O ZINC000717522524 1126989157 /nfs/dbraw/zinc/98/91/57/1126989157.db2.gz BJVYOLXFXXXBFQ-GXTWGEPZSA-N 1 0 277.408 3.705 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1cncs1 ZINC000268786726 1127023670 /nfs/dbraw/zinc/02/36/70/1127023670.db2.gz BOXHIUHPCKGFKO-CYBMUJFWSA-N 1 0 287.432 3.594 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)cc1)[C@@H](C)c1cccnc1 ZINC000269334554 1127038234 /nfs/dbraw/zinc/03/82/34/1127038234.db2.gz AZZMWZAJASPKRI-HNNXBMFYSA-N 1 0 283.419 3.731 20 10 CHCDRO COc1ccc(C[NH2+]Cc2ccc(Cl)o2)cc1C ZINC000698077349 1127038806 /nfs/dbraw/zinc/03/88/06/1127038806.db2.gz ZGTXZIKKNWFZNN-UHFFFAOYSA-N 1 0 265.740 3.540 20 10 CHCDRO CC(C)COC1CC[NH+](Cc2c(O)cccc2Cl)CC1 ZINC000271131944 1127069311 /nfs/dbraw/zinc/06/93/11/1127069311.db2.gz PYUBRTNEBMVLRJ-UHFFFAOYSA-N 1 0 297.826 3.683 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CCCc3cn[nH]c32)cc1 ZINC000271436423 1127081271 /nfs/dbraw/zinc/08/12/71/1127081271.db2.gz BQFCUQXAGVXDIE-SUMWQHHRSA-N 1 0 298.434 3.594 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)CCSC)c1ccc(N(C)C)cc1 ZINC000151091530 1127122351 /nfs/dbraw/zinc/12/23/51/1127122351.db2.gz WFGXVHWLDOIMCJ-CZUORRHYSA-N 1 0 280.481 3.935 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CCC[C@@H]1[C@@H]1CCCO1 ZINC000284016709 1127169928 /nfs/dbraw/zinc/16/99/28/1127169928.db2.gz HXVXPPMESBQCPZ-MJGOQNOKSA-N 1 0 297.398 3.689 20 10 CHCDRO COc1cccc(C[NH2+]C2(Cc3ccccc3)CCC2)c1O ZINC000760715534 1127206469 /nfs/dbraw/zinc/20/64/69/1127206469.db2.gz AWJHVQTTZKWHBC-UHFFFAOYSA-N 1 0 297.398 3.656 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CCCc2ccccn2)c(O)c1 ZINC000285321094 1127222547 /nfs/dbraw/zinc/22/25/47/1127222547.db2.gz TWHSYARORIWOQF-HNNXBMFYSA-N 1 0 284.403 3.687 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CC[C@@H]2CCCCO2)c(O)c1 ZINC000285400509 1127225615 /nfs/dbraw/zinc/22/56/15/1127225615.db2.gz XCWSSHWPMHQOIJ-CABCVRRESA-N 1 0 277.408 3.619 20 10 CHCDRO CSCc1ccc(C[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC000285623064 1127239806 /nfs/dbraw/zinc/23/98/06/1127239806.db2.gz YDRGMWVLLQSVAE-UHFFFAOYSA-N 1 0 299.439 3.774 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(C)nc1)c1cccc(Cl)c1[O-] ZINC000287554612 1127309626 /nfs/dbraw/zinc/30/96/26/1127309626.db2.gz FUKQLZGHLBKVHI-HNNXBMFYSA-N 1 0 290.794 3.990 20 10 CHCDRO C[C@@H](CF)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000288391757 1127336591 /nfs/dbraw/zinc/33/65/91/1127336591.db2.gz GZQZOHXCSFMTFE-LBPRGKRZSA-N 1 0 259.324 3.507 20 10 CHCDRO C[C@@H](CCC1CC1)[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001308381171 1127375568 /nfs/dbraw/zinc/37/55/68/1127375568.db2.gz OXSBAHDSHNLWPN-ZDUSSCGKSA-N 1 0 259.393 3.680 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[C@@H](C)C[C@@H]2C)c1 ZINC000226160491 1127380757 /nfs/dbraw/zinc/38/07/57/1127380757.db2.gz TWJGSZZZYUUPCJ-LMOYCYGVSA-N 1 0 277.408 3.876 20 10 CHCDRO C[C@@H](CCc1ccccc1)[NH2+]Cc1cc(F)ccc1O ZINC000226582789 1127411553 /nfs/dbraw/zinc/41/15/53/1127411553.db2.gz BMRVSBDBCGWWGL-ZDUSSCGKSA-N 1 0 273.351 3.642 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1C[C@H]1C)c1ccc2ccccc2c1O ZINC000168740915 1127463992 /nfs/dbraw/zinc/46/39/92/1127463992.db2.gz BYVWXUMUCATGPU-DYEKYZERSA-N 1 0 255.361 3.852 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1C[C@@H]1C)c1ccc2ccccc2c1O ZINC000168740829 1127464244 /nfs/dbraw/zinc/46/42/44/1127464244.db2.gz BYVWXUMUCATGPU-SGMGOOAPSA-N 1 0 255.361 3.852 20 10 CHCDRO CCC1([NH2+]C2CCN(c3ccc(OC)cc3)CC2)CCC1 ZINC000360474126 1127500425 /nfs/dbraw/zinc/50/04/25/1127500425.db2.gz YNKIIMMIVPERCQ-UHFFFAOYSA-N 1 0 288.435 3.586 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2cccc(N(C)C)c2)c(O)c1 ZINC000293579595 1127506994 /nfs/dbraw/zinc/50/69/94/1127506994.db2.gz DVKJJMOTLOUQBL-HNNXBMFYSA-N 1 0 298.430 3.926 20 10 CHCDRO CC[C@@H]([NH2+]CC1CC(F)(F)C1)c1ccc(C)cc1O ZINC000293632521 1127509717 /nfs/dbraw/zinc/50/97/17/1127509717.db2.gz KFUXOBJENMNPPI-CYBMUJFWSA-N 1 0 269.335 3.787 20 10 CHCDRO COC1(CC[NH2+][C@H](C)c2ccc(C)c(C)c2O)CCC1 ZINC000293681853 1127512948 /nfs/dbraw/zinc/51/29/48/1127512948.db2.gz KIHVIBZANZFJPO-CQSZACIVSA-N 1 0 277.408 3.619 20 10 CHCDRO CCCC[N@H+](Cc1cc(Cl)cc(OC)c1O)C1CC1 ZINC000761191104 1127516607 /nfs/dbraw/zinc/51/66/07/1127516607.db2.gz NKWPNIMNVZTKIS-UHFFFAOYSA-N 1 0 283.799 3.819 20 10 CHCDRO C[C@H](CC[NH2+]Cc1ccc2c(c1)CCO2)c1ccccc1 ZINC000060394186 1127522021 /nfs/dbraw/zinc/52/20/21/1127522021.db2.gz LCUNCJMHXGYXIJ-OAHLLOKOSA-N 1 0 281.399 3.905 20 10 CHCDRO CCc1noc(C)c1C[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000293835231 1127523949 /nfs/dbraw/zinc/52/39/49/1127523949.db2.gz XJWORSYINMPQFR-LBPRGKRZSA-N 1 0 288.391 3.719 20 10 CHCDRO CC[C@H]([NH2+]CCC1(COC)CCC1)c1ccc(C)cc1O ZINC000293848056 1127525484 /nfs/dbraw/zinc/52/54/84/1127525484.db2.gz YEGCHPZRDXGLTH-INIZCTEOSA-N 1 0 291.435 3.948 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CC[C@@H]3CCC[C@H]3C2)cc1Cl ZINC001231868436 1127544545 /nfs/dbraw/zinc/54/45/45/1127544545.db2.gz UTBHXSWHKGMAAS-STQMWFEESA-N 1 0 279.811 3.976 20 10 CHCDRO Oc1ccccc1[C@@H](CCc1ccccc1)[NH2+]CCF ZINC000294122214 1127550476 /nfs/dbraw/zinc/55/04/76/1127550476.db2.gz KUMVCVSNPPQRKI-MRXNPFEDSA-N 1 0 273.351 3.625 20 10 CHCDRO C[C@@H](CCCC(F)(F)F)[NH2+]Cc1ccccc1O ZINC000228407673 1127556045 /nfs/dbraw/zinc/55/60/45/1127556045.db2.gz IWNSRKMJLBSCBF-JTQLQIEISA-N 1 0 261.287 3.603 20 10 CHCDRO Cc1cnc([C@H](C)[NH2+]Cc2ccc(N(C)C)c(C)c2)s1 ZINC000294697775 1127592596 /nfs/dbraw/zinc/59/25/96/1127592596.db2.gz UIPBVBMLZHWKEK-ZDUSSCGKSA-N 1 0 289.448 3.677 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+][C@H]2CCCSC2)c(O)c1 ZINC000294895843 1127607100 /nfs/dbraw/zinc/60/71/00/1127607100.db2.gz VQKBUQUBSZHJEB-OLZOCXBDSA-N 1 0 265.422 3.555 20 10 CHCDRO C[C@@H]1C[C@@H]([NH2+]Cc2ccc3c(c2)CCO3)c2ccccc2O1 ZINC000295128632 1127621842 /nfs/dbraw/zinc/62/18/42/1127621842.db2.gz XSMAATWJNYPZMG-CXAGYDPISA-N 1 0 295.382 3.623 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+][C@@H](C)c2ccsc2)c1O ZINC000229051859 1127643219 /nfs/dbraw/zinc/64/32/19/1127643219.db2.gz ZACCIXVXBHCMTH-VIFPVBQESA-N 1 0 297.807 3.967 20 10 CHCDRO CCn1cc([C@@H](C)[NH2+][C@H](C)c2cc(Cl)ccc2O)cn1 ZINC000295964536 1127658952 /nfs/dbraw/zinc/65/89/52/1127658952.db2.gz NIKXYLOWEJPUOC-GHMZBOCLSA-N 1 0 293.798 3.674 20 10 CHCDRO CCn1cc([C@H](C)[NH2+][C@H](C)c2cc(Cl)ccc2O)cn1 ZINC000295965862 1127659005 /nfs/dbraw/zinc/65/90/05/1127659005.db2.gz NIKXYLOWEJPUOC-WDEREUQCSA-N 1 0 293.798 3.674 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CCCc2ncccc2C)c(O)c1 ZINC000296486495 1127672916 /nfs/dbraw/zinc/67/29/16/1127672916.db2.gz OMRVHWYDYSXJCX-MRXNPFEDSA-N 1 0 298.430 3.996 20 10 CHCDRO COc1ccc(N2CCC([NH2+]C3CCCCC3)CC2)cc1 ZINC000363557090 1127676651 /nfs/dbraw/zinc/67/66/51/1127676651.db2.gz LMSHXQCNISBQBM-UHFFFAOYSA-N 1 0 288.435 3.586 20 10 CHCDRO Cc1cccnc1CCC[NH2+][C@H](C)c1cc(F)ccc1O ZINC000296636602 1127679382 /nfs/dbraw/zinc/67/93/82/1127679382.db2.gz XTAQCNSJWNEKJX-CYBMUJFWSA-N 1 0 288.366 3.518 20 10 CHCDRO C[C@H]([NH2+]Cc1cc(Cl)ccc1O)c1ccsc1 ZINC000061360799 1127685580 /nfs/dbraw/zinc/68/55/80/1127685580.db2.gz NWAPLRLZMNVURO-VIFPVBQESA-N 1 0 267.781 3.958 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)c2ccsc2)cc1C ZINC000061361604 1127685727 /nfs/dbraw/zinc/68/57/27/1127685727.db2.gz BSAICHHQRZUCMI-GFCCVEGCSA-N 1 0 261.390 3.916 20 10 CHCDRO Cc1cc(C[NH+](C)C)cc(N[C@H]2CCc3cccc(O)c32)c1 ZINC000297037284 1127687829 /nfs/dbraw/zinc/68/78/29/1127687829.db2.gz VAQFWNSUGAMPGJ-KRWDZBQOSA-N 1 0 296.414 3.862 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@@H]1CCc3cc(F)ccc31)CC2 ZINC000297619721 1127701918 /nfs/dbraw/zinc/70/19/18/1127701918.db2.gz IWTMLCBPFSNJGZ-CVEARBPZSA-N 1 0 283.346 3.796 20 10 CHCDRO CC(C)[C@H](C[NH2+][C@H]1CCc2cccc(O)c21)c1cccnc1 ZINC000297619704 1127702004 /nfs/dbraw/zinc/70/20/04/1127702004.db2.gz IWGOPEIVBAMFMI-IRXDYDNUSA-N 1 0 296.414 3.804 20 10 CHCDRO CCc1nc([C@@H](C)[NH2+][C@H]2CCc3cccc(O)c32)cs1 ZINC000297685643 1127703979 /nfs/dbraw/zinc/70/39/79/1127703979.db2.gz LRZHDEFSDRJAPV-PWSUYJOCSA-N 1 0 288.416 3.749 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)Cc2ccccn2)cc1 ZINC000298684800 1127729276 /nfs/dbraw/zinc/72/92/76/1127729276.db2.gz UVHAURPWUNTOCF-UHFFFAOYSA-N 1 0 283.419 3.560 20 10 CHCDRO Cc1cc(C[N@@H+](C)Cc2ccccc2O)c(C)s1 ZINC000171937478 1127736011 /nfs/dbraw/zinc/73/60/11/1127736011.db2.gz WXNLGIXMDZQKTN-UHFFFAOYSA-N 1 0 261.390 3.703 20 10 CHCDRO CCC1(C[NH2+][C@H](C)c2cc(F)ccc2O)CCC1 ZINC000230665771 1127770911 /nfs/dbraw/zinc/77/09/11/1127770911.db2.gz WGAJVMWYCCGAJL-LLVKDONJSA-N 1 0 251.345 3.762 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccc2ccccc2c1O)c1cn[nH]c1 ZINC000230669582 1127771022 /nfs/dbraw/zinc/77/10/22/1127771022.db2.gz DCYVUZTYZJFNJR-NEPJUHHUSA-N 1 0 281.359 3.680 20 10 CHCDRO C[C@H]1CCC[C@@H]1C[NH2+]Cc1c(O)cccc1Cl ZINC000230667127 1127771040 /nfs/dbraw/zinc/77/10/40/1127771040.db2.gz NSKAFBHDCSXJPW-WDEREUQCSA-N 1 0 253.773 3.571 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2[C@H]3CCCO[C@H]3C2(C)C)c(O)c1 ZINC000371870202 1127782680 /nfs/dbraw/zinc/78/26/80/1127782680.db2.gz OCKZUCCVJNIPNW-LBRJOISOSA-N 1 0 289.419 3.555 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CS[C@H](C(C)C)C1 ZINC000754120400 1128197030 /nfs/dbraw/zinc/19/70/30/1128197030.db2.gz HOHVIDKUNHRWFQ-WBVHZDCISA-N 1 0 292.492 3.681 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCCC2(CCC2)O1)c1cc(F)ccc1O ZINC000927011918 1128207590 /nfs/dbraw/zinc/20/75/90/1128207590.db2.gz SGZDHWSSNYCBMO-GXTWGEPZSA-N 1 0 293.382 3.674 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCS[C@H](C)C1)c1cc(Cl)ccc1O ZINC000927028459 1128208929 /nfs/dbraw/zinc/20/89/29/1128208929.db2.gz ADDHDUFTMDCXMQ-SCVCMEIPSA-N 1 0 285.840 3.980 20 10 CHCDRO CC(C)C[N@H+](Cc1cc2c(cc1O)CCC2)C1CC1 ZINC000914567073 1128211404 /nfs/dbraw/zinc/21/14/04/1128211404.db2.gz XKFYTXMRIUTQGN-UHFFFAOYSA-N 1 0 259.393 3.501 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](C2CC2)[C@H]2CCCOC2)c(O)c1 ZINC000927069477 1128215784 /nfs/dbraw/zinc/21/57/84/1128215784.db2.gz MZIWWHFHWUWBIW-YEWWUXTCSA-N 1 0 289.419 3.556 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC[C@@H]2CCC3(CCC3)O2)c(O)c1 ZINC000927128860 1128220755 /nfs/dbraw/zinc/22/07/55/1128220755.db2.gz MZUZQGZIZDTFIB-CABCVRRESA-N 1 0 289.419 3.843 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C2([C@@H]3CCCCO3)CC2)c(O)c1C ZINC000927164525 1128223784 /nfs/dbraw/zinc/22/37/84/1128223784.db2.gz XKARLNYJRNCRMX-HOCLYGCPSA-N 1 0 289.419 3.761 20 10 CHCDRO COC/C(C)=C/C[N@H+](Cc1ccccc1O)C1CCCC1 ZINC000929635277 1128280135 /nfs/dbraw/zinc/28/01/35/1128280135.db2.gz IMUKOYSTXTVPMX-RVDMUPIBSA-N 1 0 289.419 3.730 20 10 CHCDRO COc1cc(C)cc(C[N@H+](C)[C@H]2CCC[C@H](C)C2)c1O ZINC000754726805 1128299426 /nfs/dbraw/zinc/29/94/26/1128299426.db2.gz UBUFENZRIUMOPA-WFASDCNBSA-N 1 0 277.408 3.720 20 10 CHCDRO CCCC[N@H+](C/C=C(/C)COC)Cc1ccccc1O ZINC000930350654 1128315311 /nfs/dbraw/zinc/31/53/11/1128315311.db2.gz ILJFVXHVRNDVCL-GDNBJRDFSA-N 1 0 277.408 3.587 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C2Cc3ccccc3C2)c(O)c1C ZINC000762781910 1128317775 /nfs/dbraw/zinc/31/77/75/1128317775.db2.gz SPLLUMHBLKRBDM-CQSZACIVSA-N 1 0 281.399 3.827 20 10 CHCDRO C[C@H]1CC[N@H+](Cc2c(O)ccc3ccccc32)C[C@H]1F ZINC000777970802 1128351508 /nfs/dbraw/zinc/35/15/08/1128351508.db2.gz WGQRSYNCWHOPDA-BLLLJJGKSA-N 1 0 273.351 3.725 20 10 CHCDRO COc1cc(C)cc(C[N@H+]2Cc3ccccc3[C@@H](C)C2)c1O ZINC000915838550 1128351615 /nfs/dbraw/zinc/35/16/15/1128351615.db2.gz GJEMMTWYMKCEQK-AWEZNQCLSA-N 1 0 297.398 3.829 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C1CC1)C1CCC1)c1cc(F)ccc1O ZINC000324606573 1128389962 /nfs/dbraw/zinc/38/99/62/1128389962.db2.gz BJRZXUUFPGHJAE-QLJPJBMISA-N 1 0 263.356 3.761 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C[C@@H]2CCC(C)(C)O2)cc1 ZINC000778207851 1128447487 /nfs/dbraw/zinc/44/74/87/1128447487.db2.gz ABEBYSWRUVBEQN-KRWDZBQOSA-N 1 0 290.451 3.580 20 10 CHCDRO C[C@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1ccccc1O ZINC000780793298 1128451797 /nfs/dbraw/zinc/45/17/97/1128451797.db2.gz LCBADQPOALYTCU-JQWIXIFHSA-N 1 0 273.298 3.555 20 10 CHCDRO CCC[C@H](C)CC[C@@H](C)[NH2+]Cc1ccc(O)cc1O ZINC001257467233 1128456681 /nfs/dbraw/zinc/45/66/81/1128456681.db2.gz HQHTZRYEEZRHAS-QWHCGFSZSA-N 1 0 265.397 3.792 20 10 CHCDRO CC[C@H](C[NH2+]Cc1ccc2c(c1)CCO2)c1ccccc1 ZINC000917392619 1128496889 /nfs/dbraw/zinc/49/68/89/1128496889.db2.gz DXBNQKMUCGMUBL-MRXNPFEDSA-N 1 0 281.399 3.905 20 10 CHCDRO C[N@H+](CCCc1ccccc1)Cc1cc2c(cc1O)CCC2 ZINC000917455014 1128501052 /nfs/dbraw/zinc/50/10/52/1128501052.db2.gz DOPVJDLEUMJFSL-UHFFFAOYSA-N 1 0 295.426 3.946 20 10 CHCDRO Cc1cc(C[NH+]2CCSCC2)c(O)c(C(C)(C)C)c1 ZINC000917469601 1128501580 /nfs/dbraw/zinc/50/15/80/1128501580.db2.gz WSTQOJDEPOWKHY-UHFFFAOYSA-N 1 0 279.449 3.547 20 10 CHCDRO CCc1cccc(C[N@@H+]2CCc3ccc(C)cc3C2)c1O ZINC001206585538 1128522276 /nfs/dbraw/zinc/52/22/76/1128522276.db2.gz UTSFVJINBRIVKX-UHFFFAOYSA-N 1 0 281.399 3.821 20 10 CHCDRO C[C@@H]([NH2+]Cc1nccs1)c1ccc2ccccc2c1O ZINC000041011680 1128533405 /nfs/dbraw/zinc/53/34/05/1128533405.db2.gz DHSJLVGUSWVCNO-LLVKDONJSA-N 1 0 284.384 3.853 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCCC[C@H]2C)c1 ZINC000042856719 1128587498 /nfs/dbraw/zinc/58/74/98/1128587498.db2.gz STZNTCSHOHHFMQ-RDBSUJKOSA-N 1 0 277.408 3.878 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCCC[C@H]2C)c1 ZINC000042856713 1128587730 /nfs/dbraw/zinc/58/77/30/1128587730.db2.gz STZNTCSHOHHFMQ-HZSPNIEDSA-N 1 0 277.408 3.878 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)Cc1ccc(O)cc1)c1ccccc1O ZINC000155668601 1128610739 /nfs/dbraw/zinc/61/07/39/1128610739.db2.gz GVXNRXFZMBCYGZ-SUMWQHHRSA-N 1 0 285.387 3.770 20 10 CHCDRO CN1CCCc2cc(CN3CCCCC(F)(F)C3)ccc21 ZINC001138355051 1128624995 /nfs/dbraw/zinc/62/49/95/1128624995.db2.gz ZZQMQARENAOGHT-UHFFFAOYSA-N 1 0 294.389 3.690 20 10 CHCDRO CC[C@H]([NH2+][C@H](CCO)C1CCCCC1)c1ccccc1O ZINC000156411036 1128636033 /nfs/dbraw/zinc/63/60/33/1128636033.db2.gz YBIXAVSRZXDXAC-DLBZAZTESA-N 1 0 291.435 3.764 20 10 CHCDRO CC[N@@H+](Cc1cc(C(C)C)c(C)cc1O)C[C@@H]1CCCO1 ZINC000919945650 1128652444 /nfs/dbraw/zinc/65/24/44/1128652444.db2.gz OMHKYUQEUMVQNH-INIZCTEOSA-N 1 0 291.435 3.825 20 10 CHCDRO CCc1cc(C[N@H+](C)C2CC2)c(O)c(C(C)(C)C)c1 ZINC000919938859 1128652927 /nfs/dbraw/zinc/65/29/27/1128652927.db2.gz YBBVSKJDYNCKPX-UHFFFAOYSA-N 1 0 261.409 3.846 20 10 CHCDRO C[C@H]1C[N@H+](Cc2ccccc2O)Cc2ccccc21 ZINC000778995443 1128674682 /nfs/dbraw/zinc/67/46/82/1128674682.db2.gz RSTWTODCVHHRPT-ZDUSSCGKSA-N 1 0 253.345 3.512 20 10 CHCDRO Oc1ccc(F)cc1C[N@H+](Cc1cccc(F)c1)C1CC1 ZINC000778996447 1128675337 /nfs/dbraw/zinc/67/53/37/1128675337.db2.gz PDGVWIDVKFHXIC-UHFFFAOYSA-N 1 0 289.325 3.835 20 10 CHCDRO CC1(C)C[N@H+](Cc2ccccc2O)[C@@H]1c1ccccc1 ZINC000778998905 1128675350 /nfs/dbraw/zinc/67/53/50/1128675350.db2.gz FEKWABHUIMDREI-QGZVFWFLSA-N 1 0 267.372 3.975 20 10 CHCDRO CC(C)[C@@H]1CCC[N@@H+]1Cc1cc2c(cc1O)CCC2 ZINC000920484961 1128684149 /nfs/dbraw/zinc/68/41/49/1128684149.db2.gz LLRYEZKHHWJQIX-INIZCTEOSA-N 1 0 259.393 3.501 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)C1CCSCC1 ZINC000779023888 1128685761 /nfs/dbraw/zinc/68/57/61/1128685761.db2.gz JXWIEWLTFOKSKO-AWEZNQCLSA-N 1 0 292.492 3.682 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2C[C@H](C)OC(C)(C)C2)cc1C(C)C ZINC000920865434 1128693937 /nfs/dbraw/zinc/69/39/37/1128693937.db2.gz CAAMDAAENKGJHB-AWEZNQCLSA-N 1 0 291.435 3.823 20 10 CHCDRO Cc1cc(Br)cc([C@@H](C)[NH2+]CCC2CC2)c1O ZINC000779036340 1128697993 /nfs/dbraw/zinc/69/79/93/1128697993.db2.gz MNSAWQOLPARDON-SNVBAGLBSA-N 1 0 298.224 3.914 20 10 CHCDRO CCc1cc(C[N@H+](CC)CCOC)c(O)c(C(C)(C)C)c1 ZINC000921047228 1128699299 /nfs/dbraw/zinc/69/92/99/1128699299.db2.gz UIECDEYYEBZRTP-UHFFFAOYSA-N 1 0 293.451 3.720 20 10 CHCDRO CCOC[C@H](C)[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000779073567 1128719450 /nfs/dbraw/zinc/71/94/50/1128719450.db2.gz OULAZEJVZUSWSO-HOTGVXAUSA-N 1 0 290.451 3.753 20 10 CHCDRO C[C@@H]1C[C@@H]([NH2+]C[C@@H]2CCC(C)(C)O2)c2c1c(F)ccc2O ZINC000779078459 1128721801 /nfs/dbraw/zinc/72/18/01/1128721801.db2.gz GHNFBFVAPXSAAX-NTZNESFSSA-N 1 0 293.382 3.627 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]C1(c2ccc(Cl)cc2)CC1 ZINC000779078558 1128722004 /nfs/dbraw/zinc/72/20/04/1128722004.db2.gz RRJBSBNBBSTRIC-UHFFFAOYSA-N 1 0 291.753 3.964 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCC(C)(C)O2)c(O)c1C ZINC000779079005 1128723157 /nfs/dbraw/zinc/72/31/57/1128723157.db2.gz JSINORCWXMYQMB-KBPBESRZSA-N 1 0 277.408 3.617 20 10 CHCDRO CCC[N@@H+](Cc1ccccc1O)C[C@H](O)c1ccccc1C ZINC000160160287 1117747188 /nfs/dbraw/zinc/74/71/88/1117747188.db2.gz OZZQUVVRVFTPPS-IBGZPJMESA-N 1 0 299.414 3.646 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCc2c(F)cccc2F)c(O)c1 ZINC000185067788 1117759107 /nfs/dbraw/zinc/75/91/07/1117759107.db2.gz CXKNWFMRNHNVFZ-LBPRGKRZSA-N 1 0 291.341 3.872 20 10 CHCDRO Cc1cc(C)c(C[NH2+]Cc2ccc(N(C)C)cc2)cc1C ZINC000035012555 1117759111 /nfs/dbraw/zinc/75/91/11/1117759111.db2.gz RWLATZVIZAZGDV-UHFFFAOYSA-N 1 0 282.431 3.968 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(F)c(F)c1)c1ccccc1O ZINC000049577323 1117782056 /nfs/dbraw/zinc/78/20/56/1117782056.db2.gz JEXDFSQHBZGKIJ-JTQLQIEISA-N 1 0 263.287 3.521 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(C#N)cc2F)c1 ZINC000185377822 1117814402 /nfs/dbraw/zinc/81/44/02/1117814402.db2.gz NFWJSQPNGQPYST-GFCCVEGCSA-N 1 0 284.334 3.562 20 10 CHCDRO CCO[C@@H]1C[C@H]([NH2+][C@@H](C)c2cc(F)ccc2O)C12CCC2 ZINC000185551700 1117844290 /nfs/dbraw/zinc/84/42/90/1117844290.db2.gz NYFCLDBDPWWMRK-KNXALSJPSA-N 1 0 293.382 3.530 20 10 CHCDRO CCC[C@@H](CC)[NH2+]Cc1cc(Br)ccc1O ZINC000163890634 1117905340 /nfs/dbraw/zinc/90/53/40/1117905340.db2.gz HRXKLNXHVVLJJY-GFCCVEGCSA-N 1 0 286.213 3.823 20 10 CHCDRO C[C@@H]1CCC[N@H+](Cc2cc3c(cc2O)CCC3)CC1 ZINC000748081656 1117923415 /nfs/dbraw/zinc/92/34/15/1117923415.db2.gz BICAPOFLWQLOFV-CYBMUJFWSA-N 1 0 259.393 3.503 20 10 CHCDRO CC[C@@H](O)C[N@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000179646425 1128751968 /nfs/dbraw/zinc/75/19/68/1128751968.db2.gz MJSQBUXBCPQAHC-MAUKXSAKSA-N 1 0 299.414 3.726 20 10 CHCDRO COc1cccc(C[NH2+][C@H](C)[C@H]2CC3CCC2CC3)c1O ZINC000382126138 1118097034 /nfs/dbraw/zinc/09/70/34/1118097034.db2.gz MFADNZJWMDQRGP-UWLZSVRSSA-N 1 0 289.419 3.705 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CCS[C@@H]2CCCC[C@H]21 ZINC000769497431 1118106109 /nfs/dbraw/zinc/10/61/09/1118106109.db2.gz DOGRWRZGNSYTNB-UKRRQHHQSA-N 1 0 297.851 3.906 20 10 CHCDRO CN(C)c1ccc(C2=CCC[NH2+]CC2)cc1C(F)(F)F ZINC001238944165 1118106694 /nfs/dbraw/zinc/10/66/94/1118106694.db2.gz FXOXPJSWZLTKSU-UHFFFAOYSA-N 1 0 284.325 3.538 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2CS[C@H](C(C)(C)C)C2)cc1 ZINC000754129437 1118108786 /nfs/dbraw/zinc/10/87/86/1118108786.db2.gz QCXOXWSHJCXNBN-HOCLYGCPSA-N 1 0 292.492 3.762 20 10 CHCDRO Cc1cc(C[N@H+]2CCO[C@H](C)[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC000765098299 1118134947 /nfs/dbraw/zinc/13/49/47/1118134947.db2.gz GITHWOWKYGYYHN-ZIAGYGMSSA-N 1 0 291.435 3.607 20 10 CHCDRO C[C@@H](CSC(C)(C)C)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000765474028 1118155285 /nfs/dbraw/zinc/15/52/85/1118155285.db2.gz KWKPZOYLNXXDSY-LBPRGKRZSA-N 1 0 298.471 3.902 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cc(F)cc(F)c1 ZINC000765608670 1118182318 /nfs/dbraw/zinc/18/23/18/1118182318.db2.gz ITJKZEZLNWNUOD-NSHDSACASA-N 1 0 289.325 3.751 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCc3[nH]c4ccccc4c3C2)c1 ZINC000179849606 1128762898 /nfs/dbraw/zinc/76/28/98/1128762898.db2.gz KRBNQGFDRFVRDH-UHFFFAOYSA-N 1 0 292.382 3.740 20 10 CHCDRO Cc1cc(C)cc(C[NH2+][C@H](C)c2ccccc2O)c1 ZINC000693131059 1118219008 /nfs/dbraw/zinc/21/90/08/1118219008.db2.gz MEDNRVSMXNKSPT-CQSZACIVSA-N 1 0 255.361 3.860 20 10 CHCDRO COc1cnccc1[C@@H](C)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000188784433 1128765486 /nfs/dbraw/zinc/76/54/86/1128765486.db2.gz FZOPBZKCVNAPFZ-UONOGXRCSA-N 1 0 299.418 3.568 20 10 CHCDRO C[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1cc(F)ccc1O ZINC000179893756 1128764302 /nfs/dbraw/zinc/76/43/02/1128764302.db2.gz KZGWAULFKDECOT-NSHDSACASA-N 1 0 277.314 3.863 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CC[C@@H](F)C(F)(F)CC2)c1O ZINC001140178789 1118242045 /nfs/dbraw/zinc/24/20/45/1118242045.db2.gz XQEBZPFZLGWBSF-CYBMUJFWSA-N 1 0 287.325 3.578 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CC[C@@H]3CCC[C@H]3C2)c1O ZINC001140181945 1118246747 /nfs/dbraw/zinc/24/67/47/1118246747.db2.gz XXUSRHARAXGKIM-GJZGRUSLSA-N 1 0 259.393 3.631 20 10 CHCDRO CC[C@H](C)C[NH2+][C@@H](C)Cc1ccc(N(C)C)cc1C ZINC001651228326 1118265640 /nfs/dbraw/zinc/26/56/40/1118265640.db2.gz VAXNMZWUVIHICM-ZFWWWQNUSA-N 1 0 262.441 3.628 20 10 CHCDRO CCOc1cccc(C[NH2+]Cc2ccc(Cl)s2)c1O ZINC000070937895 1118271770 /nfs/dbraw/zinc/27/17/70/1118271770.db2.gz YMGKOPIOWMVJFP-UHFFFAOYSA-N 1 0 297.807 3.796 20 10 CHCDRO CCC[N@H+](Cc1ccccc1O)Cc1cccc(C)c1O ZINC000179929262 1128768345 /nfs/dbraw/zinc/76/83/45/1128768345.db2.gz MWCFAIGAZFWCLP-UHFFFAOYSA-N 1 0 285.387 3.818 20 10 CHCDRO Cc1cc(C)cc(C[NH2+][C@H]2CCc3cccc(O)c32)c1 ZINC000693192800 1118369469 /nfs/dbraw/zinc/36/94/69/1118369469.db2.gz KJOWMDATNNUODE-INIZCTEOSA-N 1 0 267.372 3.786 20 10 CHCDRO COc1ccc(C[NH2+]Cc2cc(C)cc(C)c2)cc1C ZINC000237212049 1118492180 /nfs/dbraw/zinc/49/21/80/1118492180.db2.gz KJUZYBRMNNRBEC-UHFFFAOYSA-N 1 0 269.388 3.910 20 10 CHCDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]CCc1cscn1 ZINC000111627243 1118523155 /nfs/dbraw/zinc/52/31/55/1118523155.db2.gz UMVBSBDZBDWEIG-AAEUAGOBSA-N 1 0 288.416 3.538 20 10 CHCDRO CC(C)CC1([NH2+]Cc2c(O)cccc2Br)CC1 ZINC000706853847 1118552767 /nfs/dbraw/zinc/55/27/67/1118552767.db2.gz BXGLZFCOHAMXCU-UHFFFAOYSA-N 1 0 298.224 3.823 20 10 CHCDRO CSCC[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000069430839 1118572728 /nfs/dbraw/zinc/57/27/28/1118572728.db2.gz APWLSWGVJWJXSV-NSHDSACASA-N 1 0 261.390 3.559 20 10 CHCDRO CC1CCC([NH2+]Cc2cc(Br)ccc2O)CC1 ZINC000109873258 1118586291 /nfs/dbraw/zinc/58/62/91/1118586291.db2.gz VRYUBKHRPHPARB-UHFFFAOYSA-N 1 0 298.224 3.823 20 10 CHCDRO COc1cccc(C[NH2+][C@@H](C)CCC(C)(C)C)c1O ZINC000076768609 1128788482 /nfs/dbraw/zinc/78/84/82/1128788482.db2.gz XFVAUSIEKFTIFN-LBPRGKRZSA-N 1 0 265.397 3.705 20 10 CHCDRO C[N@H+](Cc1ccsc1)Cc1ccc(Cl)cc1O ZINC001140466222 1118751438 /nfs/dbraw/zinc/75/14/38/1118751438.db2.gz BSIYCVAWOQVLCE-UHFFFAOYSA-N 1 0 267.781 3.739 20 10 CHCDRO Oc1cc(Cl)ccc1C[N@@H+]1CCC[C@@H](C(F)(F)F)C1 ZINC001140467244 1118753350 /nfs/dbraw/zinc/75/33/50/1118753350.db2.gz RIJQJHSQZFWCCM-SNVBAGLBSA-N 1 0 293.716 3.820 20 10 CHCDRO CCC[N@H+](Cc1cnn(C2CCC2)c1)Cc1ccccc1O ZINC000891853323 1118804180 /nfs/dbraw/zinc/80/41/80/1118804180.db2.gz ITJSLXPEKDQPRI-UHFFFAOYSA-N 1 0 299.418 3.726 20 10 CHCDRO COc1ccc(C[NH2+]CCC2CC(F)(F)C2)cc1C ZINC000835059833 1118834328 /nfs/dbraw/zinc/83/43/28/1118834328.db2.gz DYIQPADQMQQUDF-UHFFFAOYSA-N 1 0 269.335 3.529 20 10 CHCDRO Cc1nc(C(C)(C)[NH2+]Cc2cc(F)ccc2O)sc1C ZINC000180743249 1128804401 /nfs/dbraw/zinc/80/44/01/1128804401.db2.gz URLHTMDKHUQRCP-UHFFFAOYSA-N 1 0 294.395 3.630 20 10 CHCDRO CC[C@H]1CCCC[C@H]1[NH2+]Cc1cc(F)ccc1O ZINC000226584035 1119212079 /nfs/dbraw/zinc/21/20/79/1119212079.db2.gz DIAJHERTUMQGHO-SMDDNHRTSA-N 1 0 251.345 3.590 20 10 CHCDRO C[C@@H]([NH2+]Cc1cccc(N(C)C)c1)c1ccc(N(C)C)cc1 ZINC000119856791 1119223629 /nfs/dbraw/zinc/22/36/29/1119223629.db2.gz YVDJNZIYMUGHPD-OAHLLOKOSA-N 1 0 297.446 3.669 20 10 CHCDRO CC(C)Oc1ccc(N2C(C)(C)CC([NH3+])CC2(C)C)cc1 ZINC001167624205 1119230289 /nfs/dbraw/zinc/23/02/89/1119230289.db2.gz BQJHLIADTASLJO-UHFFFAOYSA-N 1 0 290.451 3.959 20 10 CHCDRO COc1ccc(C[N@H+](C)Cc2cc(C)c(C)cc2O)cc1C ZINC000728560663 1119337784 /nfs/dbraw/zinc/33/77/84/1119337784.db2.gz SRKXXJBHEJKFIZ-UHFFFAOYSA-N 1 0 299.414 3.958 20 10 CHCDRO CC(C)(C)c1cc(O)c(O)c(C[N@@H+]2CCC[C@H]2C2CC2)c1 ZINC000728562208 1119339278 /nfs/dbraw/zinc/33/92/78/1119339278.db2.gz IJXJBNKQVGVQJA-HNNXBMFYSA-N 1 0 289.419 3.770 20 10 CHCDRO COc1cc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)ccc1C ZINC000161781068 1119379545 /nfs/dbraw/zinc/37/95/45/1119379545.db2.gz ZDEGTFTZFYOQCC-OAHLLOKOSA-N 1 0 298.430 3.920 20 10 CHCDRO Cc1cccc(C[NH2+][C@H]2CCC[C@@H](C(F)(F)F)C2)c1O ZINC000158097642 1119432211 /nfs/dbraw/zinc/43/22/11/1119432211.db2.gz MZRNSZQIRMLLMK-OLZOCXBDSA-N 1 0 287.325 3.911 20 10 CHCDRO C[C@H]1CCC[C@H](C[NH2+]Cc2ccc3c(c2)CCO3)C1 ZINC000219471239 1119472175 /nfs/dbraw/zinc/47/21/75/1119472175.db2.gz BJSBRMLGPDMRTL-KBPBESRZSA-N 1 0 259.393 3.537 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)o1 ZINC000053036509 1119531557 /nfs/dbraw/zinc/53/15/57/1119531557.db2.gz WCDUHWANWYXLBQ-CYBMUJFWSA-N 1 0 258.365 3.505 20 10 CHCDRO Cc1cccc(CC[NH2+][C@@H](C)c2cc(Cl)ccc2O)n1 ZINC000279928408 1119632184 /nfs/dbraw/zinc/63/21/84/1119632184.db2.gz APDJPRNQVNDZFE-LBPRGKRZSA-N 1 0 290.794 3.642 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)[C@@H](C)c1cccc(OC)c1 ZINC000179560965 1119750802 /nfs/dbraw/zinc/75/08/02/1119750802.db2.gz QRKZJINVRVWFFN-AWEZNQCLSA-N 1 0 285.387 3.984 20 10 CHCDRO CSc1ccc(C[NH2+][C@@H](C)c2ccccc2O)cc1 ZINC000179887210 1119791040 /nfs/dbraw/zinc/79/10/40/1119791040.db2.gz LQSDIXSZKAQKMV-LBPRGKRZSA-N 1 0 273.401 3.965 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCC[C@@H]2C[C@@H]21)c1cc(F)ccc1O ZINC000694376815 1119892003 /nfs/dbraw/zinc/89/20/03/1119892003.db2.gz SGYNBUWCOUCRSC-OXIQGZBJSA-N 1 0 263.356 3.618 20 10 CHCDRO C[C@@H]([NH2+]C[C@@]1(C)CC1(F)F)c1ccc(Cl)cc1O ZINC000850536155 1119973310 /nfs/dbraw/zinc/97/33/10/1119973310.db2.gz HPMWFPDXXMFWGO-PRHODGIISA-N 1 0 275.726 3.742 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCCC(F)(F)C1)c1ccc(N(C)C)cc1 ZINC000695064584 1120099558 /nfs/dbraw/zinc/09/95/58/1120099558.db2.gz GFBUNNTUYVMQFH-TZMCWYRMSA-N 1 0 282.378 3.981 20 10 CHCDRO Cc1oc(C(C)(C)C)cc1C[NH2+]Cc1ccccc1O ZINC000892793135 1120142521 /nfs/dbraw/zinc/14/25/21/1120142521.db2.gz WQKPPDFQUBXHTB-UHFFFAOYSA-N 1 0 273.376 3.881 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCCOC(C)(C)C)c1 ZINC000695279090 1120182797 /nfs/dbraw/zinc/18/27/97/1120182797.db2.gz GSJLDUPNEPNZID-ZDUSSCGKSA-N 1 0 265.397 3.556 20 10 CHCDRO Fc1ccc(C[NH2+]Cc2ccc3c(c2)CCO3)cc1Cl ZINC000053149011 1120183722 /nfs/dbraw/zinc/18/37/22/1120183722.db2.gz GYESZMOHYOGFCB-UHFFFAOYSA-N 1 0 291.753 3.704 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2ncccc2c1)c1ccccc1O ZINC000186462871 1120204563 /nfs/dbraw/zinc/20/45/63/1120204563.db2.gz YOVIRVBKVXFVSK-ZDUSSCGKSA-N 1 0 278.355 3.791 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)CCCO2)c1ccncc1 ZINC000921774703 1120207586 /nfs/dbraw/zinc/20/75/86/1120207586.db2.gz AJWDCISMFQADSW-QGZVFWFLSA-N 1 0 282.387 3.648 20 10 CHCDRO CCC(CC)[C@@H](O)C[NH2+][C@@H](C)c1ccc(N(C)CC)cc1 ZINC000765921784 1120209991 /nfs/dbraw/zinc/20/99/91/1120209991.db2.gz LTMFHHFBPYMVLD-KSSFIOAISA-N 1 0 292.467 3.590 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)Cc2ccccc2C)c1 ZINC000314478014 1120218690 /nfs/dbraw/zinc/21/86/90/1120218690.db2.gz OUHRJOACTFEUMT-CABCVRRESA-N 1 0 299.414 3.991 20 10 CHCDRO COc1cccc(C[N@@H+]2CCc3sccc3[C@@H]2C)c1O ZINC000271018992 1120226175 /nfs/dbraw/zinc/22/61/75/1120226175.db2.gz AYZAPYHKWGZKDK-NSHDSACASA-N 1 0 289.400 3.582 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CC(C)(C)OC1(C)C)c1cc(F)ccc1O ZINC000186500143 1120241723 /nfs/dbraw/zinc/24/17/23/1120241723.db2.gz OSBFLTMPTTVRQG-YGRLFVJLSA-N 1 0 281.371 3.528 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1cn[nH]c1)c1ccc(N2CCCCC2)cc1 ZINC000271460993 1120254374 /nfs/dbraw/zinc/25/43/74/1120254374.db2.gz HJKONTUCBAHXAP-CABCVRRESA-N 1 0 298.434 3.812 20 10 CHCDRO CC[C@H]([NH2+]CCCCOC(C)C)c1ccc(N(C)C)cc1 ZINC000180457467 1120275431 /nfs/dbraw/zinc/27/54/31/1120275431.db2.gz OUIJVQWLZJCCOT-SFHVURJKSA-N 1 0 292.467 3.999 20 10 CHCDRO CCCCN(C)CC[NH2+][C@@H](C)c1ccc(N(C)CC)cc1 ZINC000765954128 1120281385 /nfs/dbraw/zinc/28/13/85/1120281385.db2.gz WGOIZKZYILUYKJ-INIZCTEOSA-N 1 0 291.483 3.525 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CC2CCSCC2)cc1 ZINC000765959449 1120295339 /nfs/dbraw/zinc/29/53/39/1120295339.db2.gz FOSKQVDXNHQABU-CQSZACIVSA-N 1 0 292.492 3.937 20 10 CHCDRO Cc1ccncc1[C@@H](C)[NH2+]Cc1ccc2c(c1)CCCO2 ZINC000921960396 1120306897 /nfs/dbraw/zinc/30/68/97/1120306897.db2.gz LNJKOJPASGDJAY-CQSZACIVSA-N 1 0 282.387 3.566 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCc2ccccc21)c1ccccc1O ZINC000182790965 1120328442 /nfs/dbraw/zinc/32/84/42/1120328442.db2.gz XZCCCKDIQWNOPN-ZFWWWQNUSA-N 1 0 267.372 3.773 20 10 CHCDRO COC[C@H]1CCCC[N@@H+]1Cc1cccc(C(C)(C)C)c1O ZINC001143103382 1120346444 /nfs/dbraw/zinc/34/64/44/1120346444.db2.gz BJKREWIWTWYPDU-OAHLLOKOSA-N 1 0 291.435 3.691 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCOc2ccccc2C)c1 ZINC000756482709 1120370484 /nfs/dbraw/zinc/37/04/84/1120370484.db2.gz KAXMCXLAXLPWMJ-OAHLLOKOSA-N 1 0 285.387 3.739 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCCO[C@@H]2C(C)C)c(O)c1 ZINC000186093613 1120391012 /nfs/dbraw/zinc/39/10/12/1120391012.db2.gz PGJLGILSQLLRBW-HDMKZQKVSA-N 1 0 291.435 3.802 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]C1CCC3(CC3)CC1)CC2 ZINC000695716605 1120405290 /nfs/dbraw/zinc/40/52/90/1120405290.db2.gz LFEZIKUZFBANFE-AWEZNQCLSA-N 1 0 257.377 3.692 20 10 CHCDRO CC(C)C1(C[NH2+]Cc2ccc(N3CCCC3)cc2)CC1 ZINC000227833565 1120465396 /nfs/dbraw/zinc/46/53/96/1120465396.db2.gz DHQWVEPBXULZFY-UHFFFAOYSA-N 1 0 272.436 3.813 20 10 CHCDRO C[C@@H]1CSCC[N@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000192180412 1120535587 /nfs/dbraw/zinc/53/55/87/1120535587.db2.gz LUKWZUZNSUDZMF-ZDUSSCGKSA-N 1 0 287.428 3.730 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2ccccc2)c1 ZINC000019878470 1120542601 /nfs/dbraw/zinc/54/26/01/1120542601.db2.gz UWIMAOKJYMYHKY-CHWSQXEVSA-N 1 0 271.360 3.813 20 10 CHCDRO COc1ccccc1[C@@H](C)[NH2+][C@H](C)c1ccccc1O ZINC000020096745 1120583936 /nfs/dbraw/zinc/58/39/36/1120583936.db2.gz BTASRJDHHMNLDA-CHWSQXEVSA-N 1 0 271.360 3.813 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+]C/C=C\c2ccc(N(C)C)cc2)CCS1 ZINC000922837243 1120607530 /nfs/dbraw/zinc/60/75/30/1120607530.db2.gz GNPVDTCRZDIJMF-RCELQXLSSA-N 1 0 290.476 3.640 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+][C@@H]1CCSC2(CCC2)C1 ZINC000922845305 1120612329 /nfs/dbraw/zinc/61/23/29/1120612329.db2.gz LZQNCNSKDGBMHC-CYBMUJFWSA-N 1 0 297.851 3.954 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]CCSc1ccccc1)CC2 ZINC000312888304 1120653549 /nfs/dbraw/zinc/65/35/49/1120653549.db2.gz WGSWRWBDWIMRKB-HNNXBMFYSA-N 1 0 285.412 3.761 20 10 CHCDRO C[C@@H]([NH2+]CCCSc1nccs1)c1ccoc1 ZINC000178463555 1120842047 /nfs/dbraw/zinc/84/20/47/1120842047.db2.gz JFVYASKVCOIFCI-SNVBAGLBSA-N 1 0 268.407 3.569 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1C[C@H]1C)c1cc(Br)ccc1O ZINC000252966495 1120873565 /nfs/dbraw/zinc/87/35/65/1120873565.db2.gz SRVODLWKADLVGN-NRUUGDAUSA-N 1 0 298.224 3.851 20 10 CHCDRO C[N@@H+](Cc1cc(-c2ccccc2)ccc1O)C[C@@H]1CCOC1 ZINC000093839873 1120887282 /nfs/dbraw/zinc/88/72/82/1120887282.db2.gz WMEBTUYZOWJATP-HNNXBMFYSA-N 1 0 297.398 3.528 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCN2CCCC[C@H]2C)c(O)c1C ZINC000756418226 1121032368 /nfs/dbraw/zinc/03/23/68/1121032368.db2.gz QJTWSUHIZXOBRV-ZBFHGGJFSA-N 1 0 290.451 3.534 20 10 CHCDRO COCc1cccc(C[NH2+][C@@H](C)c2ccc(C)cc2O)c1 ZINC000038010617 1121094589 /nfs/dbraw/zinc/09/45/89/1121094589.db2.gz SWXZPZKGBYEGPY-AWEZNQCLSA-N 1 0 285.387 3.698 20 10 CHCDRO CCc1cnccc1[C@H](C)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000773427286 1121099546 /nfs/dbraw/zinc/09/95/46/1121099546.db2.gz JSEQGDBVGPXDJD-AWEZNQCLSA-N 1 0 283.419 3.561 20 10 CHCDRO C[C@H]([NH2+]CCCSc1nccs1)[C@H]1CC1(C)C ZINC000785473303 1121157935 /nfs/dbraw/zinc/15/79/35/1121157935.db2.gz MDNXTXOIWOGIJW-WDEREUQCSA-N 1 0 270.467 3.650 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(F)cc2C)c1 ZINC000182413526 1128968764 /nfs/dbraw/zinc/96/87/64/1128968764.db2.gz DBOONZRPVHKRTC-LBPRGKRZSA-N 1 0 289.350 3.699 20 10 CHCDRO CCCC[N@H+](Cc1nccs1)Cc1ccccc1O ZINC000282523038 1121201615 /nfs/dbraw/zinc/20/16/15/1121201615.db2.gz UCIMARYUIQEPAU-UHFFFAOYSA-N 1 0 276.405 3.651 20 10 CHCDRO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000066236445 1121202897 /nfs/dbraw/zinc/20/28/97/1121202897.db2.gz MVFGKDCSALDCTP-HNNXBMFYSA-N 1 0 298.430 3.920 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@@H]1CCC[C@@H](C)O1 ZINC001203162004 1121227232 /nfs/dbraw/zinc/22/72/32/1121227232.db2.gz VBDIUTDTZFPIFL-HIFRSBDPSA-N 1 0 286.419 3.534 20 10 CHCDRO C[C@@H]([NH2+]C[C@@]1(C)CCCO1)c1ccc2ccccc2c1O ZINC000094797012 1121229112 /nfs/dbraw/zinc/22/91/12/1121229112.db2.gz VAYKFYBWPBQYJI-FZKQIMNGSA-N 1 0 285.387 3.765 20 10 CHCDRO CC(C)CC[C@@](C)(O)C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000766128969 1121290602 /nfs/dbraw/zinc/29/06/02/1121290602.db2.gz NPDDBPXJPHWFQA-CRAIPNDOSA-N 1 0 292.467 3.590 20 10 CHCDRO C[C@@H]1CCC[C@@H](C)[NH+]1Cc1c(O)ccc(F)c1Cl ZINC001237121026 1128980896 /nfs/dbraw/zinc/98/08/96/1128980896.db2.gz JYJNNXKZMPLLAM-NXEZZACHSA-N 1 0 271.763 3.948 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)C1(C)CC1 ZINC000706906028 1121444852 /nfs/dbraw/zinc/44/48/52/1121444852.db2.gz ROXSHYLHBISTPU-HNNXBMFYSA-N 1 0 272.436 3.955 20 10 CHCDRO C[C@@H](c1cccc(O)c1)[N@H+](C)Cc1cc(F)cc(F)c1[O-] ZINC000894017969 1121454423 /nfs/dbraw/zinc/45/44/23/1121454423.db2.gz UWSKTKIJVMWRHB-JTQLQIEISA-N 1 0 293.313 3.569 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1CCC2(CCC2)O1)c1ccccc1O ZINC000711458525 1121536878 /nfs/dbraw/zinc/53/68/78/1121536878.db2.gz XNCNFHDMQAIDLC-DZGCQCFKSA-N 1 0 275.392 3.535 20 10 CHCDRO Cc1cc(Cl)nc(C[NH2+]Cc2c(O)cccc2Cl)c1 ZINC000800283427 1121557506 /nfs/dbraw/zinc/55/75/06/1121557506.db2.gz SBCAIOUZKUSGFA-UHFFFAOYSA-N 1 0 297.185 3.692 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C2CCC(F)(F)CC2)c1 ZINC000688504118 1129004352 /nfs/dbraw/zinc/00/43/52/1129004352.db2.gz SMWAGCKVEHQJEC-NSHDSACASA-N 1 0 269.335 3.929 20 10 CHCDRO C[C@@H]1CCCC[C@H]1C[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001177575484 1121739688 /nfs/dbraw/zinc/73/96/88/1121739688.db2.gz JNJTYXJXXSBFST-OLZOCXBDSA-N 1 0 296.405 3.947 20 10 CHCDRO COCc1cccc(C[N@H+](C)Cc2ccc(N(C)C)cc2)c1 ZINC000178864581 1121784462 /nfs/dbraw/zinc/78/44/62/1121784462.db2.gz UOHALTLTJGKDFK-UHFFFAOYSA-N 1 0 298.430 3.531 20 10 CHCDRO CCN(C)c1ccc(C[N@H+](C)[C@H](C)c2ccco2)cc1 ZINC000773746623 1121790524 /nfs/dbraw/zinc/79/05/24/1121790524.db2.gz NBMDDLYBJOLQKP-CQSZACIVSA-N 1 0 272.392 3.929 20 10 CHCDRO CCC[N@@H+](Cc1cc(C)c(C)cc1O)C[C@H]1CCCCO1 ZINC000730255799 1121800661 /nfs/dbraw/zinc/80/06/61/1121800661.db2.gz JKJFTMPVLYSPRR-QGZVFWFLSA-N 1 0 291.435 3.790 20 10 CHCDRO CC(C)[N@H+](C)Cc1ccc(OCc2ccccc2)cc1O ZINC000182942732 1129012763 /nfs/dbraw/zinc/01/27/63/1129012763.db2.gz VVNSKAQWRNGBRT-UHFFFAOYSA-N 1 0 285.387 3.811 20 10 CHCDRO CC[C@](C)([NH2+]Cc1ccc(N(C)C)c(F)c1)C1CC1 ZINC001179184313 1121853681 /nfs/dbraw/zinc/85/36/81/1121853681.db2.gz YBVQDTLPLCHXDE-INIZCTEOSA-N 1 0 264.388 3.560 20 10 CHCDRO COc1cc(C[NH2+][C@@]2(C)CC2(C)C)c(O)c(C(C)(C)C)c1 ZINC001179217253 1121859855 /nfs/dbraw/zinc/85/98/55/1121859855.db2.gz XIETYXQVOFODHA-SFHVURJKSA-N 1 0 291.435 3.977 20 10 CHCDRO Cc1cc(O)c(C[NH2+]Cc2cccc(F)c2F)c(Cl)c1 ZINC001179294771 1121867899 /nfs/dbraw/zinc/86/78/99/1121867899.db2.gz FVWUDQFBDCDGHY-UHFFFAOYSA-N 1 0 297.732 3.922 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+][C@@H]2C[C@@H]3CCCC[C@H]23)cc1 ZINC001179464466 1121881319 /nfs/dbraw/zinc/88/13/19/1121881319.db2.gz RHYPWWLXLUHYHK-FLUCXVNESA-N 1 0 284.447 3.934 20 10 CHCDRO COc1ccc(C[NH2+]C[C@@H]2CCc3ccccc32)cc1C ZINC000732229870 1121911740 /nfs/dbraw/zinc/91/17/40/1121911740.db2.gz MQVBIMRSSFFRNT-KRWDZBQOSA-N 1 0 281.399 3.823 20 10 CHCDRO CSC[C@H]1CCC[N@@H+]1Cc1c(O)cc(C)cc1Cl ZINC001179854988 1121916874 /nfs/dbraw/zinc/91/68/74/1121916874.db2.gz LXIJXIZAKLBOJG-LLVKDONJSA-N 1 0 285.840 3.681 20 10 CHCDRO CC[C@H]1CCC[N@@H+]1C/C=C\c1ccc(N(C)C)cc1 ZINC001179863578 1121920737 /nfs/dbraw/zinc/92/07/37/1121920737.db2.gz PMPSOVFHVQGDGL-WRLNGNIRSA-N 1 0 258.409 3.640 20 10 CHCDRO Cc1cc(O)c(C[N@H+](CCCO)CC(C)(C)C)cc1Cl ZINC001180006634 1121936384 /nfs/dbraw/zinc/93/63/84/1121936384.db2.gz HKYOSYUIIPHOPY-UHFFFAOYSA-N 1 0 299.842 3.585 20 10 CHCDRO C[C@@H]1CCC[N@H+](C/C=C\c2ccc(N(C)C)cc2)CC1 ZINC001180030806 1121938706 /nfs/dbraw/zinc/93/87/06/1121938706.db2.gz PXPDJNDDNWTKFV-GMNBZTITSA-N 1 0 272.436 3.888 20 10 CHCDRO Cc1ncc(C[N@@H+](C)Cc2cc(C(C)C)ccc2O)s1 ZINC001180042561 1121942605 /nfs/dbraw/zinc/94/26/05/1121942605.db2.gz DMZMPGFYUPEBRF-UHFFFAOYSA-N 1 0 290.432 3.913 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]Cc2cc(C)ccc2O)cc1 ZINC000733324829 1121975484 /nfs/dbraw/zinc/97/54/84/1121975484.db2.gz DWDPFGKRTNESBH-UHFFFAOYSA-N 1 0 298.430 3.837 20 10 CHCDRO CCCC[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000733323300 1121976154 /nfs/dbraw/zinc/97/61/54/1121976154.db2.gz XQBWBMUBNPWIKH-UHFFFAOYSA-N 1 0 255.361 3.949 20 10 CHCDRO CCCCOCC[N@H+](Cc1ccccc1O)C1CCCC1 ZINC000733613764 1122001440 /nfs/dbraw/zinc/00/14/40/1122001440.db2.gz KSPNADHIWWXPTI-UHFFFAOYSA-N 1 0 291.435 3.954 20 10 CHCDRO Cc1ncsc1C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC000071212513 1122032897 /nfs/dbraw/zinc/03/28/97/1122032897.db2.gz IPKKCWLUXQBJBE-ZYHUDNBSSA-N 1 0 288.416 3.804 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2CCC[C@@H]2C(C)C)c1 ZINC001181544817 1122061498 /nfs/dbraw/zinc/06/14/98/1122061498.db2.gz ZTQIRMUAAVETIN-BJJXKVORSA-N 1 0 277.408 3.876 20 10 CHCDRO CCc1cccc(C[NH+]2CC(C3CCCC3)C2)c1O ZINC001182227515 1122120688 /nfs/dbraw/zinc/12/06/88/1122120688.db2.gz OOSJOVLSTVAWIZ-UHFFFAOYSA-N 1 0 259.393 3.577 20 10 CHCDRO CCc1cc(NCc2ccccc2O)c2ccccc2[nH+]1 ZINC000774524426 1122179623 /nfs/dbraw/zinc/17/96/23/1122179623.db2.gz SSSFCMQASAHBRT-UHFFFAOYSA-N 1 0 278.355 3.537 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+][C@@H]2CCOC3(CCC3)C2)c1O ZINC000271876965 1122180324 /nfs/dbraw/zinc/18/03/24/1122180324.db2.gz ZPCKNULJECZIPA-CQSZACIVSA-N 1 0 295.810 3.545 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+][C@@H]1CC[C@@H]1C1CCC1 ZINC001182684099 1122182222 /nfs/dbraw/zinc/18/22/22/1122182222.db2.gz JQSHMMCAZGMGIM-ZIAGYGMSSA-N 1 0 265.784 3.714 20 10 CHCDRO COc1cc(C)cc(C[NH+]2CCC(C3CCC3)CC2)c1O ZINC001182805634 1122187813 /nfs/dbraw/zinc/18/78/13/1122187813.db2.gz GFCJIIOFWXRSEH-UHFFFAOYSA-N 1 0 289.419 3.721 20 10 CHCDRO CC1(C)CCC(C)([NH2+]Cc2cc(F)ccc2O)CC1 ZINC001183323751 1122217165 /nfs/dbraw/zinc/21/71/65/1122217165.db2.gz DXHOURHHVGGKEL-UHFFFAOYSA-N 1 0 265.372 3.980 20 10 CHCDRO Cc1ccc(C[NH+]2CC([C@H]3CCC[C@@H](C)C3)C2)c(O)c1 ZINC001183441908 1122223421 /nfs/dbraw/zinc/22/34/21/1122223421.db2.gz BDDMGHRZCZOZPG-HIFRSBDPSA-N 1 0 273.420 3.959 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCc2ccc(O)cc2)c(O)c1C ZINC000273301192 1122226749 /nfs/dbraw/zinc/22/67/49/1122226749.db2.gz BOASVZWVMNMGFZ-AWEZNQCLSA-N 1 0 285.387 3.608 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC2([C@H](C)CCO)CCC2)c(O)c1 ZINC000273347154 1122229495 /nfs/dbraw/zinc/22/94/95/1122229495.db2.gz AZWJHQLDCYWWAX-CABCVRRESA-N 1 0 291.435 3.540 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc3c(c2)OCO3)c(O)c1C ZINC000273384101 1122230605 /nfs/dbraw/zinc/23/06/05/1122230605.db2.gz JAHVRGNCMWFHGD-CYBMUJFWSA-N 1 0 299.370 3.589 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc([C@@H](C)O)cc2)c(O)c1C ZINC000273383909 1122230804 /nfs/dbraw/zinc/23/08/04/1122230804.db2.gz IWODSZLTXMLLIU-LSDHHAIUSA-N 1 0 299.414 3.913 20 10 CHCDRO Cc1csc(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)n1 ZINC000273394081 1122231405 /nfs/dbraw/zinc/23/14/05/1122231405.db2.gz LOZHOLMSHWLXMO-GFCCVEGCSA-N 1 0 276.405 3.625 20 10 CHCDRO COc1cccc(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)c1 ZINC000273390343 1122231655 /nfs/dbraw/zinc/23/16/55/1122231655.db2.gz KOBGJEBFFCLNPI-CQSZACIVSA-N 1 0 285.387 3.868 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCCCOC(C)C)c(O)c1C ZINC000273404356 1122231706 /nfs/dbraw/zinc/23/17/06/1122231706.db2.gz GZDGIXSEPBMWQG-HNNXBMFYSA-N 1 0 279.424 3.865 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2cccnc2)c(O)c1C ZINC000273412847 1122231858 /nfs/dbraw/zinc/23/18/58/1122231858.db2.gz QEENPNDNHXCAHI-ZIAGYGMSSA-N 1 0 270.376 3.816 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCO[C@@H](C(C)(C)C)C2)c1 ZINC000273483348 1122235218 /nfs/dbraw/zinc/23/52/18/1122235218.db2.gz MRCSZSIJKNWHLA-JJRVBVJISA-N 1 0 291.435 3.945 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@](C)(O)c2ccccc2)c(O)c1C ZINC000273575674 1122238754 /nfs/dbraw/zinc/23/87/54/1122238754.db2.gz LSSIXGCFXDSPQO-BEFAXECRSA-N 1 0 299.414 3.567 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@](C)(O)c2ccccc2)c(O)c1C ZINC000273575676 1122238802 /nfs/dbraw/zinc/23/88/02/1122238802.db2.gz LSSIXGCFXDSPQO-HNAYVOBHSA-N 1 0 299.414 3.567 20 10 CHCDRO CCCC[C@@H](C)[C@H](C)[NH2+]Cc1c([O-])cccc1F ZINC001183918659 1122248402 /nfs/dbraw/zinc/24/84/02/1122248402.db2.gz BETWXKUEOLOTSF-NEPJUHHUSA-N 1 0 253.361 3.836 20 10 CHCDRO CC1(C[N@@H+](Cc2ccccc2O)C[C@@H]2CCCO2)CCC1 ZINC000774819881 1122317953 /nfs/dbraw/zinc/31/79/53/1122317953.db2.gz APXHJSVRUCMRMU-INIZCTEOSA-N 1 0 289.419 3.563 20 10 CHCDRO Cc1cccc(C[NH2+]Cc2ccc3ncccc3c2)c1O ZINC000192979638 1129049151 /nfs/dbraw/zinc/04/91/51/1129049151.db2.gz RIDGSGHTKQIETD-UHFFFAOYSA-N 1 0 278.355 3.539 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@]2(C)CCCS2)c(O)c1 ZINC000133962489 1122438092 /nfs/dbraw/zinc/43/80/92/1122438092.db2.gz LSKRTNKOCNHFSD-SWLSCSKDSA-N 1 0 265.422 3.637 20 10 CHCDRO CCCN(Cc1ccc(Cl)o1)c1ccc(C[NH3+])cc1 ZINC000775139446 1122439455 /nfs/dbraw/zinc/43/94/55/1122439455.db2.gz AZNAJBBZTXLBJB-UHFFFAOYSA-N 1 0 278.783 3.808 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@H]1CS[C@@H](C(C)C)C1 ZINC000775141090 1122440368 /nfs/dbraw/zinc/44/03/68/1122440368.db2.gz VZOAMGVNJUBOQV-IAGOWNOFSA-N 1 0 292.492 3.892 20 10 CHCDRO CCCN(C[C@@H]1CC=CCC1)c1ccc(C[NH3+])cc1 ZINC000775141175 1122440568 /nfs/dbraw/zinc/44/05/68/1122440568.db2.gz XNDQQPCVAWUWBN-MRXNPFEDSA-N 1 0 258.409 3.718 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@H](C)CCc1ccco1 ZINC000775141054 1122440634 /nfs/dbraw/zinc/44/06/34/1122440634.db2.gz VKVITSZVWMEOAU-OAHLLOKOSA-N 1 0 286.419 3.976 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)C1CC(OC(C)(C)C)C1 ZINC000775141028 1122440661 /nfs/dbraw/zinc/44/06/61/1122440661.db2.gz UJCDWOVCCSCJDL-UHFFFAOYSA-N 1 0 290.451 3.708 20 10 CHCDRO Cc1ccc(F)c(C[N@H+](C)Cc2cccc(C)c2O)c1 ZINC000775169451 1122466794 /nfs/dbraw/zinc/46/67/94/1122466794.db2.gz XHKATVZWLQJOIB-UHFFFAOYSA-N 1 0 273.351 3.780 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+]CCC(C)(C)F)c1O ZINC000827189900 1122481989 /nfs/dbraw/zinc/48/19/89/1122481989.db2.gz OKWQPFSQHOXELL-UHFFFAOYSA-N 1 0 259.752 3.582 20 10 CHCDRO C[C@@H]([NH2+]Cc1cccnc1Cl)c1ccc(N(C)C)cc1 ZINC000775363329 1122527989 /nfs/dbraw/zinc/52/79/89/1122527989.db2.gz MVRGCSRWHVKKSN-GFCCVEGCSA-N 1 0 289.810 3.652 20 10 CHCDRO Cc1cccc(O[C@H](C)C[NH2+][C@@H](C)c2ccccc2O)c1 ZINC000183533715 1129060855 /nfs/dbraw/zinc/06/08/55/1129060855.db2.gz YNMMOZNNJXCJAT-CABCVRRESA-N 1 0 285.387 3.819 20 10 CHCDRO CCO[C@@H]1C[C@@H]([NH2+][C@@H](C)c2ccccc2O)C12CCCC2 ZINC000183537975 1129061129 /nfs/dbraw/zinc/06/11/29/1129061129.db2.gz QKQSUIJRXQZVQO-IAOVAPTHSA-N 1 0 289.419 3.781 20 10 CHCDRO C[C@@H](C[NH2+][C@@H](C)c1ccccc1O)Cc1cccs1 ZINC000183531621 1129061819 /nfs/dbraw/zinc/06/18/19/1129061819.db2.gz ISXQVXIEVWROQI-OLZOCXBDSA-N 1 0 275.417 3.983 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccc(C)cc1)c1ccccc1O ZINC000775412537 1122554840 /nfs/dbraw/zinc/55/48/40/1122554840.db2.gz OAGLFLVNRBXTKQ-QGZVFWFLSA-N 1 0 269.388 3.984 20 10 CHCDRO CC[C@H]([NH2+]Cc1cccc(F)c1F)c1ccccc1O ZINC000775413769 1122555844 /nfs/dbraw/zinc/55/58/44/1122555844.db2.gz AQKDBMGJBGUWTI-AWEZNQCLSA-N 1 0 277.314 3.911 20 10 CHCDRO CCc1cccc(C[NH2+][C@@H]2C[C@@H]3CCCC[C@H]23)c1O ZINC000712359116 1122560536 /nfs/dbraw/zinc/56/05/36/1122560536.db2.gz FRKSFNPRKZFAHO-CWRNSKLLSA-N 1 0 259.393 3.623 20 10 CHCDRO COc1ccc([C@H](C)[NH2+]Cc2cc(C)ccc2O)cc1F ZINC000071407669 1129062638 /nfs/dbraw/zinc/06/26/38/1129062638.db2.gz NLUVTXJZIYCIFV-LBPRGKRZSA-N 1 0 289.350 3.699 20 10 CHCDRO CC[C@@H]([NH2+]CCN1CCCCC1)c1cc(Cl)ccc1O ZINC000775486888 1122616658 /nfs/dbraw/zinc/61/66/58/1122616658.db2.gz JANRDMBLZKETKV-OAHLLOKOSA-N 1 0 296.842 3.572 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1CCCCO1)c1cc(Cl)ccc1O ZINC000775490805 1122619126 /nfs/dbraw/zinc/61/91/26/1122619126.db2.gz XHWIBMKHWXYHGP-GXTWGEPZSA-N 1 0 283.799 3.655 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccc(F)cc1F)c1ccccc1O ZINC000775503557 1122630821 /nfs/dbraw/zinc/63/08/21/1122630821.db2.gz JFZKUOLCLUQOPF-INIZCTEOSA-N 1 0 291.341 3.954 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCC[C@H](O)C1)c1cc(Cl)ccc1O ZINC000775508379 1122631027 /nfs/dbraw/zinc/63/10/27/1122631027.db2.gz BOTLXBFAWXZTFF-ZLDLUXBVSA-N 1 0 297.826 3.637 20 10 CHCDRO CC[C@H]([NH2+]C[C@@]1(C)CCCO1)c1cc(Cl)ccc1O ZINC000775514138 1122634305 /nfs/dbraw/zinc/63/43/05/1122634305.db2.gz XEYAHOMBODMLNG-DZGCQCFKSA-N 1 0 283.799 3.655 20 10 CHCDRO CC[C@H]([NH2+]CCc1cscn1)c1cc(Cl)ccc1O ZINC000775513028 1122634337 /nfs/dbraw/zinc/63/43/37/1122634337.db2.gz DXTGEOSSNXZBDA-ZDUSSCGKSA-N 1 0 296.823 3.786 20 10 CHCDRO CC[C@H]([NH2+]Cc1nc2cc(C)ccc2[nH]1)c1ccccc1O ZINC000775512379 1122634605 /nfs/dbraw/zinc/63/46/05/1122634605.db2.gz KGPGMBUSNYIIPN-AWEZNQCLSA-N 1 0 295.386 3.818 20 10 CHCDRO C[N@H+](Cc1ccc(F)c(Cl)c1)Cc1cc(F)ccc1O ZINC000763624530 1129070830 /nfs/dbraw/zinc/07/08/30/1129070830.db2.gz XPIOELIVGGVXKA-UHFFFAOYSA-N 1 0 297.732 3.956 20 10 CHCDRO CC[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(N(C)C)c(C)c1 ZINC001193402154 1122688360 /nfs/dbraw/zinc/68/83/60/1122688360.db2.gz QSAGDEJYOSLROK-CVEARBPZSA-N 1 0 260.425 3.729 20 10 CHCDRO CC(C)(C)OC1CC(CC[NH2+]Cc2cc(F)ccc2O)C1 ZINC000763627810 1129077872 /nfs/dbraw/zinc/07/78/72/1129077872.db2.gz VFKYTNJBATYAMF-UHFFFAOYSA-N 1 0 295.398 3.605 20 10 CHCDRO CC[N@H+](Cc1ccccc1)Cc1cccc(C)c1O ZINC000775638873 1122845546 /nfs/dbraw/zinc/84/55/46/1122845546.db2.gz OPCYWXVUYFIOFZ-UHFFFAOYSA-N 1 0 255.361 3.723 20 10 CHCDRO CCc1ccc(C[N@H+](C)Cc2cc(OC)ccc2O)cc1 ZINC000775643125 1122851295 /nfs/dbraw/zinc/85/12/95/1122851295.db2.gz UBTKZLFAPJMSDM-UHFFFAOYSA-N 1 0 285.387 3.595 20 10 CHCDRO COc1ccc(O)c(C[N@H+]2Cc3ccccc3[C@H](C)C2)c1 ZINC000775645702 1122853018 /nfs/dbraw/zinc/85/30/18/1122853018.db2.gz FSOHEDZHXPRHBV-CYBMUJFWSA-N 1 0 283.371 3.520 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCc3sccc3[C@H]2C)c1O ZINC000775646014 1122856201 /nfs/dbraw/zinc/85/62/01/1122856201.db2.gz FEAHBRNYLAOVHG-GFCCVEGCSA-N 1 0 273.401 3.881 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)c(C)c1)[C@H]1CC1(C)C ZINC001195280418 1122859846 /nfs/dbraw/zinc/85/98/46/1122859846.db2.gz STTLZWWPFQRBIC-HZPDHXFCSA-N 1 0 274.452 3.975 20 10 CHCDRO Cc1cc(Br)cc(C[N@@H+](C)[C@H](C)C2CC2)c1O ZINC000775649395 1122863286 /nfs/dbraw/zinc/86/32/86/1122863286.db2.gz KCYZGWFDSHEGKM-SNVBAGLBSA-N 1 0 298.224 3.693 20 10 CHCDRO CCCSC[C@@H](C)[NH2+][C@@H](C)c1cc(OC)ccc1O ZINC000894502274 1122865855 /nfs/dbraw/zinc/86/58/55/1122865855.db2.gz OUFAWNWNRUVGGR-NEPJUHHUSA-N 1 0 283.437 3.583 20 10 CHCDRO Cc1cccc(C[N@H+](C)CCCOc2ccccc2)c1O ZINC000775654622 1122868596 /nfs/dbraw/zinc/86/85/96/1122868596.db2.gz MYMQWQDOPCGVNT-UHFFFAOYSA-N 1 0 285.387 3.602 20 10 CHCDRO COc1cc(C)cc(C[NH2+]C[C@@H]2CCCC(F)(F)C2)c1O ZINC000894664940 1122887475 /nfs/dbraw/zinc/88/74/75/1122887475.db2.gz JISPBOLFXZXBFN-GFCCVEGCSA-N 1 0 299.361 3.624 20 10 CHCDRO CCOc1ccc(N(CC)CCC[C@@H]2CCOC2)cc1 ZINC001167982982 1122902303 /nfs/dbraw/zinc/90/23/03/1122902303.db2.gz IERQRFATLAQJFY-OAHLLOKOSA-N 1 0 277.408 3.728 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+](C)CCC2CC2)c1O ZINC000775740335 1122930228 /nfs/dbraw/zinc/93/02/28/1122930228.db2.gz VBIVKDNXOPKPGJ-UHFFFAOYSA-N 1 0 253.773 3.586 20 10 CHCDRO COc1cc(C)cc(C[NH2+]C[C@H]2CCCCC2(F)F)c1O ZINC000894873452 1123004194 /nfs/dbraw/zinc/00/41/94/1123004194.db2.gz LXZXHBAEVJQULK-CYBMUJFWSA-N 1 0 299.361 3.624 20 10 CHCDRO C[C@H]1[C@H](C(F)(F)F)CCC[N@@H+]1Cc1ccccc1O ZINC000776014049 1123035172 /nfs/dbraw/zinc/03/51/72/1123035172.db2.gz QGVSAHASFPGBQN-CMPLNLGQSA-N 1 0 273.298 3.555 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]C2(C3CCC3)CCC2)c1 ZINC000839186853 1123042802 /nfs/dbraw/zinc/04/28/02/1123042802.db2.gz PQUCIJRAAQNDEH-UHFFFAOYSA-N 1 0 275.392 3.603 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)CCc2ccc(O)cc2)cc1C ZINC000237158054 1123096096 /nfs/dbraw/zinc/09/60/96/1123096096.db2.gz FWDXOLXRPHGQOD-OAHLLOKOSA-N 1 0 299.414 3.820 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]CCCc1cccc(F)c1 ZINC000776170498 1123100686 /nfs/dbraw/zinc/10/06/86/1123100686.db2.gz UZHKAYYRMALTTK-UHFFFAOYSA-N 1 0 293.769 3.907 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+][C@@H](C)c2cccnc2)c1O ZINC000776175199 1123102614 /nfs/dbraw/zinc/10/26/14/1123102614.db2.gz YIRMSHKTNFVDME-NSHDSACASA-N 1 0 276.767 3.600 20 10 CHCDRO COc1ccc2c(c1)c1c(n2C)CC[N@@H+](CCC(C)C)C1 ZINC001201624060 1123132744 /nfs/dbraw/zinc/13/27/44/1123132744.db2.gz TXZDADSGEPJQJY-UHFFFAOYSA-N 1 0 286.419 3.591 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)CCCc2ccccc2)cc1 ZINC001201672684 1123133927 /nfs/dbraw/zinc/13/39/27/1123133927.db2.gz VLXPGJPXCNDCNA-UHFFFAOYSA-N 1 0 282.431 3.817 20 10 CHCDRO COc1ccc(O)c(C[NH2+]C[C@H](C)c2ccc(C)cc2)c1 ZINC000776208659 1123148468 /nfs/dbraw/zinc/14/84/68/1123148468.db2.gz JBGJNJXZMISSIC-AWEZNQCLSA-N 1 0 285.387 3.603 20 10 CHCDRO Cc1cccc(C[NH2+][C@H](C)[C@H]2Oc3ccccc3[C@H]2C)c1O ZINC000776230453 1123159452 /nfs/dbraw/zinc/15/94/52/1123159452.db2.gz ITQPILMLPXRSQT-LPMFXHHGSA-N 1 0 297.398 3.743 20 10 CHCDRO COc1ccc2c(c1)c1c(n2C)CC[N@@H+](CC2CCCC2)C1 ZINC001202167391 1123180451 /nfs/dbraw/zinc/18/04/51/1123180451.db2.gz XIRGMMQFUMVYCG-UHFFFAOYSA-N 1 0 298.430 3.735 20 10 CHCDRO CCCN(CCC)c1ccc(C[NH2+][C@H](CC)[C@@H](C)O)cc1 ZINC001202381515 1123204370 /nfs/dbraw/zinc/20/43/70/1123204370.db2.gz OSEMNMLXBJDLHQ-CRAIPNDOSA-N 1 0 292.467 3.562 20 10 CHCDRO CCOCc1cc(C[NH2+]CCC2=CCCC2)ccc1OC ZINC000179014173 1123232170 /nfs/dbraw/zinc/23/21/70/1123232170.db2.gz JPUOTVFPHBQYSD-UHFFFAOYSA-N 1 0 289.419 3.822 20 10 CHCDRO COc1cc(C[NH2+]CCCCF)c(O)c(C(C)(C)C)c1 ZINC000850306758 1123252206 /nfs/dbraw/zinc/25/22/06/1123252206.db2.gz RNPAFQSZZIGNLN-UHFFFAOYSA-N 1 0 283.387 3.538 20 10 CHCDRO COc1cc(C[NH2+][C@H]2C=CCC2)c(O)c(C(C)(C)C)c1 ZINC000850359896 1123256741 /nfs/dbraw/zinc/25/67/41/1123256741.db2.gz VPFCRPPQBBKKEH-ZDUSSCGKSA-N 1 0 275.392 3.507 20 10 CHCDRO CCOCc1cc(C[NH2+][C@]2(C)CC2(C)C)ccc1OC ZINC000850399169 1123262475 /nfs/dbraw/zinc/26/24/75/1123262475.db2.gz IBWQTOOVUPJEJI-QGZVFWFLSA-N 1 0 277.408 3.510 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]CCCc2ccco2)cc1 ZINC000850408033 1123264617 /nfs/dbraw/zinc/26/46/17/1123264617.db2.gz VSZCAKVWHMFALA-ZZXKWVIFSA-N 1 0 284.403 3.581 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCN2C(C)(C)C)c(O)c1C ZINC000850480542 1123273155 /nfs/dbraw/zinc/27/31/55/1123273155.db2.gz BXCNYDXUWSLXBF-HUUCEWRRSA-N 1 0 290.451 3.532 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H](C)c2ccccn2)c(O)c1C ZINC000850482022 1123273374 /nfs/dbraw/zinc/27/33/74/1123273374.db2.gz MAIZCGBUWFTVBX-ZFWWWQNUSA-N 1 0 284.403 3.858 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCC2CC(OC)C2)cc1 ZINC000850481450 1123273510 /nfs/dbraw/zinc/27/35/10/1123273510.db2.gz LJJLDCWTIYZUNW-KSTDHSDQSA-N 1 0 290.451 3.608 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCN(C(C)(C)C)C1)c1ccc(Cl)cc1O ZINC000850495291 1123275132 /nfs/dbraw/zinc/27/51/32/1123275132.db2.gz ZLDMRYHPUUYNSQ-YPMHNXCESA-N 1 0 296.842 3.569 20 10 CHCDRO CC[C@H](COCC1CC1)[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000850493856 1123275444 /nfs/dbraw/zinc/27/54/44/1123275444.db2.gz LOKYKDATOSLIPR-DZGCQCFKSA-N 1 0 277.408 3.556 20 10 CHCDRO CSCC1(CC[NH2+][C@@H]2CCc3cccc(O)c32)CC1 ZINC000850507474 1123277377 /nfs/dbraw/zinc/27/73/77/1123277377.db2.gz OKKXWMQNEAEMIC-CYBMUJFWSA-N 1 0 277.433 3.502 20 10 CHCDRO CCO[C@H]1C[C@H]([NH2+][C@H](C)c2cc(Cl)cc(C)c2O)C1 ZINC000850515347 1123278980 /nfs/dbraw/zinc/27/89/80/1123278980.db2.gz WUPADWCTQPIVCE-RAIGVLPGSA-N 1 0 283.799 3.572 20 10 CHCDRO CCO[C@H]1C[C@H]([NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)C1 ZINC000850515346 1123279192 /nfs/dbraw/zinc/27/91/92/1123279192.db2.gz WUPADWCTQPIVCE-DRZSPHRISA-N 1 0 283.799 3.572 20 10 CHCDRO C[C@H]([NH2+][C@@H]1C[C@H](O)c2ccccc21)c1ccc(N(C)C)cc1 ZINC000850527621 1123282694 /nfs/dbraw/zinc/28/26/94/1123282694.db2.gz AYPSYUFURNHUMF-BKTGTZMESA-N 1 0 296.414 3.582 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CCCOC(C)(C)C)c(O)c1 ZINC000850527785 1123282852 /nfs/dbraw/zinc/28/28/52/1123282852.db2.gz ZFHOIKIYRNGQBF-AWEZNQCLSA-N 1 0 279.424 3.865 20 10 CHCDRO C[C@@H]1C[C@@H]([NH2+]CCC(C)(C)F)c2c1c(F)ccc2O ZINC000850532286 1123286105 /nfs/dbraw/zinc/28/61/05/1123286105.db2.gz SRMHLLXRFWTJMA-MWLCHTKSSA-N 1 0 269.335 3.807 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCC[C@H](C)O2)c(O)c1C ZINC000850533798 1123286334 /nfs/dbraw/zinc/28/63/34/1123286334.db2.gz CEZMQPPGXWRBKR-AEGPPILISA-N 1 0 277.408 3.617 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]CCc2ccoc2)c1O ZINC000850532776 1123286369 /nfs/dbraw/zinc/28/63/69/1123286369.db2.gz XDZMDRHRTKWUHG-LLVKDONJSA-N 1 0 279.767 3.840 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC[C@]2(C)CC2(F)F)c(O)c1 ZINC000850537669 1123287933 /nfs/dbraw/zinc/28/79/33/1123287933.db2.gz WXTLHDDXDDVSSV-BXUZGUMPSA-N 1 0 269.335 3.787 20 10 CHCDRO C[C@H]([NH2+]C[C@@]1(C)CC1(F)F)c1cc(Cl)ccc1O ZINC000850537327 1123287970 /nfs/dbraw/zinc/28/79/70/1123287970.db2.gz TUQDCHFCEXEFOX-QPUJVOFHSA-N 1 0 275.726 3.742 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2c(C3CCC3)cnn2C)c1 ZINC000850549344 1123289300 /nfs/dbraw/zinc/28/93/00/1123289300.db2.gz GVAFCVSELGGPRW-ZDUSSCGKSA-N 1 0 299.418 3.552 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCc3ccc(O)cc32)c(O)c1 ZINC000850543308 1123289327 /nfs/dbraw/zinc/28/93/27/1123289327.db2.gz HPEUNDOTHRSVMN-PXAZEXFGSA-N 1 0 283.371 3.744 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@H]2C(C)(C)C2(F)F)c(O)c1 ZINC000850552819 1123289938 /nfs/dbraw/zinc/28/99/38/1123289938.db2.gz QBTWUZDTDQGWNK-AAEUAGOBSA-N 1 0 283.362 3.951 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CCCc2ccco2)c(O)c1 ZINC000850569540 1123294174 /nfs/dbraw/zinc/29/41/74/1123294174.db2.gz HPJLHRIQOFJXBT-AWEZNQCLSA-N 1 0 273.376 3.885 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@H]2CCOC2(C)C)c1O ZINC000850570411 1123294321 /nfs/dbraw/zinc/29/43/21/1123294321.db2.gz GYLIRWZCUDAAAC-RYUDHWBXSA-N 1 0 297.826 3.820 20 10 CHCDRO CC[C@H]([NH2+][C@H](c1ccccc1)[C@H](C)O)c1ccccc1O ZINC000850582911 1123295884 /nfs/dbraw/zinc/29/58/84/1123295884.db2.gz HOTIWSBEYJPSRQ-OWQGQXMQSA-N 1 0 285.387 3.555 20 10 CHCDRO CC(C)(C)[C@H]1C[C@H]([NH2+]Cc2cc(Cl)ccc2O)CCO1 ZINC000721827851 1123304303 /nfs/dbraw/zinc/30/43/03/1123304303.db2.gz PXHJBEQYHHKHRU-UKRRQHHQSA-N 1 0 297.826 3.729 20 10 CHCDRO CC[C@@H]([NH2+]CC1(SC)CC1)c1ccc(N(C)C)cc1 ZINC000193817715 1129115563 /nfs/dbraw/zinc/11/55/63/1129115563.db2.gz MIFXXJANERCDTC-OAHLLOKOSA-N 1 0 278.465 3.689 20 10 CHCDRO CCCC[N@H+](Cc1ccccc1O)[C@@H]1CCO[C@H](C)C1 ZINC000852017806 1123392877 /nfs/dbraw/zinc/39/28/77/1123392877.db2.gz GKIATWIRYVNJEF-GDBMZVCRSA-N 1 0 277.408 3.562 20 10 CHCDRO C[N@H+](Cc1cccc(OC(F)F)c1)Cc1ccccc1O ZINC000111234999 1123432482 /nfs/dbraw/zinc/43/24/82/1123432482.db2.gz NWLKRQCGJMVUCJ-UHFFFAOYSA-N 1 0 293.313 3.626 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@@H+]2CCC[C@@H](CCF)C2)c1 ZINC000853564094 1123443937 /nfs/dbraw/zinc/44/39/37/1123443937.db2.gz JNWNAPCDIWICGD-AWEZNQCLSA-N 1 0 265.372 3.581 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCc3cc(N)ccc32)c(O)c1 ZINC000854226891 1123477853 /nfs/dbraw/zinc/47/78/53/1123477853.db2.gz SBDJWBSGYQDJMN-SJCJKPOMSA-N 1 0 282.387 3.621 20 10 CHCDRO CCCN(Cc1ccc(F)c(F)c1)c1ccc(C[NH3+])cc1 ZINC000147632197 1123477992 /nfs/dbraw/zinc/47/79/92/1123477992.db2.gz UDHSUFTUWCHIGS-UHFFFAOYSA-N 1 0 290.357 3.840 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)[C@H]1COc2ccccc2C1)c1ccccc1O ZINC000895851044 1123521860 /nfs/dbraw/zinc/52/18/60/1123521860.db2.gz IIJUPZQVTPKIFR-SQWLQELKSA-N 1 0 297.398 3.683 20 10 CHCDRO CCC[N@@H+](Cc1ccccc1O)C[C@@H]1CCO[C@H](CC)C1 ZINC000780758816 1123544237 /nfs/dbraw/zinc/54/42/37/1123544237.db2.gz WTEZANFHGIOTLU-NVXWUHKLSA-N 1 0 291.435 3.809 20 10 CHCDRO CCc1cccc(C[NH+]2CC(Cc3ccsc3)C2)c1O ZINC000857068411 1123583863 /nfs/dbraw/zinc/58/38/63/1123583863.db2.gz SSUIPEHDGZLKEH-UHFFFAOYSA-N 1 0 287.428 3.691 20 10 CHCDRO CC[C@H]([NH2+]CC[C@H]1CC1(F)F)c1ccc(C)cc1O ZINC000857080643 1123584666 /nfs/dbraw/zinc/58/46/66/1123584666.db2.gz JZBDXYIHDCYYFO-AAEUAGOBSA-N 1 0 269.335 3.787 20 10 CHCDRO COc1ccc(F)c(C[NH2+][C@H](C)c2cc(F)ccc2O)c1 ZINC000857082530 1123585704 /nfs/dbraw/zinc/58/57/04/1123585704.db2.gz WXHWCBYUUCREJM-SNVBAGLBSA-N 1 0 293.313 3.530 20 10 CHCDRO Cc1cc(CC[NH2+]C(C)C)c(C)n1-c1ccccc1 ZINC000857761266 1123619328 /nfs/dbraw/zinc/61/93/28/1123619328.db2.gz ODDBMWKSRMUTCZ-UHFFFAOYSA-N 1 0 256.393 3.635 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CCCC(C)(C)C2)c1O ZINC000228630645 1123634215 /nfs/dbraw/zinc/63/42/15/1123634215.db2.gz GEPNCHFVFXQWAG-UHFFFAOYSA-N 1 0 283.799 3.676 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H](c2ccccn2)C2CCC2)cc1 ZINC000858238578 1123639243 /nfs/dbraw/zinc/63/92/43/1123639243.db2.gz WMTVKSFFMJHATG-LJQANCHMSA-N 1 0 295.430 3.779 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CC[C@@H]2CC=CCC2)c1O ZINC000858515214 1123659125 /nfs/dbraw/zinc/65/91/25/1123659125.db2.gz FKJWJAATZPCPTA-UONOGXRCSA-N 1 0 275.392 3.798 20 10 CHCDRO C[C@H]([NH2+]C[C@]1(C)C[C@H]2C[C@H]2C1)c1cc(F)ccc1O ZINC000858538192 1123660994 /nfs/dbraw/zinc/66/09/94/1123660994.db2.gz SXYLUNMDFJIYIM-OVZMXSCWSA-N 1 0 263.356 3.618 20 10 CHCDRO CC[C@@H]([NH2+]C[C@]1(C)C[C@H]2C[C@H]2C1)c1ccccc1O ZINC000858538918 1123661409 /nfs/dbraw/zinc/66/14/09/1123661409.db2.gz ZATKSKUOWMHZJD-IARIHHJXSA-N 1 0 259.393 3.869 20 10 CHCDRO CO[C@H]1C[C@H]([NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)C1 ZINC000858587095 1123666041 /nfs/dbraw/zinc/66/60/41/1123666041.db2.gz ZYACNOPKHLHOGQ-ZVZYQTTQSA-N 1 0 288.435 3.505 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)Cc2ccc3cc[nH]c3c2)cc1 ZINC000862210694 1123791833 /nfs/dbraw/zinc/79/18/33/1123791833.db2.gz SYDLVRFCAOJCDE-UHFFFAOYSA-N 1 0 293.414 3.866 20 10 CHCDRO CCC[N@H+](Cc1ccccc1O)Cc1ccnc(F)c1C ZINC000862236322 1123794611 /nfs/dbraw/zinc/79/46/11/1123794611.db2.gz AEMCIKBNNWSMTO-UHFFFAOYSA-N 1 0 288.366 3.647 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+][C@H]1CCc2ccc(Cl)cc21 ZINC000862539823 1123818630 /nfs/dbraw/zinc/81/86/30/1123818630.db2.gz WFONBXPPUOSRII-HNNXBMFYSA-N 1 0 291.753 3.962 20 10 CHCDRO CC[C@@H]1OCC[C@H]1[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000840822404 1123828043 /nfs/dbraw/zinc/82/80/43/1123828043.db2.gz UKAXRZNVARJEBJ-VUCTXSBTSA-N 1 0 285.387 3.764 20 10 CHCDRO Cc1cc(C)c(O)c(C[NH+]2C[C@H](C)C(F)(F)[C@@H](C)C2)c1 ZINC000863274030 1123857441 /nfs/dbraw/zinc/85/74/41/1123857441.db2.gz GYNJFEUEYLVXCA-STQMWFEESA-N 1 0 283.362 3.732 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CC3(CCC3)C[C@H]2C)c1O ZINC000763645405 1129149876 /nfs/dbraw/zinc/14/98/76/1129149876.db2.gz FNDXQHQNTCHVNH-CYBMUJFWSA-N 1 0 275.392 3.555 20 10 CHCDRO C[C@H]([NH2+]CCc1ccco1)c1cc2c(cc1O)CCCC2 ZINC000119880364 1123918323 /nfs/dbraw/zinc/91/83/23/1123918323.db2.gz HPUAZHBJZPXSJB-ZDUSSCGKSA-N 1 0 285.387 3.757 20 10 CHCDRO C[N@H+](Cc1c(O)ccc2ccncc21)[C@H]1CCC(C)(C)C1 ZINC000794686837 1123927544 /nfs/dbraw/zinc/92/75/44/1123927544.db2.gz RYLLLQPBGPOWLJ-AWEZNQCLSA-N 1 0 284.403 3.951 20 10 CHCDRO CCCCOCCC[NH2+][C@H](CC)c1ccc(C)cc1O ZINC000794796450 1123949530 /nfs/dbraw/zinc/94/95/30/1123949530.db2.gz UJEPSFTXDIYPSK-MRXNPFEDSA-N 1 0 279.424 3.948 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](C)c1ccncc1)c1ccc(C)cc1O ZINC000794800314 1123950295 /nfs/dbraw/zinc/95/02/95/1123950295.db2.gz CHMGFFZXTFUYEX-YOEHRIQHSA-N 1 0 284.403 3.940 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)CN1CCCCC1)c1ccc(C)cc1O ZINC000794799144 1123950711 /nfs/dbraw/zinc/95/07/11/1123950711.db2.gz ZAWOPKRJJPIWLC-WBVHZDCISA-N 1 0 290.451 3.616 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](C)c1ccncc1)c1ccc(C)cc1O ZINC000794800313 1123951077 /nfs/dbraw/zinc/95/10/77/1123951077.db2.gz CHMGFFZXTFUYEX-WMLDXEAASA-N 1 0 284.403 3.940 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1CCCCN1CC)c1ccc(C)cc1O ZINC000794806994 1123953966 /nfs/dbraw/zinc/95/39/66/1123953966.db2.gz JDDQLSJVUWTYGM-DOTOQJQBSA-N 1 0 290.451 3.616 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](O)c1ccccc1C)c1ccc(C)cc1O ZINC000794806393 1123955776 /nfs/dbraw/zinc/95/57/76/1123955776.db2.gz IGRZQFFERPBBPV-HKUYNNGSSA-N 1 0 299.414 3.783 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1ccc[nH]1)c1ccc(C)cc1O ZINC000794814689 1123958116 /nfs/dbraw/zinc/95/81/16/1123958116.db2.gz HYCCHVUKPLDRPD-OCCSQVGLSA-N 1 0 258.365 3.831 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1CCCS1)c1ccc(C)cc1O ZINC000794812535 1123959252 /nfs/dbraw/zinc/95/92/52/1123959252.db2.gz XCPIDPKFDAHLGN-GXTWGEPZSA-N 1 0 265.422 3.637 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCC(C)(C)O1)c1ccc(C)cc1O ZINC000794818972 1123960490 /nfs/dbraw/zinc/96/04/90/1123960490.db2.gz ZWSOTYIGKUXIIK-HIFRSBDPSA-N 1 0 277.408 3.699 20 10 CHCDRO C[C@@H]([NH2+]Cc1cccnc1F)c1ccc2ccccc2c1O ZINC000794834249 1123964733 /nfs/dbraw/zinc/96/47/33/1123964733.db2.gz HYXVKSXCIVUIIG-GFCCVEGCSA-N 1 0 296.345 3.930 20 10 CHCDRO Cc1ccc2[nH+]ccc(N(C)Cc3ccccc3O)c2c1 ZINC000302683742 1123977357 /nfs/dbraw/zinc/97/73/57/1123977357.db2.gz XQWWOVNCHWYLME-UHFFFAOYSA-N 1 0 278.355 3.885 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H]2CCO[C@H]2c2ccccc2)cc1C ZINC000865648579 1124002373 /nfs/dbraw/zinc/00/23/73/1124002373.db2.gz FSHIOLZOSGDIEK-MJGOQNOKSA-N 1 0 297.398 3.629 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2CCC[C@@H](CO)C2)c1O ZINC000840893380 1124006867 /nfs/dbraw/zinc/00/68/67/1124006867.db2.gz GNAIOVYMHIKOEV-OUCADQQQSA-N 1 0 297.826 3.556 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)CCc1cccnc1 ZINC000866268537 1124044706 /nfs/dbraw/zinc/04/47/06/1124044706.db2.gz XWVCYAJZAZYTOF-INIZCTEOSA-N 1 0 297.446 3.567 20 10 CHCDRO C[C@H]([NH2+]CC[C@H]1CCSC1)c1cc(Cl)ccc1O ZINC000866403496 1124063813 /nfs/dbraw/zinc/06/38/13/1124063813.db2.gz QOIZZLQBUPBFNZ-QWRGUYRKSA-N 1 0 285.840 3.839 20 10 CHCDRO COc1cccc(C[NH2+][C@H]2CCC[C@@H]2C(C)(C)C)c1O ZINC000840971619 1124067196 /nfs/dbraw/zinc/06/71/96/1124067196.db2.gz QBEZXLMANHGHRG-KBPBESRZSA-N 1 0 277.408 3.705 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2c3ccccc3CN2C)c(O)c1 ZINC000866562141 1124082082 /nfs/dbraw/zinc/08/20/82/1124082082.db2.gz CRGMOEDQSCWWTF-KDOFPFPSSA-N 1 0 296.414 3.538 20 10 CHCDRO COc1ccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)cc1 ZINC000122784004 1124534381 /nfs/dbraw/zinc/53/43/81/1124534381.db2.gz WNGUGLMYIDQMGR-OAHLLOKOSA-N 1 0 298.430 3.920 20 10 CHCDRO CC[C@H]([NH2+]Cc1c(F)cccc1OC)c1ccccc1O ZINC001120345256 1131273790 /nfs/dbraw/zinc/27/37/90/1131273790.db2.gz SYKKOWOFPKOQSJ-HNNXBMFYSA-N 1 0 289.350 3.781 20 10 CHCDRO C[C@@H]1[C@@H](c2ccccc2)CC[N@@H+]1Cc1ccc(N)cc1 ZINC001120370823 1131274442 /nfs/dbraw/zinc/27/44/42/1131274442.db2.gz GOGFBAGOKGDEHO-KDOFPFPSSA-N 1 0 266.388 3.647 20 10 CHCDRO CC[C@@H]([NH2+]CCC(C)(C)COC)c1ccc(C)cc1O ZINC000872104597 1124682325 /nfs/dbraw/zinc/68/23/25/1124682325.db2.gz KEDSIJGQVDJSJE-OAHLLOKOSA-N 1 0 279.424 3.804 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1ccc(C)cc1O)[C@H](O)c1ccccc1 ZINC000872133306 1124692780 /nfs/dbraw/zinc/69/27/80/1124692780.db2.gz PGJZOZJANRPQFF-UCLAIMLFSA-N 1 0 299.414 3.863 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1nccnc1C)c1ccc(C)cc1O ZINC000872135105 1124693844 /nfs/dbraw/zinc/69/38/44/1124693844.db2.gz VFTHQEHJUVCDNG-DZGCQCFKSA-N 1 0 285.391 3.601 20 10 CHCDRO Oc1ccc2ccncc2c1C[NH+]1CCC(CCF)CC1 ZINC000872647641 1124724039 /nfs/dbraw/zinc/72/40/39/1124724039.db2.gz HOGCDJXFVGYZLR-UHFFFAOYSA-N 1 0 288.366 3.512 20 10 CHCDRO C[C@@H]1CCC[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000124296560 1124732323 /nfs/dbraw/zinc/73/23/23/1124732323.db2.gz HDRIOQCMHDMENF-OAHLLOKOSA-N 1 0 258.409 3.661 20 10 CHCDRO CCCOc1ccc(C[NH2+]Cc2cccc(CO)c2)cc1C ZINC000873047414 1124734494 /nfs/dbraw/zinc/73/44/94/1124734494.db2.gz ZGIRQEZIKRQBBT-UHFFFAOYSA-N 1 0 299.414 3.566 20 10 CHCDRO CCOc1cccc(F)c1C[NH2+]Cc1cc(C)ccc1O ZINC000873143134 1124741256 /nfs/dbraw/zinc/74/12/56/1124741256.db2.gz XWKJOYNCJOWENJ-UHFFFAOYSA-N 1 0 289.350 3.528 20 10 CHCDRO CSC(C)(C)CC[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC000820851909 1131307230 /nfs/dbraw/zinc/30/72/30/1131307230.db2.gz VAFDQMXDONNZLO-UHFFFAOYSA-N 1 0 280.481 3.716 20 10 CHCDRO COc1ccccc1[C@H](C)[NH2+]Cc1cc(Cl)ccc1O ZINC000020096891 1124805504 /nfs/dbraw/zinc/80/55/04/1124805504.db2.gz BDWGMOLXWUOAMF-NSHDSACASA-N 1 0 291.778 3.905 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCc2ccc(F)cc2)c(O)c1 ZINC000020087386 1124805684 /nfs/dbraw/zinc/80/56/84/1124805684.db2.gz WJQSXQLTLHAUFC-CYBMUJFWSA-N 1 0 273.351 3.733 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H](C)CCc2ccco2)c(O)c1 ZINC000020145204 1124809216 /nfs/dbraw/zinc/80/92/16/1124809216.db2.gz FKCDXODLXFUTFN-KGLIPLIRSA-N 1 0 273.376 3.966 20 10 CHCDRO [O-]c1c(Cl)cccc1C[NH2+]Cc1cc(F)ccc1F ZINC000124797999 1124813159 /nfs/dbraw/zinc/81/31/59/1124813159.db2.gz STEVZWGCLXMEIQ-UHFFFAOYSA-N 1 0 283.705 3.614 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C(C)(C)C2CCOCC2)cc1Cl ZINC000825726619 1124832026 /nfs/dbraw/zinc/83/20/26/1124832026.db2.gz UCEDSYPMGLQZRI-UHFFFAOYSA-N 1 0 297.826 3.649 20 10 CHCDRO Cc1ccncc1C[N@@H+](C)Cc1cc(Cl)c(C)cc1O ZINC000825748501 1124853155 /nfs/dbraw/zinc/85/31/55/1124853155.db2.gz CUDYMMXKDQCZME-UHFFFAOYSA-N 1 0 290.794 3.689 20 10 CHCDRO CCN(CC)[C@H](C[NH2+]Cc1ccccc1O)c1ccccc1 ZINC000020826561 1124879107 /nfs/dbraw/zinc/87/91/07/1124879107.db2.gz JJWZZUMFIBUMCS-GOSISDBHSA-N 1 0 298.430 3.565 20 10 CHCDRO c1cc(N2CCCCC2)ccc1C[NH2+]C(C1CC1)C1CC1 ZINC000021506487 1124929174 /nfs/dbraw/zinc/92/91/74/1124929174.db2.gz BVSUEQAFGOPGJX-UHFFFAOYSA-N 1 0 284.447 3.955 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+]1CCCO[C@H](c2ccccc2)C1 ZINC000876684691 1124971178 /nfs/dbraw/zinc/97/11/78/1124971178.db2.gz RDIODIMEKFUUQT-IBGZPJMESA-N 1 0 297.398 3.664 20 10 CHCDRO Cc1ccc(C[N@@H+](C)[C@H](C)c2cccc(O)c2)c(O)c1 ZINC000876721614 1124972675 /nfs/dbraw/zinc/97/26/75/1124972675.db2.gz WFFBULQXLAPAKV-CYBMUJFWSA-N 1 0 271.360 3.599 20 10 CHCDRO CC[N@H+](Cc1ccncc1)Cc1cc(Cl)c(C)cc1O ZINC000825903337 1124979419 /nfs/dbraw/zinc/97/94/19/1124979419.db2.gz DQOGFHJQALJQOX-UHFFFAOYSA-N 1 0 290.794 3.771 20 10 CHCDRO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1ccc(C)cc1O ZINC000876901083 1124988088 /nfs/dbraw/zinc/98/80/88/1124988088.db2.gz YMZMJFPNEFIWJX-CQSZACIVSA-N 1 0 285.387 3.868 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](c2ccccc2)[C@@H]2CCCO2)c(O)c1 ZINC000876976495 1124994881 /nfs/dbraw/zinc/99/48/81/1124994881.db2.gz QLXHYCMXEIMKHP-OALUTQOASA-N 1 0 297.398 3.711 20 10 CHCDRO Cc1ccc(C[NH2+][C@H]2CCCOc3ccccc32)c(O)c1 ZINC000876999787 1124996163 /nfs/dbraw/zinc/99/61/63/1124996163.db2.gz YVWBSKZDMRNRMM-INIZCTEOSA-N 1 0 283.371 3.704 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](c2ncccc2C)C(C)C)c(O)c1 ZINC000877043588 1125001641 /nfs/dbraw/zinc/00/16/41/1125001641.db2.gz KIFZEDOMDGOBEM-QGZVFWFLSA-N 1 0 284.403 3.891 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]C[C@H]1CCCO[C@H]1C(C)(C)C ZINC000877038841 1125001656 /nfs/dbraw/zinc/00/16/56/1125001656.db2.gz ZGROBPVXOFXJOQ-RHSMWYFYSA-N 1 0 291.435 3.632 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)c2ccc(C)c(F)c2)c(O)c1 ZINC000877106608 1125009811 /nfs/dbraw/zinc/00/98/11/1125009811.db2.gz SUUNLFUDUJXNLK-CYBMUJFWSA-N 1 0 273.351 3.999 20 10 CHCDRO Cc1ccc(C[NH2+]C2CCC(OC(C)C)CC2)c(O)c1 ZINC000877114617 1125010667 /nfs/dbraw/zinc/01/06/67/1125010667.db2.gz VWQDGGVYQYDFNH-UHFFFAOYSA-N 1 0 277.408 3.526 20 10 CHCDRO CCC(CC)[C@@H]1C[C@@H]([NH2+]Cc2c(C)cccc2O)CCO1 ZINC000877167487 1125016453 /nfs/dbraw/zinc/01/64/53/1125016453.db2.gz ZOCXYQPRFNBMOK-YJBOKZPZSA-N 1 0 291.435 3.774 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H](c2ccccn2)C2CCC2)c1O ZINC000529646088 1125021833 /nfs/dbraw/zinc/02/18/33/1125021833.db2.gz YUEXIBORKDSOJA-QGZVFWFLSA-N 1 0 282.387 3.727 20 10 CHCDRO Cc1cccc(C[NH2+][C@H](c2ccccn2)C2CCC2)c1O ZINC000529646087 1125022980 /nfs/dbraw/zinc/02/29/80/1125022980.db2.gz YUEXIBORKDSOJA-KRWDZBQOSA-N 1 0 282.387 3.727 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]CCC1CC(OC(C)(C)C)C1 ZINC000877478346 1125033001 /nfs/dbraw/zinc/03/30/01/1125033001.db2.gz NCGADQDUEUPNKC-UHFFFAOYSA-N 1 0 291.435 3.774 20 10 CHCDRO Cc1ccc(C[NH+]2CCC(CC(F)(F)F)CC2)c(O)c1 ZINC000877508229 1125036862 /nfs/dbraw/zinc/03/68/62/1125036862.db2.gz UBBYZBXMNCSNBG-UHFFFAOYSA-N 1 0 287.325 3.865 20 10 CHCDRO COc1cccc([C@H]2C[C@H]([NH2+]Cc3c(C)cccc3O)C2)c1 ZINC000877571891 1125046635 /nfs/dbraw/zinc/04/66/35/1125046635.db2.gz BANWZFYDQDEYSO-WKILWMFISA-N 1 0 297.398 3.745 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](c2ccccn2)C2CCC2)c(O)c1 ZINC000877652741 1125058378 /nfs/dbraw/zinc/05/83/78/1125058378.db2.gz NHOLPWBMLCELCM-GOSISDBHSA-N 1 0 282.387 3.727 20 10 CHCDRO CCc1cccc(C[NH2+]Cc2cccc(F)c2F)c1O ZINC000877673091 1125060838 /nfs/dbraw/zinc/06/08/38/1125060838.db2.gz NGBFYHQPLWKKDW-UHFFFAOYSA-N 1 0 277.314 3.523 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H](C)c2ccccc2O)c(Cl)c1 ZINC000877755911 1125072903 /nfs/dbraw/zinc/07/29/03/1125072903.db2.gz SFXHYJWMCGGSIK-LLVKDONJSA-N 1 0 291.778 3.910 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)c2ccccc2O)cc1C ZINC000877757045 1125074331 /nfs/dbraw/zinc/07/43/31/1125074331.db2.gz CKQRCNISUMZFLE-ZDUSSCGKSA-N 1 0 271.360 3.560 20 10 CHCDRO C[C@@H]([NH2+]CCCF)c1ccc(N2CCCCC2)cc1 ZINC000126835036 1125108956 /nfs/dbraw/zinc/10/89/56/1125108956.db2.gz IUGFVXMTPYDCLM-CQSZACIVSA-N 1 0 264.388 3.687 20 10 CHCDRO C[N@H+](CC[C@@H]1CCCC1(F)F)Cc1ccccc1O ZINC000878241046 1125134196 /nfs/dbraw/zinc/13/41/96/1125134196.db2.gz AAEDBQKJNDKFFI-ZDUSSCGKSA-N 1 0 269.335 3.650 20 10 CHCDRO C[C@@H]([NH2+]CC[C@@H]1CCCC1(F)F)c1ccccc1O ZINC000878354159 1125143728 /nfs/dbraw/zinc/14/37/28/1125143728.db2.gz DAGZETWPKPKODT-NEPJUHHUSA-N 1 0 269.335 3.868 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C)c1ccoc1 ZINC000530413110 1125151085 /nfs/dbraw/zinc/15/10/85/1125151085.db2.gz JQCAXRBKLHTEND-ZDUSSCGKSA-N 1 0 268.360 3.931 20 10 CHCDRO Cc1cc(C)c(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)c(C)n1 ZINC000878455355 1125155218 /nfs/dbraw/zinc/15/52/18/1125155218.db2.gz XAKHQKIHDCFVGT-OAHLLOKOSA-N 1 0 297.446 3.924 20 10 CHCDRO CC(C)Oc1ccccc1C[N@@H+]1CCc2cccc(O)c2C1 ZINC001137139597 1125190253 /nfs/dbraw/zinc/19/02/53/1125190253.db2.gz KGYQVFVPBULVGA-UHFFFAOYSA-N 1 0 297.398 3.738 20 10 CHCDRO C[C@H]([NH2+]Cc1cccc2cccnc21)c1cc(F)ccc1O ZINC000127655344 1125207819 /nfs/dbraw/zinc/20/78/19/1125207819.db2.gz ZPWIZBWHDQRWIK-LBPRGKRZSA-N 1 0 296.345 3.930 20 10 CHCDRO COc1ccc(Cl)c(C[NH2+][C@@H](C)c2ccccc2O)c1 ZINC000879650326 1125223641 /nfs/dbraw/zinc/22/36/41/1125223641.db2.gz UWFFZJOFDBLRJN-NSHDSACASA-N 1 0 291.778 3.905 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CC[C@]3(CC3(F)F)C2)cc1Cl ZINC000826143188 1125252573 /nfs/dbraw/zinc/25/25/73/1125252573.db2.gz UGVYHGQRJZILSK-ZDUSSCGKSA-N 1 0 287.737 3.585 20 10 CHCDRO COc1ccc(O)c(C[N@H+](C)C2CCC(C)(C)CC2)c1 ZINC000211642877 1125313397 /nfs/dbraw/zinc/31/33/97/1125313397.db2.gz JRMGXFAKRUYIQQ-UHFFFAOYSA-N 1 0 277.408 3.801 20 10 CHCDRO CC(C)[C@@H]1CCC[N@@H+]1Cc1c(O)cccc1Cl ZINC000211658847 1125314993 /nfs/dbraw/zinc/31/49/93/1125314993.db2.gz QNONFJSMKQDRCY-ZDUSSCGKSA-N 1 0 253.773 3.666 20 10 CHCDRO CCC[C@H]1CCCC[N@@H+]1Cc1cccc(OCC)c1O ZINC000213582932 1125363656 /nfs/dbraw/zinc/36/36/56/1125363656.db2.gz BQLZWGSWSCWTML-HNNXBMFYSA-N 1 0 277.408 3.946 20 10 CHCDRO C[C@H]([NH2+]CC1CCSCC1)c1ccc(N(C)C)cc1 ZINC000131154669 1125374738 /nfs/dbraw/zinc/37/47/38/1125374738.db2.gz PUMNMHNMGMYLJX-ZDUSSCGKSA-N 1 0 278.465 3.546 20 10 CHCDRO COc1ccc(C[NH2+]CC(C)(C)CC(F)F)cc1C ZINC000883252125 1125385083 /nfs/dbraw/zinc/38/50/83/1125385083.db2.gz SGJCXYYZZHQLEY-UHFFFAOYSA-N 1 0 271.351 3.775 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(C)nc2Cl)c(O)c1 ZINC000883302516 1125393121 /nfs/dbraw/zinc/39/31/21/1125393121.db2.gz ZYKTTZQDOHFOBM-LBPRGKRZSA-N 1 0 290.794 3.908 20 10 CHCDRO COC[C@H]1C[C@@H]([NH2+]Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000883316811 1125395022 /nfs/dbraw/zinc/39/50/22/1125395022.db2.gz KVYABTUIGNLHEB-UJKQEGAGSA-N 1 0 297.398 3.574 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H]2CCC3(CCC3)O2)c(O)c1 ZINC000883357847 1125401446 /nfs/dbraw/zinc/40/14/46/1125401446.db2.gz WFKWOSWZGJCJEN-GJZGRUSLSA-N 1 0 289.419 3.761 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@H]1c3ccccc3CC[C@@H]1F)CC2 ZINC000883378014 1125405102 /nfs/dbraw/zinc/40/51/02/1125405102.db2.gz XVHFLYFTZQYFHA-FCEWJHQRSA-N 1 0 297.373 3.995 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H]2c3ccccc3CC[C@H]2F)c1 ZINC000883383089 1125406700 /nfs/dbraw/zinc/40/67/00/1125406700.db2.gz SSXNJFOEZHXEHZ-AEFFLSMTSA-N 1 0 285.362 3.816 20 10 CHCDRO CC[N@H+](Cc1cc(OC)ccc1O)C1CCCCC1 ZINC000131769170 1125409524 /nfs/dbraw/zinc/40/95/24/1125409524.db2.gz ZRSHIBYOWQIWCM-UHFFFAOYSA-N 1 0 263.381 3.555 20 10 CHCDRO c1csc(SCCC[NH2+][C@@H]2CCc3ccccc32)n1 ZINC000132185372 1125415389 /nfs/dbraw/zinc/41/53/89/1125415389.db2.gz ATKRSRMLKVWEJQ-CQSZACIVSA-N 1 0 290.457 3.902 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CCC[C@H]2C2CCCC2)c1 ZINC000132824637 1125424023 /nfs/dbraw/zinc/42/40/23/1125424023.db2.gz PHYZMHXRTLVOIG-INIZCTEOSA-N 1 0 275.392 3.555 20 10 CHCDRO Cc1cc(C[N@H+](C)Cc2cccc(F)c2)ccc1N(C)C ZINC001139669947 1131357240 /nfs/dbraw/zinc/35/72/40/1131357240.db2.gz QYRFLKAETWTYAV-UHFFFAOYSA-N 1 0 286.394 3.832 20 10 CHCDRO CCOc1cccc(C[NH2+][C@H](C)C[C@H](C)CC)c1O ZINC000088293751 1129202336 /nfs/dbraw/zinc/20/23/36/1129202336.db2.gz KSWVVJXKNGNPHJ-CHWSQXEVSA-N 1 0 265.397 3.705 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H]2CCc3cccc(O)c32)c1 ZINC000295771525 1129219251 /nfs/dbraw/zinc/21/92/51/1129219251.db2.gz AJPRBUWNQQFBIZ-LRDDRELGSA-N 1 0 283.371 3.739 20 10 CHCDRO C[C@H](CCCCO)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000296604041 1129223832 /nfs/dbraw/zinc/22/38/32/1129223832.db2.gz VVSZALOXXDCXEV-ZIAGYGMSSA-N 1 0 287.403 3.747 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2[C@H](C)C[C@@H]3CCCC[C@H]32)c1 ZINC000245865023 1129230314 /nfs/dbraw/zinc/23/03/14/1129230314.db2.gz PSEQHFQVZRPVKW-DVOMOZLQSA-N 1 0 275.392 3.554 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@H](C)CCC=C(C)C)c1 ZINC000089726261 1129249851 /nfs/dbraw/zinc/24/98/51/1129249851.db2.gz ZRXNYBSLTTVHLX-CYBMUJFWSA-N 1 0 263.381 3.625 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(C)c(F)c2)c(O)c1 ZINC000184910148 1129261450 /nfs/dbraw/zinc/26/14/50/1129261450.db2.gz KDGWKPXRPNOHAQ-CYBMUJFWSA-N 1 0 273.351 3.999 20 10 CHCDRO c1oc2ccccc2c1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000734004014 1129291330 /nfs/dbraw/zinc/29/13/30/1129291330.db2.gz HKGSQGFGIOENBB-UHFFFAOYSA-N 1 0 279.339 3.658 20 10 CHCDRO Cc1cc(O)c(C[NH+](CC2CC2)CC2CC2)cc1C ZINC000734478646 1129310974 /nfs/dbraw/zinc/31/09/74/1129310974.db2.gz XWWQHGUOKMDNKE-UHFFFAOYSA-N 1 0 259.393 3.631 20 10 CHCDRO CC[C@H](CSC)[N@H+](C)Cc1cc(C)c(C)cc1O ZINC000091024765 1129341943 /nfs/dbraw/zinc/34/19/43/1129341943.db2.gz CNJPWWXIWILKIW-CQSZACIVSA-N 1 0 267.438 3.582 20 10 CHCDRO C[N@H+](Cc1ccccc1O)Cc1ccccc1OCC1CC1 ZINC000091974542 1129376155 /nfs/dbraw/zinc/37/61/55/1129376155.db2.gz RHHYURQFVRKYMK-UHFFFAOYSA-N 1 0 297.398 3.813 20 10 CHCDRO CCC[N@@H+](Cc1ccccc1O)Cc1cccnc1C ZINC000092705055 1129405040 /nfs/dbraw/zinc/40/50/40/1129405040.db2.gz JEIJFMLGKNLYPX-UHFFFAOYSA-N 1 0 270.376 3.508 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@@H+]2CCC=C(c3ccco3)C2)c1 ZINC000795650995 1129406988 /nfs/dbraw/zinc/40/69/88/1129406988.db2.gz PLCYTOZMWPYPKB-UHFFFAOYSA-N 1 0 283.371 3.891 20 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0 278.327 3.548 20 10 CHCDRO C[C@H]([NH2+]CCCc1ccccc1)c1cc(F)ccc1O ZINC000094616827 1129448288 /nfs/dbraw/zinc/44/82/88/1129448288.db2.gz NWIPSKQJXWVMHQ-ZDUSSCGKSA-N 1 0 273.351 3.815 20 10 CHCDRO CCN(C)c1ccc(C[N@H+](C)Cc2ccc(OC)cc2)cc1 ZINC000741753348 1129451188 /nfs/dbraw/zinc/45/11/88/1129451188.db2.gz VJLIXCZUOLUMOD-UHFFFAOYSA-N 1 0 298.430 3.783 20 10 CHCDRO C[C@H]([NH2+]C[C@@]1(C)CCCO1)c1ccc2ccccc2c1O ZINC000094797011 1129452630 /nfs/dbraw/zinc/45/26/30/1129452630.db2.gz VAYKFYBWPBQYJI-SCLBCKFNSA-N 1 0 285.387 3.765 20 10 CHCDRO Cc1cc(O)c(C[NH2+]Cc2ccc(C)c(F)c2)cc1C ZINC000742366635 1129472415 /nfs/dbraw/zinc/47/24/15/1129472415.db2.gz MXXPBJHYUXTUNV-UHFFFAOYSA-N 1 0 273.351 3.746 20 10 CHCDRO CCOc1cccc(C[NH2+]Cc2c(C)cccc2F)c1O ZINC000742380618 1129472957 /nfs/dbraw/zinc/47/29/57/1129472957.db2.gz HLLWOIGTXKYWLM-UHFFFAOYSA-N 1 0 289.350 3.528 20 10 CHCDRO c1cc(C[NH2+][C@H]2C[C@H]2C2CCCCC2)cc2c1OCC2 ZINC000742375413 1129475437 /nfs/dbraw/zinc/47/54/37/1129475437.db2.gz MHPMXCKHLQIRHO-IRXDYDNUSA-N 1 0 271.404 3.680 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H]2CC[C@@H]3CCC[C@H]3C2)c1 ZINC000742378342 1129476235 /nfs/dbraw/zinc/47/62/35/1129476235.db2.gz FJKFOLPTJVICCW-OFQRWUPVSA-N 1 0 259.393 3.759 20 10 CHCDRO CC[C@@H](C)C[C@H](C)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000742379878 1129476246 /nfs/dbraw/zinc/47/62/46/1129476246.db2.gz CDBHMAHYCYLTFI-OLZOCXBDSA-N 1 0 266.404 3.806 20 10 CHCDRO CC[N@H+](Cc1cc2c(cc1O)CCC2)[C@@H](C)C(C)C ZINC000742557295 1129487335 /nfs/dbraw/zinc/48/73/35/1129487335.db2.gz UPCQQBLSKSRVCK-ZDUSSCGKSA-N 1 0 261.409 3.747 20 10 CHCDRO CCC[N@H+](Cc1cncn1C(C)C)Cc1ccccc1O ZINC000822443511 1131378594 /nfs/dbraw/zinc/37/85/94/1131378594.db2.gz WEGVTFXEKPKMEV-UHFFFAOYSA-N 1 0 287.407 3.582 20 10 CHCDRO C[N@H+](CCc1cccs1)Cc1c(O)ccc2ccncc21 ZINC000743384619 1129522351 /nfs/dbraw/zinc/52/23/51/1129522351.db2.gz SJVXIRBVKAPJOL-UHFFFAOYSA-N 1 0 298.411 3.676 20 10 CHCDRO C[C@@H]1C[N@@H+](Cc2c(O)ccc3ccccc32)C[C@H](C)S1 ZINC000743376952 1129522584 /nfs/dbraw/zinc/52/25/84/1129522584.db2.gz WKDGFBZJVFWRFP-BETUJISGSA-N 1 0 287.428 3.871 20 10 CHCDRO CO[C@@H]1CCC[C@H]1[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000251568764 1129534000 /nfs/dbraw/zinc/53/40/00/1129534000.db2.gz UHDXPESHTYVRSP-CSMYWGQOSA-N 1 0 285.387 3.764 20 10 CHCDRO C[N@H+](CCC1CC1)Cc1ccc(N2CCCCC2)cc1 ZINC000743839122 1129538862 /nfs/dbraw/zinc/53/88/62/1129538862.db2.gz FIZHZXDBCFCFLL-UHFFFAOYSA-N 1 0 272.436 3.909 20 10 CHCDRO C[N@@H+](Cc1ccc(N2CCCCC2)cc1)CC1CCC1 ZINC000743839315 1129538906 /nfs/dbraw/zinc/53/89/06/1129538906.db2.gz CSFRNRPGIBESGK-UHFFFAOYSA-N 1 0 272.436 3.909 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CC[C@H]1C)c1cc(Br)ccc1O ZINC000379795249 1129659788 /nfs/dbraw/zinc/65/97/88/1129659788.db2.gz LASLYGYMQKFTAU-ICCXJUOJSA-N 1 0 298.224 3.994 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CC[C@@H]1C)c1cc(Br)ccc1O ZINC000379795255 1129660307 /nfs/dbraw/zinc/66/03/07/1129660307.db2.gz LASLYGYMQKFTAU-XDTLVQLUSA-N 1 0 298.224 3.994 20 10 CHCDRO CO[C@]1(C)C[C@@H]([NH2+][C@@H](C)c2ccc(N(C)C)cc2)C1(C)C ZINC000766382687 1129661008 /nfs/dbraw/zinc/66/10/08/1129661008.db2.gz XYVAYVDTDVEOAX-FDQGKXFDSA-N 1 0 290.451 3.607 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H](C)Cc2ccncc2)cc1 ZINC000766488502 1129669701 /nfs/dbraw/zinc/66/97/01/1129669701.db2.gz JPRPKPHATBGPDQ-CVEARBPZSA-N 1 0 297.446 3.820 20 10 CHCDRO CC/C=C\CC[N@@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000767325817 1129786629 /nfs/dbraw/zinc/78/66/29/1129786629.db2.gz XYCLZMNLCPGVFO-CWIOURORSA-N 1 0 289.419 3.730 20 10 CHCDRO C[C@H]1CC[N@H+](Cc2c(O)ccc3ccccc32)[C@H]1C ZINC000380743043 1129832571 /nfs/dbraw/zinc/83/25/71/1129832571.db2.gz ULFUALDIZOPRGY-STQMWFEESA-N 1 0 255.361 3.776 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]CCC(C)(C)C2CC2)c1 ZINC000380949798 1129832910 /nfs/dbraw/zinc/83/29/10/1129832910.db2.gz DWVJNRQVINSKSE-LBPRGKRZSA-N 1 0 277.408 3.878 20 10 CHCDRO CC(C)[C@H](C)[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000768137144 1129835150 /nfs/dbraw/zinc/83/51/50/1129835150.db2.gz GQUWFNUBPORBRV-AWEZNQCLSA-N 1 0 260.425 3.762 20 10 CHCDRO CCOc1ccc(C[N@H+](C)[C@@H](C)c2ccccc2)c(O)c1 ZINC000768196497 1129842698 /nfs/dbraw/zinc/84/26/98/1129842698.db2.gz GHOUVOSOQPEZRE-AWEZNQCLSA-N 1 0 285.387 3.984 20 10 CHCDRO CCOc1ccc(C[N@H+](C)[C@H]2CCC[C@H](C)C2)c(O)c1 ZINC000768263581 1129849149 /nfs/dbraw/zinc/84/91/49/1129849149.db2.gz VCHOFLNPIBZLTP-ZFWWWQNUSA-N 1 0 277.408 3.801 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CCC[C@H]2CC(C)C)c1 ZINC000768316317 1129852300 /nfs/dbraw/zinc/85/23/00/1129852300.db2.gz CKFVUPQFHUFJPL-HNNXBMFYSA-N 1 0 277.408 3.801 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)[C@H]2CC3CCC2CC3)c(O)c1 ZINC000382067719 1129854393 /nfs/dbraw/zinc/85/43/93/1129854393.db2.gz GVUSFELGDQJPSM-QROZZAMVSA-N 1 0 289.419 3.705 20 10 CHCDRO COc1cc(C[N@H+](C)Cc2ccc(C)cc2)c(O)cc1C ZINC000768437664 1129856750 /nfs/dbraw/zinc/85/67/50/1129856750.db2.gz CAKBLEDYRDYECR-UHFFFAOYSA-N 1 0 285.387 3.650 20 10 CHCDRO CCCC[NH+](CCCC)Cc1cc(OC)c(OC)cc1O ZINC000768439282 1129856784 /nfs/dbraw/zinc/85/67/84/1129856784.db2.gz JZILZODLIXRBBM-UHFFFAOYSA-N 1 0 295.423 3.812 20 10 CHCDRO C[C@H](C1CC1)[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000768420766 1129857717 /nfs/dbraw/zinc/85/77/17/1129857717.db2.gz HYVGCLGUGYXRSW-OAHLLOKOSA-N 1 0 272.436 3.907 20 10 CHCDRO Cc1cc(C)c(O)c(C[NH+]2CCC(c3cccnc3)CC2)c1 ZINC000768460081 1129858524 /nfs/dbraw/zinc/85/85/24/1129858524.db2.gz RPVNGPIUFXGKMX-UHFFFAOYSA-N 1 0 296.414 3.784 20 10 CHCDRO COc1cc(C[N@@H+]2Cc3ccccc3[C@@H]2C)c(O)cc1C ZINC000768465632 1129859462 /nfs/dbraw/zinc/85/94/62/1129859462.db2.gz JQMBQFNXQVEJOF-ZDUSSCGKSA-N 1 0 283.371 3.786 20 10 CHCDRO Oc1ccccc1C[N@H+](C[C@H]1CCCOC1)C1CCCC1 ZINC000768534088 1129861823 /nfs/dbraw/zinc/86/18/23/1129861823.db2.gz PEUGDCXXNSMEQO-OAHLLOKOSA-N 1 0 289.419 3.563 20 10 CHCDRO COc1ccc(C[NH2+]CCc2cccc3[nH]ccc32)cc1C ZINC000800298448 1129864612 /nfs/dbraw/zinc/86/46/12/1129864612.db2.gz IHZHQLYFQSGPRL-UHFFFAOYSA-N 1 0 294.398 3.817 20 10 CHCDRO CCC(CC)[N@H+](CCOC)Cc1cc(C)c(C)cc1O ZINC000768602044 1129866159 /nfs/dbraw/zinc/86/61/59/1129866159.db2.gz VDOGVASJGKSCQH-UHFFFAOYSA-N 1 0 279.424 3.646 20 10 CHCDRO COc1cccc(C[N@H+](C)CCCCc2ccccc2)c1O ZINC000768873579 1129877629 /nfs/dbraw/zinc/87/76/29/1129877629.db2.gz WKUDXRIGAOQABA-UHFFFAOYSA-N 1 0 299.414 3.856 20 10 CHCDRO COc1cccc(C[N@@H+]2CC[C@H](C)[C@H]3CCCC[C@@H]32)c1O ZINC000768848463 1129877972 /nfs/dbraw/zinc/87/79/72/1129877972.db2.gz CDKSJYFAYYXNLN-IMJJTQAJSA-N 1 0 289.419 3.801 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)Cc2ccccc2O)cc1 ZINC000768872977 1129878077 /nfs/dbraw/zinc/87/80/77/1129878077.db2.gz NSXGXQDNASKMID-UHFFFAOYSA-N 1 0 298.430 3.870 20 10 CHCDRO CCSCCC[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000800492109 1129879885 /nfs/dbraw/zinc/87/98/85/1129879885.db2.gz BXSQCQSGCQTLTB-ZYHUDNBSSA-N 1 0 283.412 3.812 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)CC2CC2)cc1F ZINC000768915568 1129881851 /nfs/dbraw/zinc/88/18/51/1129881851.db2.gz ORKRARSBABCFBN-UHFFFAOYSA-N 1 0 264.388 3.514 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)CCc2ccccc2F)cc1 ZINC000769030117 1129886181 /nfs/dbraw/zinc/88/61/81/1129886181.db2.gz PNVRYRBQJXQMJB-UHFFFAOYSA-N 1 0 286.394 3.566 20 10 CHCDRO CCC1(CC)[C@@H]([NH2+]Cc2ccc(OC)c(C)c2)C[C@@H]1OC ZINC001170002533 1129895863 /nfs/dbraw/zinc/89/58/63/1129895863.db2.gz NQOCRLZEELBZLZ-IRXDYDNUSA-N 1 0 291.435 3.687 20 10 CHCDRO CCOc1ccc(C[NH2+][C@H](C)c2ccsc2)c(O)c1 ZINC000800889632 1129896747 /nfs/dbraw/zinc/89/67/47/1129896747.db2.gz RTHFNXZMQIVZLX-LLVKDONJSA-N 1 0 277.389 3.703 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCc3ccccc3[C@H]2C)c1O ZINC000769353884 1129904096 /nfs/dbraw/zinc/90/40/96/1129904096.db2.gz VZBBOHDHIFZTFV-CQSZACIVSA-N 1 0 297.398 3.910 20 10 CHCDRO C[C@@H]1[C@H](C)OCC[N@@H+]1Cc1cc(-c2ccccc2)ccc1O ZINC000769421997 1129907668 /nfs/dbraw/zinc/90/76/68/1129907668.db2.gz DZBTYNLANJJTIA-CABCVRRESA-N 1 0 297.398 3.668 20 10 CHCDRO CC[C@H](C)[C@H]1CCCC[N@@H+]1Cc1cccc(OC)c1O ZINC000769466979 1129912073 /nfs/dbraw/zinc/91/20/73/1129912073.db2.gz RRQWXLZEPHOYEJ-DZGCQCFKSA-N 1 0 277.408 3.801 20 10 CHCDRO CCC[C@@H]1[C@H](C)CCC[N@@H+]1Cc1cccc(OC)c1O ZINC000769507491 1129914761 /nfs/dbraw/zinc/91/47/61/1129914761.db2.gz LXUUFHQTFWOPBG-UKRRQHHQSA-N 1 0 277.408 3.801 20 10 CHCDRO CC(C)[C@H]1C[N@H+](Cc2c(O)cccc2Cl)CCS1 ZINC000769550351 1129917332 /nfs/dbraw/zinc/91/73/32/1129917332.db2.gz RFLJBUDGTIYWKO-CQSZACIVSA-N 1 0 285.840 3.619 20 10 CHCDRO CCc1cccc(C[NH2+]Cc2ccc(F)c(F)c2)c1O ZINC000691468213 1129923255 /nfs/dbraw/zinc/92/32/55/1129923255.db2.gz SHOFDAYKUZPTIC-UHFFFAOYSA-N 1 0 277.314 3.523 20 10 CHCDRO CCCC[N@H+](Cc1cncc(C)c1)Cc1ccccc1O ZINC000801596847 1129932057 /nfs/dbraw/zinc/93/20/57/1129932057.db2.gz QWLOERIPWOABRN-UHFFFAOYSA-N 1 0 284.403 3.898 20 10 CHCDRO CC[C@H]1CCC[C@H]1C[NH2+]Cc1ccc(OC)c(C)c1 ZINC001461514421 1129934404 /nfs/dbraw/zinc/93/44/04/1129934404.db2.gz JQWSWDVWWBKLSJ-HOTGVXAUSA-N 1 0 261.409 3.920 20 10 CHCDRO CS[C@@H]1CCCC[N@H+](Cc2cc(C)c(C)cc2O)C1 ZINC000770348493 1129945896 /nfs/dbraw/zinc/94/58/96/1129945896.db2.gz JRVICFVQGHKDFA-OAHLLOKOSA-N 1 0 279.449 3.727 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2ccccc2O)[C@@H]2CCCC[C@@H]12 ZINC000770510092 1129948167 /nfs/dbraw/zinc/94/81/67/1129948167.db2.gz XHJMBYSYLJYJDF-VNQPRFMTSA-N 1 0 259.393 3.793 20 10 CHCDRO Cc1ccc(C[C@@H](C)[N@H+](C)Cc2ccccc2O)cc1 ZINC000770511070 1129949108 /nfs/dbraw/zinc/94/91/08/1129949108.db2.gz YMPADPNIKMPOTQ-OAHLLOKOSA-N 1 0 269.388 3.764 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000770510628 1129949241 /nfs/dbraw/zinc/94/92/41/1129949241.db2.gz OQGUVCSIGIRNOI-CQSZACIVSA-N 1 0 271.335 3.521 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)c2cnccc2C)cc1C ZINC000770750308 1129958490 /nfs/dbraw/zinc/95/84/90/1129958490.db2.gz MQYJTLLHKWNDHI-AWEZNQCLSA-N 1 0 270.376 3.558 20 10 CHCDRO CCc1cccc(C[NH2+]Cc2ccc(C)s2)c1O ZINC000691498580 1129977611 /nfs/dbraw/zinc/97/76/11/1129977611.db2.gz ZUYBEXXTAKGYDL-UHFFFAOYSA-N 1 0 261.390 3.614 20 10 CHCDRO Cc1ccncc1[C@@H](C)[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000771388969 1129979169 /nfs/dbraw/zinc/97/91/69/1129979169.db2.gz QDRVGEMFXCQVRI-HUUCEWRRSA-N 1 0 283.419 3.868 20 10 CHCDRO CCC[N@H+](Cc1ccccc1O)[C@@H](C)c1ncc(C)o1 ZINC000771445749 1129980812 /nfs/dbraw/zinc/98/08/12/1129980812.db2.gz HGTQGHRTRPTBQG-ZDUSSCGKSA-N 1 0 274.364 3.662 20 10 CHCDRO C[N@H+](CCOc1ccccc1)Cc1c(O)cccc1Cl ZINC000771926943 1129994824 /nfs/dbraw/zinc/99/48/24/1129994824.db2.gz AIPLMBVGTXSFEJ-UHFFFAOYSA-N 1 0 291.778 3.556 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2ccc(N(C)C)cc2)s1 ZINC000771934882 1129996938 /nfs/dbraw/zinc/99/69/38/1129996938.db2.gz FKSVNIRQESUQAJ-UHFFFAOYSA-N 1 0 274.433 3.755 20 10 CHCDRO Cc1cccc(C[N@@H+]2CC[C@](F)(c3ccccc3)C2)c1O ZINC000802656051 1130026790 /nfs/dbraw/zinc/02/67/90/1130026790.db2.gz CGCKJMIIABZQBA-GOSISDBHSA-N 1 0 285.362 3.771 20 10 CHCDRO CO[C@H](c1ccccc1)[C@@H](C)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000786782059 1130117379 /nfs/dbraw/zinc/11/73/79/1130117379.db2.gz FBWPMTZUZFWHLN-BEFAXECRSA-N 1 0 298.430 3.618 20 10 CHCDRO CC(C)[N@H+](CC[C@H]1CCCO1)Cc1ccc(N(C)C)cc1 ZINC000787185182 1130138375 /nfs/dbraw/zinc/13/83/75/1130138375.db2.gz XTFWRUGNRXYDHY-GOSISDBHSA-N 1 0 290.451 3.532 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2CCO[C@H]2C2CC2)c1O ZINC000903260813 1130138787 /nfs/dbraw/zinc/13/87/87/1130138787.db2.gz RMQCHYLBBFCJRG-JJMVLAAESA-N 1 0 295.810 3.572 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C2CC3(C2)CO[C@@H](C)C3)c(O)c1C ZINC000903283110 1130145938 /nfs/dbraw/zinc/14/59/38/1130145938.db2.gz OJXSFPZPDMGBLQ-PRPCKKACSA-N 1 0 289.419 3.617 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2c(C)cc(CO)cc2C)c1 ZINC000903307843 1130149541 /nfs/dbraw/zinc/14/95/41/1130149541.db2.gz LLZWQZIXKPPIDY-OAHLLOKOSA-N 1 0 299.414 3.661 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](c2ccccn2)C2CC2)c1 ZINC000903334765 1130160862 /nfs/dbraw/zinc/16/08/62/1130160862.db2.gz FZZYHFHVSCBEIK-FZKQIMNGSA-N 1 0 282.387 3.898 20 10 CHCDRO C[C@@H]([NH2+][C@H](c1ccncc1)C1CC1)c1cc(F)ccc1O ZINC000903428981 1130175770 /nfs/dbraw/zinc/17/57/70/1130175770.db2.gz RIUFIUOFIMFPSP-DIFFPNOSSA-N 1 0 286.350 3.728 20 10 CHCDRO C[C@H]([NH2+][C@H](c1ccncc1)C1CC1)c1ccccc1O ZINC000903430049 1130176908 /nfs/dbraw/zinc/17/69/08/1130176908.db2.gz XGVUJECQWKQHGR-SJCJKPOMSA-N 1 0 268.360 3.589 20 10 CHCDRO CCC(O)(CC)CC[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000788264560 1130180459 /nfs/dbraw/zinc/18/04/59/1130180459.db2.gz ZEZFXUAAZAWWGA-CQSZACIVSA-N 1 0 279.424 3.601 20 10 CHCDRO Oc1ccccc1C[N@@H+](Cc1ccco1)C[C@H]1CCC=CO1 ZINC000788442208 1130186041 /nfs/dbraw/zinc/18/60/41/1130186041.db2.gz BSLFXJUKEQPUCY-MRXNPFEDSA-N 1 0 299.370 3.680 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CC2(N(C)C)CCCC2)c(O)c1 ZINC000788504301 1130191141 /nfs/dbraw/zinc/19/11/41/1130191141.db2.gz GWQGKASZWJUMIJ-OAHLLOKOSA-N 1 0 290.451 3.534 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H](C)[C@]2(C)CCCO2)cc1 ZINC000788546766 1130193537 /nfs/dbraw/zinc/19/35/37/1130193537.db2.gz LQDSHCFMPYKZPF-QAPCUYQASA-N 1 0 290.451 3.580 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CCSC(F)(F)F)c(O)c1 ZINC000788556963 1130194278 /nfs/dbraw/zinc/19/42/78/1130194278.db2.gz IIKWKZFAKYZYTN-SNVBAGLBSA-N 1 0 293.354 3.913 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@](C)(O)CCC(C)C)c(O)c1 ZINC000788600878 1130197310 /nfs/dbraw/zinc/19/73/10/1130197310.db2.gz DVIRXJJRAITCPU-CRAIPNDOSA-N 1 0 293.451 3.847 20 10 CHCDRO C[C@H]([NH2+]CCCCOC(C)(C)C)c1ccc(N(C)C)cc1 ZINC000789388757 1130246321 /nfs/dbraw/zinc/24/63/21/1130246321.db2.gz QQAUHXVWWJHLQG-HNNXBMFYSA-N 1 0 292.467 3.999 20 10 CHCDRO C[C@H]1CC[C@H]([NH2+]Cc2cc3ccccc3cc2O)C1 ZINC001170112113 1130263899 /nfs/dbraw/zinc/26/38/99/1130263899.db2.gz HDRVPHCESCUCOU-LRDDRELGSA-N 1 0 255.361 3.824 20 10 CHCDRO COCC[N@H+](Cc1cc(C)c(C)cc1O)[C@@H]1CC[C@@H](C)C1 ZINC000790475510 1130315891 /nfs/dbraw/zinc/31/58/91/1130315891.db2.gz AQSRXNKESWAGQX-CXAGYDPISA-N 1 0 291.435 3.646 20 10 CHCDRO C[C@H]1CC[C@@H]([N@H+](C)Cc2ccc(N3CCCC3)cc2)C1 ZINC001170144660 1130329421 /nfs/dbraw/zinc/32/94/21/1130329421.db2.gz MWJTUUJURMAABC-MAUKXSAKSA-N 1 0 272.436 3.907 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C[C@@H]2CCC3(CCCCC3)O2)c1 ZINC000790995072 1130342794 /nfs/dbraw/zinc/34/27/94/1130342794.db2.gz JLKFCRJMXXBTRJ-INIZCTEOSA-N 1 0 289.419 3.672 20 10 CHCDRO CCOc1ccc(C[NH2+]Cc2ccc(C3CC3)cc2)c(O)c1 ZINC000790994607 1130343161 /nfs/dbraw/zinc/34/31/61/1130343161.db2.gz FEBZRCKZNXXDRW-UHFFFAOYSA-N 1 0 297.398 3.958 20 10 CHCDRO CC(C)=CCC[NH2+]Cc1cc(Br)cc(C)c1O ZINC000792184227 1130437105 /nfs/dbraw/zinc/43/71/05/1130437105.db2.gz TXLWNGDSYMDCSK-UHFFFAOYSA-N 1 0 298.224 3.909 20 10 CHCDRO C[C@H]1COC(C)(C)C[N@@H+]1Cc1c(O)ccc2ccccc21 ZINC000792726236 1130494105 /nfs/dbraw/zinc/49/41/05/1130494105.db2.gz BJGVANVMSSWZPA-ZDUSSCGKSA-N 1 0 285.387 3.545 20 10 CHCDRO C[N@H+](Cc1ccc(N2CCCCC2)cc1)CC1(F)CC1 ZINC000792763270 1130495944 /nfs/dbraw/zinc/49/59/44/1130495944.db2.gz ROJBXKVWCRYSGW-UHFFFAOYSA-N 1 0 276.399 3.611 20 10 CHCDRO COc1ccc([C@@H](C)[C@H](C)[NH2+]Cc2cc(C)ccc2O)cc1 ZINC000747100327 1130517763 /nfs/dbraw/zinc/51/77/63/1130517763.db2.gz XCDORORDGGZGOB-GJZGRUSLSA-N 1 0 299.414 3.991 20 10 CHCDRO Cc1cc(Br)cc(C[NH+]2CC(C(C)C)C2)c1O ZINC000793191543 1130529549 /nfs/dbraw/zinc/52/95/49/1130529549.db2.gz YWIZXBLZIYXBSJ-UHFFFAOYSA-N 1 0 298.224 3.551 20 10 CHCDRO CC(C)C1C[NH+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000793191790 1130529560 /nfs/dbraw/zinc/52/95/60/1130529560.db2.gz NZCMTRJGZBBHJY-UHFFFAOYSA-N 1 0 272.436 3.765 20 10 CHCDRO CCOc1cccc(C[N@H+](C)[C@H]2CCC(C)(C)C2)c1O ZINC000793353337 1130543729 /nfs/dbraw/zinc/54/37/29/1130543729.db2.gz RZQBYZPAKSTWME-AWEZNQCLSA-N 1 0 277.408 3.801 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](C)[C@@H]2CCC(C)(C)C2)c1 ZINC000793359312 1130545384 /nfs/dbraw/zinc/54/53/84/1130545384.db2.gz VZXOYPZJVUZACB-CQSZACIVSA-N 1 0 277.408 3.801 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)CCC=C(C)C)c(O)c1 ZINC000793387287 1130552338 /nfs/dbraw/zinc/55/23/38/1130552338.db2.gz BUVUPWKYYBFLAI-ZDUSSCGKSA-N 1 0 263.381 3.625 20 10 CHCDRO COC1CCC(CC[NH2+]Cc2cc(C)c(C)cc2O)CC1 ZINC000757985359 1130592022 /nfs/dbraw/zinc/59/20/22/1130592022.db2.gz OTRNZSOLLLJKKZ-UHFFFAOYSA-N 1 0 291.435 3.694 20 10 CHCDRO COC1CCC(CC[NH2+]Cc2cc(Cl)ccc2O)CC1 ZINC000757987145 1130592389 /nfs/dbraw/zinc/59/23/89/1130592389.db2.gz ZITROMIGBWALFQ-UHFFFAOYSA-N 1 0 297.826 3.731 20 10 CHCDRO CC1=C[C@@H](C)C[C@@H](C[N@H+](C)Cc2ccccc2O)C1 ZINC000811458072 1130611063 /nfs/dbraw/zinc/61/10/63/1130611063.db2.gz TXCROBIXTJNZCR-UKRRQHHQSA-N 1 0 259.393 3.816 20 10 CHCDRO CCCN(CC1(SC)CCC1)c1ccc(C[NH3+])cc1 ZINC000811496394 1130612774 /nfs/dbraw/zinc/61/27/74/1130612774.db2.gz WODIGJYCTKZSQP-UHFFFAOYSA-N 1 0 278.465 3.647 20 10 CHCDRO COc1ccc2ccc(O)c(C[N@@H+]3CCCC3(C)C)c2c1 ZINC001234525109 1130654571 /nfs/dbraw/zinc/65/45/71/1130654571.db2.gz AVWZMUHDCQKDAJ-UHFFFAOYSA-N 1 0 285.387 3.928 20 10 CHCDRO CC[N@@H+](Cc1cc(C(C)C)c(C)cc1O)C[C@H](C)OC ZINC000812302816 1130684003 /nfs/dbraw/zinc/68/40/03/1130684003.db2.gz ZSPNYKHGTKILBJ-AWEZNQCLSA-N 1 0 279.424 3.681 20 10 CHCDRO CCOCc1cc(C[NH2+][C@H]2CC[C@H](C)C2)ccc1OC ZINC000780579164 1130684917 /nfs/dbraw/zinc/68/49/17/1130684917.db2.gz ZSHCLCZDYOEUCR-BBRMVZONSA-N 1 0 277.408 3.510 20 10 CHCDRO C[C@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1ccccc1O ZINC000780793296 1130692499 /nfs/dbraw/zinc/69/24/99/1130692499.db2.gz LCBADQPOALYTCU-CMPLNLGQSA-N 1 0 273.298 3.555 20 10 CHCDRO C=Cc1ccc(CC[NH2+][C@@H](C)c2cc(OC)ccc2O)cc1 ZINC000812734307 1130708981 /nfs/dbraw/zinc/70/89/81/1130708981.db2.gz KZCQKGLIYMXVSC-AWEZNQCLSA-N 1 0 297.398 3.937 20 10 CHCDRO CC[N@H+](Cc1cc(-c2ccccc2)ccc1O)[C@@H]1CCOC1 ZINC000812780471 1130712705 /nfs/dbraw/zinc/71/27/05/1130712705.db2.gz FTNDXXFVYYIOKD-GOSISDBHSA-N 1 0 297.398 3.670 20 10 CHCDRO C[C@H]1CC[C@@]2(CC[N@H+](Cc3cc(F)ccc3O)C2)C1 ZINC000781927304 1130748970 /nfs/dbraw/zinc/74/89/70/1130748970.db2.gz DJJVUXIMGUEQBO-BLLLJJGKSA-N 1 0 263.356 3.543 20 10 CHCDRO CCOCc1cc(C[NH2+][C@@H](C)C2(C)CC2)ccc1OC ZINC000747853068 1130764651 /nfs/dbraw/zinc/76/46/51/1130764651.db2.gz XEDOMIARRWCQQV-ZDUSSCGKSA-N 1 0 277.408 3.510 20 10 CHCDRO COC[C@@H]1CCCC[N@@H+]1Cc1ccc(C(C)(C)C)cc1O ZINC001235676963 1130765367 /nfs/dbraw/zinc/76/53/67/1130765367.db2.gz YTLGWJHJWRUFCD-INIZCTEOSA-N 1 0 291.435 3.691 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2c(O)ccc3ccncc32)[C@@H]2CCCC[C@H]21 ZINC000782274314 1130767926 /nfs/dbraw/zinc/76/79/26/1130767926.db2.gz AMVMHJPMYYANNE-QIIPPGSGSA-N 1 0 296.414 3.951 20 10 CHCDRO CC[C@@H]1CC[N@H+](Cc2ccc(C(C)(C)C)cc2O)C1 ZINC001235681930 1130768367 /nfs/dbraw/zinc/76/83/67/1130768367.db2.gz SFKBPRBYBAVAAB-CYBMUJFWSA-N 1 0 261.409 3.922 20 10 CHCDRO C[N@H+](CCC1CC1)Cc1ccc(C(C)(C)C)cc1O ZINC001235681026 1130768596 /nfs/dbraw/zinc/76/85/96/1130768596.db2.gz WTIODZNRUGGXRR-UHFFFAOYSA-N 1 0 261.409 3.922 20 10 CHCDRO CC(C)(C)c1ccc(C[N@@H+]2CCC[C@H]3C[C@H]32)c(O)c1 ZINC001235679330 1130768707 /nfs/dbraw/zinc/76/87/07/1130768707.db2.gz DYZWVLDTQMMMOE-SWLSCSKDSA-N 1 0 259.393 3.674 20 10 CHCDRO CC(C)(C)c1ccc(C[N@@H+]2CCn3cccc3C2)c(O)c1 ZINC001235683406 1130768856 /nfs/dbraw/zinc/76/88/56/1130768856.db2.gz FSYZVXDWGFXFHW-UHFFFAOYSA-N 1 0 284.403 3.507 20 10 CHCDRO CCOc1ccc(C[NH2+]CC(C)(C)C(C)C)c(O)c1 ZINC000782536418 1130782774 /nfs/dbraw/zinc/78/27/74/1130782774.db2.gz ZGISULZGNSCDFJ-UHFFFAOYSA-N 1 0 265.397 3.563 20 10 CHCDRO C[N@H+](CCc1cccc(Cl)c1)Cc1ccc(N)cc1 ZINC001235839072 1130786081 /nfs/dbraw/zinc/78/60/81/1130786081.db2.gz IRXZCDXFMJQJIL-UHFFFAOYSA-N 1 0 274.795 3.597 20 10 CHCDRO C[C@]1(c2ccccc2)CC[C@@H]([NH2+]Cc2ccccc2O)C1 ZINC000783236281 1130805660 /nfs/dbraw/zinc/80/56/60/1130805660.db2.gz FYLKHCFIFNGZFE-MJGOQNOKSA-N 1 0 281.399 3.992 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCC=CO1)c1cc2c(cc1O)CCCC2 ZINC000783312190 1130815290 /nfs/dbraw/zinc/81/52/90/1130815290.db2.gz ZTGJRISTKCTQOO-CZUORRHYSA-N 1 0 287.403 3.614 20 10 CHCDRO CC[C@H]([NH2+]CC1(N(C)C)CCC1)c1cc(Cl)ccc1O ZINC000783314006 1130815975 /nfs/dbraw/zinc/81/59/75/1130815975.db2.gz JFOZYXHYDOOEPG-AWEZNQCLSA-N 1 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272.436 3.907 20 10 CHCDRO C[C@@H]1CCC[N@H+](Cc2cc(F)c(Cl)cc2[O-])[C@@H]1C ZINC001237937052 1131153847 /nfs/dbraw/zinc/15/38/47/1131153847.db2.gz NKHBIQXXYIQTRT-NXEZZACHSA-N 1 0 271.763 3.805 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCC[C@@H](CC(F)(F)F)C2)c1O ZINC000817413402 1131160199 /nfs/dbraw/zinc/16/01/99/1131160199.db2.gz XJHAFOHFYARZPC-LBPRGKRZSA-N 1 0 287.325 3.865 20 10 CHCDRO COc1ccc(C[NH2+]Cc2cccc(C3CC3)c2)c(O)c1 ZINC000817410575 1131160782 /nfs/dbraw/zinc/16/07/82/1131160782.db2.gz ZKYJNVOYXDMEPM-UHFFFAOYSA-N 1 0 283.371 3.568 20 10 CHCDRO Cc1cc(F)cc(C[N@H+]2CCC[C@H](C)[C@H](C)C2)c1O ZINC001238058764 1131165806 /nfs/dbraw/zinc/16/58/06/1131165806.db2.gz VKNHJNAQXLEKER-WCQYABFASA-N 1 0 265.372 3.708 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCO[C@H](CC)C1)c1ccc(N(C)C)cc1 ZINC000817585731 1131173864 /nfs/dbraw/zinc/17/38/64/1131173864.db2.gz HKLDCWFRRUNCGM-JQHSSLGASA-N 1 0 290.451 3.751 20 10 CHCDRO C[C@@H]([NH2+]C1CCC([NH+](C)C)CC1)c1cc(Cl)ccc1O ZINC000817587623 1131174141 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CSc1ccc([C@@H](C)[NH2+]CCc2ccc(N)cc2)cc1 ZINC000817956340 1131191610 /nfs/dbraw/zinc/19/16/10/1131191610.db2.gz WRAPEJDBVLOHIW-CYBMUJFWSA-N 1 0 286.444 3.884 20 10 CHCDRO Nc1ccc(CC[NH2+][C@@H]2CCC[C@@H](c3cccnc3)C2)cc1 ZINC000817958764 1131191677 /nfs/dbraw/zinc/19/16/77/1131191677.db2.gz YAFPHZATFPHZES-VQIMIIECSA-N 1 0 295.430 3.522 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2cccc3c2CCCN3)c(O)c1 ZINC000817975037 1131194188 /nfs/dbraw/zinc/19/41/88/1131194188.db2.gz HYVZZBRGCPQAMV-CQSZACIVSA-N 1 0 296.414 3.910 20 10 CHCDRO C[NH2+]Cc1ccc(NCc2ccc(N3CCCC3)cc2)cc1 ZINC001117953852 1131205895 /nfs/dbraw/zinc/20/58/95/1131205895.db2.gz RYTWLPGBRGHCCL-UHFFFAOYSA-N 1 0 295.430 3.618 20 10 CHCDRO Cc1cc(C[NH2+]Cc2ccc(N3CCCC3)cc2)cc(C)n1 ZINC001118055579 1131208406 /nfs/dbraw/zinc/20/84/06/1131208406.db2.gz UTIGAOKOWHOFIF-UHFFFAOYSA-N 1 0 295.430 3.588 20 10 CHCDRO CCCC[C@H](C)[NH2+]C[C@H]1CCN(c2ccc(OC)cc2)C1 ZINC000818344327 1131209240 /nfs/dbraw/zinc/20/92/40/1131209240.db2.gz LDOWUCRAAFSWRE-JKSUJKDBSA-N 1 0 290.451 3.690 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CC12CC2)c1ccc(N2CCCCC2)cc1 ZINC000818356696 1131211528 /nfs/dbraw/zinc/21/15/28/1131211528.db2.gz PWVPCOZRZYZBRK-WMLDXEAASA-N 1 0 270.420 3.880 20 10 CHCDRO COCC1(CC[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)CC1 ZINC001118238512 1131216286 /nfs/dbraw/zinc/21/62/86/1131216286.db2.gz JPSQWNMPYJOZLL-KGLIPLIRSA-N 1 0 289.419 3.655 20 10 CHCDRO Cc1cc(C[N@@H+]2CC[C@@H](F)C2)c(C)n1-c1ccccc1 ZINC001137854025 1131424300 /nfs/dbraw/zinc/42/43/00/1131424300.db2.gz FMWFZYSEOWQUIS-MRXNPFEDSA-N 1 0 272.367 3.638 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C[C@H]2CSc3ccccc32)cc1 ZINC000824482925 1131470524 /nfs/dbraw/zinc/47/05/24/1131470524.db2.gz FCFPOTQQEKXZQS-HNNXBMFYSA-N 1 0 298.455 3.732 20 10 CHCDRO Cc1cccc(C[NH2+]C[C@@H]2CSc3ccccc32)c1O ZINC000824482960 1131470562 /nfs/dbraw/zinc/47/05/62/1131470562.db2.gz FCIKZZJFXHIYQT-CQSZACIVSA-N 1 0 285.412 3.680 20 10 CHCDRO Cc1c(C[N@H+](C)CCC2CC2)c2ccccc2n1C ZINC001138258515 1131483270 /nfs/dbraw/zinc/48/32/70/1131483270.db2.gz UISLJAIHTRKBNC-UHFFFAOYSA-N 1 0 256.393 3.719 20 10 CHCDRO Cc1csc(C[NH2+]Cc2cc(C)c(C)cc2O)c1 ZINC000824750466 1131483948 /nfs/dbraw/zinc/48/39/48/1131483948.db2.gz KUPWHGZMFVKEMA-UHFFFAOYSA-N 1 0 261.390 3.669 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCOC2(CCC2)C1)c1ccccc1O ZINC000824750797 1131484131 /nfs/dbraw/zinc/48/41/31/1131484131.db2.gz PEXHFHLEFQIDMR-HOCLYGCPSA-N 1 0 289.419 3.782 20 10 CHCDRO CC(C)[C@@H]1C[C@H](C[NH2+]Cc2c(O)cccc2Cl)CCO1 ZINC000824799624 1131484650 /nfs/dbraw/zinc/48/46/50/1131484650.db2.gz PEKNGWUQPGICPG-WBMJQRKESA-N 1 0 297.826 3.586 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+]C[C@H]2CCCC2(F)F)c1O ZINC000824800281 1131484922 /nfs/dbraw/zinc/48/49/22/1131484922.db2.gz VTMYWKVGGVZIQQ-LLVKDONJSA-N 1 0 289.753 3.879 20 10 CHCDRO CN1CCCc2cc(C[NH+]3CCC4(CCC4)CC3)ccc21 ZINC001138354241 1131493566 /nfs/dbraw/zinc/49/35/66/1131493566.db2.gz BWHQDKFBCPLPBJ-UHFFFAOYSA-N 1 0 284.447 3.835 20 10 CHCDRO CN1CCCc2cc(C[N@H+](Cc3ccco3)C3CC3)ccc21 ZINC001138355718 1131493788 /nfs/dbraw/zinc/49/37/88/1131493788.db2.gz ADGAHQOQNKURPQ-UHFFFAOYSA-N 1 0 296.414 3.827 20 10 CHCDRO CN1CCCc2cc(C[N@H+](C)Cc3cccc(F)c3)ccc21 ZINC001138354798 1131494139 /nfs/dbraw/zinc/49/41/39/1131494139.db2.gz VJVZVGDVTXJNAV-UHFFFAOYSA-N 1 0 298.405 3.840 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2C[C@H]3CC[C@@H]2C3)c(OC)c1 ZINC001138389669 1131496696 /nfs/dbraw/zinc/49/66/96/1131496696.db2.gz JXEWLLAQSRLUNF-GOEBONIOSA-N 1 0 288.435 3.526 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCCC2(C)C)c(OC)c1 ZINC001138386685 1131497468 /nfs/dbraw/zinc/49/74/68/1131497468.db2.gz SUYGIYSHSNYDLQ-UHFFFAOYSA-N 1 0 290.451 3.916 20 10 CHCDRO Cc1cccc(C[NH2+]Cc2cc(Cl)c(C)cc2O)c1 ZINC000825084851 1131499288 /nfs/dbraw/zinc/49/92/88/1131499288.db2.gz SDEGPDAOZYRLEJ-UHFFFAOYSA-N 1 0 275.779 3.952 20 10 CHCDRO Cc1cc(O)c(CNc2ccc3c([nH+]2)CCC3)cc1C ZINC000825124255 1131499831 /nfs/dbraw/zinc/49/98/31/1131499831.db2.gz LAJKMEQDXGPDDL-UHFFFAOYSA-N 1 0 268.360 3.505 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C(C)(C)C2CC2)cc1Cl ZINC000825287095 1131505660 /nfs/dbraw/zinc/50/56/60/1131505660.db2.gz IRCBEZXWFMQBEO-UHFFFAOYSA-N 1 0 253.773 3.632 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H]2CC=CCC2)cc1Cl ZINC000825298096 1131505983 /nfs/dbraw/zinc/50/59/83/1131505983.db2.gz UWVJTRIEZILGMH-LBPRGKRZSA-N 1 0 251.757 3.552 20 10 CHCDRO COc1ccc(C[NH2+]C[C@@H]2C[C@H]2C2CCC2)cc1C ZINC001202914274 1131599834 /nfs/dbraw/zinc/59/98/34/1131599834.db2.gz UXFDPDLPTVVSNE-HOTGVXAUSA-N 1 0 259.393 3.529 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CNc3ccccc3C2)c(O)c1C ZINC000844921602 1131608292 /nfs/dbraw/zinc/60/82/92/1131608292.db2.gz QCRXOYOIIJFIES-HOCLYGCPSA-N 1 0 296.414 3.696 20 10 CHCDRO Cc1cc(C[N@H+]2CCCCC[C@@H]2C)ccc1N(C)C ZINC001139672451 1131626522 /nfs/dbraw/zinc/62/65/22/1131626522.db2.gz XLVFBEDBGUXFIR-HNNXBMFYSA-N 1 0 260.425 3.826 20 10 CHCDRO Cc1ccc([C@H]2CCC[N@@H+]2Cc2cc(F)ccc2O)cn1 ZINC001140058570 1131659780 /nfs/dbraw/zinc/65/97/80/1131659780.db2.gz HISSIRULGLYZGB-MRXNPFEDSA-N 1 0 286.350 3.572 20 10 CHCDRO C[N@H+](CCc1ccc(Cl)cc1)Cc1cc(F)ccc1O ZINC001140055164 1131660097 /nfs/dbraw/zinc/66/00/97/1131660097.db2.gz MSIXEPXFHAEHIQ-UHFFFAOYSA-N 1 0 293.769 3.859 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CCC[C@@H](Cc2ccccc2)C1 ZINC001140055600 1131660276 /nfs/dbraw/zinc/66/02/76/1131660276.db2.gz MISZKXIVVILGOB-INIZCTEOSA-N 1 0 299.389 3.986 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1C[C@@H]2C[C@H](C1)c1ccccc12 ZINC001140058466 1131660363 /nfs/dbraw/zinc/66/03/63/1131660363.db2.gz BEWINPBKQOEBSZ-BETUJISGSA-N 1 0 283.346 3.618 20 10 CHCDRO Cc1ccc(C)c(C[NH+]2Cc3ccccc3C2)c1O ZINC001140180641 1131672954 /nfs/dbraw/zinc/67/29/54/1131672954.db2.gz NEEYMCDRBXNXGU-UHFFFAOYSA-N 1 0 253.345 3.525 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCC[C@](C)(F)CC2)c1O ZINC001140178712 1131673032 /nfs/dbraw/zinc/67/30/32/1131673032.db2.gz VGCDVYAWRDNDPE-INIZCTEOSA-N 1 0 265.372 3.723 20 10 CHCDRO Cc1ccc(C)c(C[N@H+](C)Cc2ccccc2C)c1O ZINC001140179992 1131673390 /nfs/dbraw/zinc/67/33/90/1131673390.db2.gz RIGGAEZUEUCXFL-UHFFFAOYSA-N 1 0 269.388 3.949 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)C2CCSCC2)c1 ZINC000845972766 1131673549 /nfs/dbraw/zinc/67/35/49/1131673549.db2.gz UCXDCZULFYURFC-VXGBXAGGSA-N 1 0 295.448 3.583 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+][C@@H]2CCCC[C@H]2SC)c1 ZINC000846010319 1131678035 /nfs/dbraw/zinc/67/80/35/1131678035.db2.gz JYRRDWHGHFKIKR-GDBMZVCRSA-N 1 0 295.448 3.555 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CC[C@@]2(C)C[C@]2(F)Cl)cc1C ZINC000846032544 1131680865 /nfs/dbraw/zinc/68/08/65/1131680865.db2.gz AQENRVKWZAVGMS-LSDHHAIUSA-N 1 0 285.790 3.803 20 10 CHCDRO Cc1cccc2c1OCC[C@H]2[NH2+][C@H]1CCc2cccc(O)c21 ZINC000834552189 1131682524 /nfs/dbraw/zinc/68/25/24/1131682524.db2.gz XIFVTQRTDMLPFL-CVEARBPZSA-N 1 0 295.382 3.801 20 10 CHCDRO Cc1cccc2c1CC[C@H]2[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000834641052 1131689824 /nfs/dbraw/zinc/68/98/24/1131689824.db2.gz VSUJHMFLYRQOIP-IAGOWNOFSA-N 1 0 279.383 3.965 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@@H]2CC3CCC2CC3)c1O ZINC000846160093 1131692183 /nfs/dbraw/zinc/69/21/83/1131692183.db2.gz MROUAVXCCRWZJT-XZNOPERXSA-N 1 0 275.392 3.630 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H]2c3ccccc3C[C@@H]2C)c1O ZINC000846151276 1131692240 /nfs/dbraw/zinc/69/22/40/1131692240.db2.gz YSLBREMFFSHCQR-ZJNRKIDTSA-N 1 0 297.398 3.985 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]Cc2cscc2C)c1O ZINC000846167215 1131692709 /nfs/dbraw/zinc/69/27/09/1131692709.db2.gz UKAKBCDJOGBQIL-NSHDSACASA-N 1 0 277.389 3.622 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CCCc2cccs2)c1O ZINC000846160479 1131692826 /nfs/dbraw/zinc/69/28/26/1131692826.db2.gz XCHZIIJNBSPXPH-LBPRGKRZSA-N 1 0 291.416 3.746 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]C[C@@H]2CCCCC2(F)F)c1O ZINC000846169353 1131693562 /nfs/dbraw/zinc/69/35/62/1131693562.db2.gz HEONUXDPSVWXKC-NEPJUHHUSA-N 1 0 299.361 3.877 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H](C)CCc2ccco2)c1O ZINC000846138960 1131693591 /nfs/dbraw/zinc/69/35/91/1131693591.db2.gz YRVPKXHBJSKXSX-OLZOCXBDSA-N 1 0 289.375 3.666 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@H](C)Cc2cccs2)c1O ZINC000846139062 1131693701 /nfs/dbraw/zinc/69/37/01/1131693701.db2.gz PGPLIZCSAODSGW-VXGBXAGGSA-N 1 0 291.416 3.744 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H]2CCCC[C@H]2C)c1O ZINC000846135187 1131694177 /nfs/dbraw/zinc/69/41/77/1131694177.db2.gz BANNFDAISPZTIO-DYEKYZERSA-N 1 0 263.381 3.630 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]CCCc1cccs1)CC2 ZINC000834698447 1131694475 /nfs/dbraw/zinc/69/44/75/1131694475.db2.gz ZPSZCBOZHXXOAU-AWEZNQCLSA-N 1 0 273.401 3.663 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H](C)C2CCCC2)c1O ZINC000846144841 1131695088 /nfs/dbraw/zinc/69/50/88/1131695088.db2.gz MINVRIHSPWSSHZ-NEPJUHHUSA-N 1 0 263.381 3.630 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)COCC1CC1)c1ccc(C)cc1O ZINC000846206215 1131695923 /nfs/dbraw/zinc/69/59/23/1131695923.db2.gz XPYFCHSLIYCXFD-XJKSGUPXSA-N 1 0 277.408 3.556 20 10 CHCDRO CO[C@@H]1CCCC[C@H]1[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000846204183 1131696159 /nfs/dbraw/zinc/69/61/59/1131696159.db2.gz WXNXAIGRYJOJEA-FVQBIDKESA-N 1 0 277.408 3.617 20 10 CHCDRO CS[C@H](C[NH2+][C@@H]1CCc2cccc(O)c21)C(C)(C)C ZINC000834759898 1131703507 /nfs/dbraw/zinc/70/35/07/1131703507.db2.gz GPQOGVZQIJIAGS-TZMCWYRMSA-N 1 0 279.449 3.747 20 10 CHCDRO C[N@@H+](Cc1c(O)cccc1Cl)C[C@H]1CC1(C)C ZINC001140341582 1131703645 /nfs/dbraw/zinc/70/36/45/1131703645.db2.gz XHILSCMVDPYOPX-SNVBAGLBSA-N 1 0 253.773 3.524 20 10 CHCDRO CC(C)[C@H](CC(F)(F)F)[NH2+][C@H]1CCc2cccc(O)c21 ZINC000834779697 1131704658 /nfs/dbraw/zinc/70/46/58/1131704658.db2.gz RFUVOAOLYRZCBS-RYUDHWBXSA-N 1 0 287.325 3.946 20 10 CHCDRO Cc1cc(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)ccn1 ZINC000834859568 1131712713 /nfs/dbraw/zinc/71/27/13/1131712713.db2.gz DJLUSZGUABJCJP-QMTHXVAHSA-N 1 0 286.350 3.573 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H](C)CCCCO)c1O ZINC000834876324 1131716065 /nfs/dbraw/zinc/71/60/65/1131716065.db2.gz AKZPWWOTSYAQKN-VXGBXAGGSA-N 1 0 285.815 3.556 20 10 CHCDRO CO[C@@](C)(C[NH2+][C@@H](C)c1cc(C)ccc1O)c1ccccc1 ZINC000834884118 1131717835 /nfs/dbraw/zinc/71/78/35/1131717835.db2.gz KKLVLKPLDJRVDW-KXBFYZLASA-N 1 0 299.414 3.913 20 10 CHCDRO CC(C)[C@@H]1C[C@H](C[NH2+][C@@H](C)c2cc(F)ccc2O)CCO1 ZINC000834884619 1131717890 /nfs/dbraw/zinc/71/78/90/1131717890.db2.gz AAUOMQPHOTWHSC-AHIWAGSCSA-N 1 0 295.398 3.633 20 10 CHCDRO Cc1ccncc1C[NH2+][C@H](C)c1cc(Cl)cc(C)c1O ZINC000834886484 1131718500 /nfs/dbraw/zinc/71/85/00/1131718500.db2.gz MODXOJHRXLXEPZ-GFCCVEGCSA-N 1 0 290.794 3.908 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@]2(C)CC2(Cl)Cl)c(O)c1 ZINC000834885907 1131718634 /nfs/dbraw/zinc/71/86/34/1131718634.db2.gz YVAFSMJPRGAAEB-ZWNOBZJWSA-N 1 0 288.218 3.935 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@H]2CCCC[C@@H]2O)c1O ZINC000834897123 1131721749 /nfs/dbraw/zinc/72/17/49/1131721749.db2.gz PTGJSJUWLPBKHP-JMSVASOKSA-N 1 0 297.826 3.556 20 10 CHCDRO CCn1ccnc1[C@H](C)[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000834897000 1131721871 /nfs/dbraw/zinc/72/18/71/1131721871.db2.gz XXCHQMAKUXEDRX-KBPBESRZSA-N 1 0 287.407 3.637 20 10 CHCDRO CCCc1ncc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)o1 ZINC000834898483 1131723270 /nfs/dbraw/zinc/72/32/70/1131723270.db2.gz DSCLVSDLDVDWGU-CYBMUJFWSA-N 1 0 287.407 3.544 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)[C@H](OC)C1CC1)c1ccc(C)cc1O ZINC000834901922 1131727294 /nfs/dbraw/zinc/72/72/94/1131727294.db2.gz BSFOUGOWXTXEIJ-NUTKFTJISA-N 1 0 277.408 3.555 20 10 CHCDRO CO[C@@H]([C@@H](C)[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O)C1CC1 ZINC000834904973 1131728348 /nfs/dbraw/zinc/72/83/48/1131728348.db2.gz RKBAECRNCFAORY-USBNGQNGSA-N 1 0 297.826 3.818 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CCC[C@H]2CCOC2)cc1 ZINC000834905964 1131728541 /nfs/dbraw/zinc/72/85/41/1131728541.db2.gz VOYNKDFUYZWDFV-HOTGVXAUSA-N 1 0 290.451 3.610 20 10 CHCDRO CC[C@@H]([NH2+]CC(C)(C)C(C)(C)O)c1cc(Cl)ccc1O ZINC000834904265 1131728991 /nfs/dbraw/zinc/72/89/91/1131728991.db2.gz NWGCZSIDSYVMNM-CYBMUJFWSA-N 1 0 299.842 3.883 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]CCC[C@H]2CCOC2)c1O ZINC000834906619 1131729328 /nfs/dbraw/zinc/72/93/28/1131729328.db2.gz YOVRQTABWLWIMD-OLZOCXBDSA-N 1 0 297.826 3.821 20 10 CHCDRO CC[C@@H]([NH2+]CC(C)(C)C(C)(C)O)c1ccc(C)cc1O ZINC000834905481 1131729363 /nfs/dbraw/zinc/72/93/63/1131729363.db2.gz WRZWKVYYXIEREG-CQSZACIVSA-N 1 0 279.424 3.538 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccc(C)cn1)c1ccc(N(C)C)cc1 ZINC000834909005 1131729998 /nfs/dbraw/zinc/72/99/98/1131729998.db2.gz ICUNNEACKKSSAM-LJQANCHMSA-N 1 0 297.446 3.739 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCc2ccc(C)cn2)cc1 ZINC000834908658 1131730259 /nfs/dbraw/zinc/73/02/59/1131730259.db2.gz GKIKZFOKZVLWQL-MRXNPFEDSA-N 1 0 297.446 3.739 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCOC(C)(C)C1)c1ccc(N(C)C)cc1 ZINC000834912137 1131731697 /nfs/dbraw/zinc/73/16/97/1131731697.db2.gz WHBMKKODEINOCR-CABCVRRESA-N 1 0 290.451 3.608 20 10 CHCDRO CCO[C@@H]1CCC[C@H]1[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000834912904 1131731818 /nfs/dbraw/zinc/73/18/18/1131731818.db2.gz NGQGOFIAVCBJST-WDBKCZKBSA-N 1 0 283.799 3.654 20 10 CHCDRO Oc1cc(Cl)ccc1C[NH+]1CCC(C(F)(F)F)CC1 ZINC001140462264 1131748904 /nfs/dbraw/zinc/74/89/04/1131748904.db2.gz CPRLEEWHBIRDJL-UHFFFAOYSA-N 1 0 293.716 3.820 20 10 CHCDRO C[N@@H+](Cc1ccc(Cl)cc1O)C[C@H]1CC1(C)C ZINC001140465660 1131751452 /nfs/dbraw/zinc/75/14/52/1131751452.db2.gz QGUQCMFSGZQFBB-LLVKDONJSA-N 1 0 253.773 3.524 20 10 CHCDRO CC[N@H+](C/C=C/c1ccc(N(C)C)cc1)Cc1ccccn1 ZINC000835030384 1131759268 /nfs/dbraw/zinc/75/92/68/1131759268.db2.gz XQXLOLXXLPTNTQ-BQYQJAHWSA-N 1 0 295.430 3.683 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CC[C@H](c3ccncc3)C2)cc1 ZINC000846907816 1131760701 /nfs/dbraw/zinc/76/07/01/1131760701.db2.gz KDUBEDJCWIGEEE-SFHVURJKSA-N 1 0 295.430 3.527 20 10 CHCDRO C[C@@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)c1ccccn1 ZINC000835033100 1131761079 /nfs/dbraw/zinc/76/10/79/1131761079.db2.gz CKCMZHQIOZXXDL-IDTUSYRASA-N 1 0 281.403 3.512 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]Cc2cccs2)cc1 ZINC000835033146 1131761179 /nfs/dbraw/zinc/76/11/79/1131761179.db2.gz OXKDOQLOOWGCNJ-HWKANZROSA-N 1 0 272.417 3.617 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+][C@H]2CCC(F)(F)C2)cc1 ZINC000835042911 1131762288 /nfs/dbraw/zinc/76/22/88/1131762288.db2.gz LVOINSAXMLNDPH-NQHOJNORSA-N 1 0 280.362 3.543 20 10 CHCDRO CCC1([NH2+]C/C=C/c2ccc(N(C)C)cc2)CCC1 ZINC000835042116 1131762723 /nfs/dbraw/zinc/76/27/23/1131762723.db2.gz GXJCJGIOKYDQFG-FNORWQNLSA-N 1 0 258.409 3.688 20 10 CHCDRO CC(C)c1cc(C[NH2+]C/C=C/c2ccc(N(C)C)cc2)on1 ZINC000835039999 1131762763 /nfs/dbraw/zinc/76/27/63/1131762763.db2.gz OKIDSJHKAZWDKD-AATRIKPKSA-N 1 0 299.418 3.667 20 10 CHCDRO C[C@@H]1CCSCC[N@@H+]1C/C=C/c1ccc(N(C)C)cc1 ZINC000835049398 1131765094 /nfs/dbraw/zinc/76/50/94/1131765094.db2.gz RDRBANMEMZXUEO-MBVDDHJVSA-N 1 0 290.476 3.593 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]CCC2(F)CCC2)cc1 ZINC000835054183 1131766493 /nfs/dbraw/zinc/76/64/93/1131766493.db2.gz RZIPLVMDNUYQTE-HWKANZROSA-N 1 0 276.399 3.638 20 10 CHCDRO Cc1ccc(C[N@@H+](C)C/C=C\c2ccc(N(C)C)cc2)nc1 ZINC000835051250 1131767092 /nfs/dbraw/zinc/76/70/92/1131767092.db2.gz XQDITESJYQEAOI-WAYWQWQTSA-N 1 0 295.430 3.601 20 10 CHCDRO [O-]c1cc(F)cc(F)c1C[N@@H+]1CCC12CCCCC2 ZINC001140582657 1131807415 /nfs/dbraw/zinc/80/74/15/1131807415.db2.gz LWIVHQKPBONJSB-UHFFFAOYSA-N 1 0 267.319 3.579 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2C[C@@H]3C[C@H](C2)c2ccccc23)c1 ZINC001140622833 1131831850 /nfs/dbraw/zinc/83/18/50/1131831850.db2.gz AZPUYGVDAHLVCA-GASCZTMLSA-N 1 0 279.383 3.787 20 10 CHCDRO Cc1c(O)ccc(C[N@H+](Cc2ccccc2)C2CCC2)c1O ZINC001140750033 1131906631 /nfs/dbraw/zinc/90/66/31/1131906631.db2.gz TWCLPMDMPFDEAH-UHFFFAOYSA-N 1 0 297.398 3.961 20 10 CHCDRO CC[N@H+](Cc1cccc(F)c1)Cc1ccc(O)c(C)c1O ZINC001140748170 1131906877 /nfs/dbraw/zinc/90/68/77/1131906877.db2.gz TVQDVGCGWPHEAU-UHFFFAOYSA-N 1 0 289.350 3.567 20 10 CHCDRO Cc1cc(C[NH2+][C@H](C)c2cccs2)ccc1N(C)C ZINC000773002586 1131914286 /nfs/dbraw/zinc/91/42/86/1131914286.db2.gz WKSHXYMNHXROMB-CYBMUJFWSA-N 1 0 274.433 3.973 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H](CO)CC(C)(C)C)cc1 ZINC000773077554 1131937690 /nfs/dbraw/zinc/93/76/90/1131937690.db2.gz RXHNEDBUFBLJJU-HOCLYGCPSA-N 1 0 292.467 3.590 20 10 CHCDRO CCN(CC)c1ccc(C[NH+]2CCC3(CC3)CC2)c(O)c1 ZINC001140851068 1131947720 /nfs/dbraw/zinc/94/77/20/1131947720.db2.gz ZUJIWZRECZOKTQ-UHFFFAOYSA-N 1 0 288.435 3.614 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2ccc(N(C)C)cc2Cl)C2(CC2)C1 ZINC001140926689 1131965248 /nfs/dbraw/zinc/96/52/48/1131965248.db2.gz QIYRHHRIYKEBHK-LBPRGKRZSA-N 1 0 278.827 3.780 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)CC(C)(C)C)c(Cl)c1 ZINC001140923433 1131965501 /nfs/dbraw/zinc/96/55/01/1131965501.db2.gz AFYJOMBWFHIAIS-UHFFFAOYSA-N 1 0 268.832 3.884 20 10 CHCDRO Cc1ccc(C[N@@H+]2CCc3cc(C)ccc3C2)c(O)c1 ZINC001140954762 1131971286 /nfs/dbraw/zinc/97/12/86/1131971286.db2.gz YHJHNPPMJBDZKG-UHFFFAOYSA-N 1 0 267.372 3.567 20 10 CHCDRO Cc1ccc(C[N@@H+]2CCSc3ccccc3C2)c(O)c1 ZINC001140954063 1131972034 /nfs/dbraw/zinc/97/20/34/1131972034.db2.gz KKYKXJIRMXNALU-UHFFFAOYSA-N 1 0 285.412 3.809 20 10 CHCDRO Cc1ccc(C[N@@H+]2CC[C@H](c3ccc(F)cc3)C2)c(O)c1 ZINC001140951102 1131972325 /nfs/dbraw/zinc/97/23/25/1131972325.db2.gz ZAJLVZKIPJVTBU-HNNXBMFYSA-N 1 0 285.362 3.829 20 10 CHCDRO CCc1cc(NCc2cc3ccccc3cc2O)cc[nH+]1 ZINC001171406793 1131974849 /nfs/dbraw/zinc/97/48/49/1131974849.db2.gz FSHFUEMEYPCKTL-UHFFFAOYSA-N 1 0 278.355 3.537 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2ccns2)c1 ZINC000715964026 1131999503 /nfs/dbraw/zinc/99/95/03/1131999503.db2.gz CLEYIIDOCHDEFG-MNOVXSKESA-N 1 0 262.378 3.569 20 10 CHCDRO COc1ccc(N2CC[C@H]([NH2+]C3CCCCCC3)C2)cc1 ZINC001203090169 1132004325 /nfs/dbraw/zinc/00/43/25/1132004325.db2.gz OTKQVMGZDCRENU-INIZCTEOSA-N 1 0 288.435 3.586 20 10 CHCDRO C[N@H+](Cc1cc2c3c(c1)CCCN3CCC2)C(C)(C)C ZINC001141076696 1132005888 /nfs/dbraw/zinc/00/58/88/1132005888.db2.gz ZXKKQOPLAKKIND-UHFFFAOYSA-N 1 0 272.436 3.616 20 10 CHCDRO C[C@@H]([NH2+]CCc1cccs1)c1ccc(N(C)C)cc1 ZINC000037211818 1132022192 /nfs/dbraw/zinc/02/21/92/1132022192.db2.gz LGPSBSWJMJWUTM-CYBMUJFWSA-N 1 0 274.433 3.707 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1ccncc1 ZINC000037217757 1132024116 /nfs/dbraw/zinc/02/41/16/1132024116.db2.gz KNWMIJWVRKVFFE-UONOGXRCSA-N 1 0 269.392 3.559 20 10 CHCDRO C[N@H+](Cc1cc(O)ccc1O)Cc1cccc2ccccc21 ZINC001141158513 1132030825 /nfs/dbraw/zinc/03/08/25/1132030825.db2.gz CCAYXYZUENOUSQ-UHFFFAOYSA-N 1 0 293.366 3.883 20 10 CHCDRO CCCC[NH+](CCCC)Cc1cc(O)ccc1O ZINC001141159976 1132031784 /nfs/dbraw/zinc/03/17/84/1132031784.db2.gz NVWOUDQRWOCDPJ-UHFFFAOYSA-N 1 0 251.370 3.500 20 10 CHCDRO CCOc1cccc(C[NH+]2CC3(C2)CCCCC3)c1O ZINC000839131845 1132182421 /nfs/dbraw/zinc/18/24/21/1132182421.db2.gz DYJVFGXEPPDDQG-UHFFFAOYSA-N 1 0 275.392 3.557 20 10 CHCDRO Cc1ccc(C[NH2+]C/C=C/c2ccc(N(C)C)cc2)nc1C ZINC000839164966 1132187214 /nfs/dbraw/zinc/18/72/14/1132187214.db2.gz IGZGVDVLBINJSS-AATRIKPKSA-N 1 0 295.430 3.567 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)cc1 ZINC000839190606 1132190243 /nfs/dbraw/zinc/19/02/43/1132190243.db2.gz INGQBXQFWBVIHN-ISHXATMKSA-N 1 0 270.420 3.544 20 10 CHCDRO C[C@H](O)CC[N@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000839530946 1132220920 /nfs/dbraw/zinc/22/09/20/1132220920.db2.gz GLYYFYOYIHLZKV-HOTGVXAUSA-N 1 0 299.414 3.726 20 10 CHCDRO Cc1cc(C)c(C[NH2+][C@H](C)CCOCC(C)C)c(O)c1 ZINC001172463567 1132242988 /nfs/dbraw/zinc/24/29/88/1132242988.db2.gz QAKJTLNUVHCIGA-OAHLLOKOSA-N 1 0 279.424 3.550 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CCO[C@@H](C2CCC2)C1 ZINC000840175079 1132249562 /nfs/dbraw/zinc/24/95/62/1132249562.db2.gz GBJJMDQUIRDLBT-LJQANCHMSA-N 1 0 297.398 3.546 20 10 CHCDRO CC(C)O[C@H]1C[C@@H]([NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)C1 ZINC000840764139 1132283763 /nfs/dbraw/zinc/28/37/63/1132283763.db2.gz NMIJCNAAHVGEJC-FMSGJZPZSA-N 1 0 293.382 3.625 20 10 CHCDRO CC(C)O[C@H]1C[C@@H]([NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)C1 ZINC000840764141 1132284135 /nfs/dbraw/zinc/28/41/35/1132284135.db2.gz NMIJCNAAHVGEJC-NRWUCQMLSA-N 1 0 293.382 3.625 20 10 CHCDRO C[C@H](CCCc1cccnc1)[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000840771077 1132284978 /nfs/dbraw/zinc/28/49/78/1132284978.db2.gz AAKCBHWNTVXPJF-RHSMWYFYSA-N 1 0 296.414 3.776 20 10 CHCDRO COC1CCC([NH2+][C@H](C)c2ccc(C)c(C)c2O)CC1 ZINC000840792086 1132287726 /nfs/dbraw/zinc/28/77/26/1132287726.db2.gz GPRFRPVNSMRIMO-WLYUNCDWSA-N 1 0 277.408 3.617 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@@H]1C[C@H]1c1ccccc1F)CC2 ZINC000840788271 1132287886 /nfs/dbraw/zinc/28/78/86/1132287886.db2.gz XOLYWLRUCWVQNH-NUEKZKHPSA-N 1 0 283.346 3.664 20 10 CHCDRO C[C@@H]([NH2+]C1CCC(C(F)F)CC1)c1ccccc1O ZINC000840807270 1132289635 /nfs/dbraw/zinc/28/96/35/1132289635.db2.gz RTOYECIKGXLYQI-VOMCLLRMSA-N 1 0 269.335 3.867 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCC[C@@H]3C[C@@H]32)c(O)c1C ZINC000840820100 1132290018 /nfs/dbraw/zinc/29/00/18/1132290018.db2.gz JVKKDWBLASAHCS-VDERGJSUSA-N 1 0 259.393 3.848 20 10 CHCDRO COCC[C@@H](C)C[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000840835603 1132291836 /nfs/dbraw/zinc/29/18/36/1132291836.db2.gz OCMHHBVFHLKDEA-ZIAGYGMSSA-N 1 0 291.435 3.594 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)C1CC(C)(C)OC(C)(C)C1 ZINC001172660793 1132292746 /nfs/dbraw/zinc/29/27/46/1132292746.db2.gz XXBIJXKJSGHREI-UHFFFAOYSA-N 1 0 291.435 3.950 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CS[C@H](C)C1)c1ccc(C)cc1O ZINC000840858963 1132295586 /nfs/dbraw/zinc/29/55/86/1132295586.db2.gz FGEKWZMMQRBCCZ-DYEKYZERSA-N 1 0 265.422 3.635 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1C[C@H](C)O[C@@H]1C)c1ccc(C)cc1O ZINC000840872306 1132299013 /nfs/dbraw/zinc/29/90/13/1132299013.db2.gz KHQXXYSVLPZEMF-FQLMCAECSA-N 1 0 277.408 3.555 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)C1(OC)CCC1)c1ccc(C)cc1O ZINC000840883914 1132302053 /nfs/dbraw/zinc/30/20/53/1132302053.db2.gz HDLCQBRRDONMCR-UKRRQHHQSA-N 1 0 277.408 3.699 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+][C@H](C)c1ccccn1 ZINC000840895349 1132306770 /nfs/dbraw/zinc/30/67/70/1132306770.db2.gz XFVGRPURPRTPSJ-HZPDHXFCSA-N 1 0 297.446 3.738 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+](C)[C@@H](C)c1ccccn1 ZINC000840936891 1132309408 /nfs/dbraw/zinc/30/94/08/1132309408.db2.gz NNWZHLYSSVZJNS-HNNXBMFYSA-N 1 0 283.419 3.649 20 10 CHCDRO Cc1csc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)n1 ZINC000840931545 1132310245 /nfs/dbraw/zinc/31/02/45/1132310245.db2.gz HPOZEVMWRXMPOC-ZDUSSCGKSA-N 1 0 289.448 3.677 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1c2ccccc2O[C@@H]1C ZINC000840947206 1132311335 /nfs/dbraw/zinc/31/13/35/1132311335.db2.gz RCOOFSDQYWFIBR-AUUYWEPGSA-N 1 0 296.414 3.673 20 10 CHCDRO COC[C@H]1CCC[N@H+](Cc2c(O)cc(C)cc2Cl)CC1 ZINC000840952479 1132311447 /nfs/dbraw/zinc/31/14/47/1132311447.db2.gz ATSVJLCZYVIWPL-ZDUSSCGKSA-N 1 0 297.826 3.603 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CC[C@@]2(C)[C@@H](C1)C2(F)F ZINC000840948000 1132311743 /nfs/dbraw/zinc/31/17/43/1132311743.db2.gz OUSVWRSDDHZWND-CVEARBPZSA-N 1 0 294.389 3.538 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC000840942004 1132312246 /nfs/dbraw/zinc/31/22/46/1132312246.db2.gz VOHQJHUTPJJUIR-CYBMUJFWSA-N 1 0 282.378 3.586 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCCC[C@H]1c1cc[nH]n1 ZINC000840947972 1132312292 /nfs/dbraw/zinc/31/22/92/1132312292.db2.gz IFUACPRPAOSYGW-SFHVURJKSA-N 1 0 298.434 3.511 20 10 CHCDRO Cc1cc(O)c(C[NH2+]Cc2ccc(C)c(C)n2)c(Cl)c1 ZINC000840952473 1132312592 /nfs/dbraw/zinc/31/25/92/1132312592.db2.gz ALZKGKKWZFLRFZ-UHFFFAOYSA-N 1 0 290.794 3.656 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2cnccc2C(C)(C)C)c1 ZINC000840959738 1132313076 /nfs/dbraw/zinc/31/30/76/1132313076.db2.gz UMERNJIOMVUVRB-UHFFFAOYSA-N 1 0 284.403 3.683 20 10 CHCDRO CCOCc1cc(C[NH2+][C@@H]2CCCC[C@H]2F)ccc1OC ZINC000840961930 1132313589 /nfs/dbraw/zinc/31/35/89/1132313589.db2.gz GOBJOTYOSGGWFN-HZPDHXFCSA-N 1 0 295.398 3.602 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+][C@@H]2CCCC[C@H]2F)cc1 ZINC000840962145 1132313912 /nfs/dbraw/zinc/31/39/12/1132313912.db2.gz IOVSLJJTVQDPMG-MBZYTVFJSA-N 1 0 276.399 3.636 20 10 CHCDRO CN(C)c1ccc(C[NH2+]Cc2cnccc2C(C)(C)C)cc1 ZINC000840959675 1132314412 /nfs/dbraw/zinc/31/44/12/1132314412.db2.gz STNSBZZZZYSBQK-UHFFFAOYSA-N 1 0 297.446 3.735 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CCCC12CC2 ZINC001231588876 1132317128 /nfs/dbraw/zinc/31/71/28/1132317128.db2.gz XYBPEUYCPYTJOQ-UHFFFAOYSA-N 1 0 253.345 3.674 20 10 CHCDRO CC(C)O[C@H]1CC[N@H+](Cc2c(O)ccc3ccccc32)C1 ZINC001231591243 1132320236 /nfs/dbraw/zinc/32/02/36/1132320236.db2.gz ZMABJNIFUYMMLV-HNNXBMFYSA-N 1 0 285.387 3.545 20 10 CHCDRO Cc1cccc(CC[N@@H+](C)Cc2cccc(C)c2O)c1 ZINC001231593412 1132320701 /nfs/dbraw/zinc/32/07/01/1132320701.db2.gz WNSOKFNPNIGHGI-UHFFFAOYSA-N 1 0 269.388 3.684 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccc(N)cc1)[C@@H](C)c1ccccc1 ZINC000841035311 1132321273 /nfs/dbraw/zinc/32/12/73/1132321273.db2.gz MHKUMFSUGMUBLJ-HUUCEWRRSA-N 1 0 268.404 3.593 20 10 CHCDRO C[C@@H]1CC(C)(C)CC[C@@H]1[NH2+]CCc1ccc(N)cc1 ZINC000841033860 1132321514 /nfs/dbraw/zinc/32/15/14/1132321514.db2.gz CKEZWLVZQALQFX-CJNGLKHVSA-N 1 0 260.425 3.616 20 10 CHCDRO C[C@H](c1ccccc1)[C@H](C)[NH2+]CCc1ccc(N)cc1 ZINC000841035309 1132321815 /nfs/dbraw/zinc/32/18/15/1132321815.db2.gz MHKUMFSUGMUBLJ-GJZGRUSLSA-N 1 0 268.404 3.593 20 10 CHCDRO Cc1cc(C[NH2+]CCc2ccc(N)cc2)ccc1Cl ZINC000841036544 1132321993 /nfs/dbraw/zinc/32/19/93/1132321993.db2.gz UWPWOCMDYMMFCB-UHFFFAOYSA-N 1 0 274.795 3.563 20 10 CHCDRO C[C@@H](CC[NH2+]CCc1ccc(N)cc1)c1ccccc1 ZINC000841036567 1132322084 /nfs/dbraw/zinc/32/20/84/1132322084.db2.gz VVEDSKRPJWGRFU-HNNXBMFYSA-N 1 0 268.404 3.595 20 10 CHCDRO CC[NH2+]Cc1cccc(NCc2cccc(Cl)c2O)c1 ZINC000841042971 1132324673 /nfs/dbraw/zinc/32/46/73/1132324673.db2.gz MJLQEWWEERLRFS-UHFFFAOYSA-N 1 0 290.794 3.767 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H]2CCCc3cc(N)ccc32)cc1 ZINC000841058731 1132324911 /nfs/dbraw/zinc/32/49/11/1132324911.db2.gz SLWHNEZIQNRZGI-IBGZPJMESA-N 1 0 295.430 3.502 20 10 CHCDRO COc1ccc(C[NH2+][C@H]2CCc3ccc(C)cc3C2)cc1C ZINC001172829901 1132325783 /nfs/dbraw/zinc/32/57/83/1132325783.db2.gz HDLHAXQNIUPKEH-IBGZPJMESA-N 1 0 295.426 3.959 20 10 CHCDRO CCc1ccc(C[N@H+](CC)Cc2ccc(N(C)C)cc2)nc1 ZINC001231642686 1132332054 /nfs/dbraw/zinc/33/20/54/1132332054.db2.gz MATHNNBMTWXRIS-UHFFFAOYSA-N 1 0 297.446 3.732 20 10 CHCDRO CO[C@H]1CCC[C@H]([NH2+]Cc2cc3ccccc3cc2O)C1 ZINC001172922625 1132362945 /nfs/dbraw/zinc/36/29/45/1132362945.db2.gz IYRVPKZMEBZPGQ-IRXDYDNUSA-N 1 0 285.387 3.593 20 10 CHCDRO Cc1cc(C)c(C[NH+]2Cc3ccccc3C2)c(O)c1 ZINC001231841637 1132375674 /nfs/dbraw/zinc/37/56/74/1132375674.db2.gz GDWZJLAZAZYOQV-UHFFFAOYSA-N 1 0 253.345 3.525 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC(C)(C)C2)cc1Cl ZINC001231870775 1132376048 /nfs/dbraw/zinc/37/60/48/1132376048.db2.gz SJHMAYXUVBMBAE-UHFFFAOYSA-N 1 0 253.773 3.586 20 10 CHCDRO Cc1cc([C@@H]2CCC[N@@H+]2Cc2c(C)cc(C)cc2O)no1 ZINC001231841580 1132376125 /nfs/dbraw/zinc/37/61/25/1132376125.db2.gz CAFYPBCZXGFMBM-INIZCTEOSA-N 1 0 286.375 3.643 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CC[C@H](Oc3ccccc3)C2)c(O)c1 ZINC001231843850 1132376769 /nfs/dbraw/zinc/37/67/69/1132376769.db2.gz BZAMKOJKKKLSKY-KRWDZBQOSA-N 1 0 297.398 3.662 20 10 CHCDRO Cc1cc(C)c(C[N@H+]2CC[C@H](C)C(F)(F)CC2)c(O)c1 ZINC001231842249 1132377273 /nfs/dbraw/zinc/37/72/73/1132377273.db2.gz LRJKSIHILUWYEC-ZDUSSCGKSA-N 1 0 283.362 3.876 20 10 CHCDRO COc1cccc(CC[N@H+](C)Cc2c(C)cc(C)cc2O)c1 ZINC001231845580 1132378025 /nfs/dbraw/zinc/37/80/25/1132378025.db2.gz BKEMHXULTSNLGF-UHFFFAOYSA-N 1 0 299.414 3.692 20 10 CHCDRO Cc1cc(O)c(C[NH+]2CCC(OC3CCC3)CC2)cc1C ZINC000841687356 1132383381 /nfs/dbraw/zinc/38/33/81/1132383381.db2.gz FGLJZRCVLPRKSO-UHFFFAOYSA-N 1 0 289.419 3.543 20 10 CHCDRO C[C@@H]([NH2+]CCC[NH+]1CCCCC1)c1ccc(Cl)cc1[O-] ZINC000841743483 1132387561 /nfs/dbraw/zinc/38/75/61/1132387561.db2.gz HPQCPFWSOWMJCS-CYBMUJFWSA-N 1 0 296.842 3.572 20 10 CHCDRO C[C@H]([NH2+]C[C@@H](O)C1CCCCC1)c1ccc(Cl)cc1O ZINC000841746419 1132389205 /nfs/dbraw/zinc/38/92/05/1132389205.db2.gz GOXLRKGQCAAZNH-MEDUHNTESA-N 1 0 297.826 3.637 20 10 CHCDRO C[C@@H]([NH2+]CCOCC1CCC1)c1ccc(Cl)cc1O ZINC000841751199 1132389971 /nfs/dbraw/zinc/38/99/71/1132389971.db2.gz FTVLCGMPCMHEIR-LLVKDONJSA-N 1 0 283.799 3.513 20 10 CHCDRO Cc1cnc(C[NH2+][C@H](C)c2ccc(Cl)cc2O)s1 ZINC000841749008 1132390437 /nfs/dbraw/zinc/39/04/37/1132390437.db2.gz CPKQEZQZQXNGGO-SECBINFHSA-N 1 0 282.796 3.661 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2ccc3ccccc3c2O)C2(CC2)C1 ZINC001231883714 1132390734 /nfs/dbraw/zinc/39/07/34/1132390734.db2.gz SYIVXYZOUKZYAI-ZDUSSCGKSA-N 1 0 267.372 3.920 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)c1ccc(Cl)cc1O)c1ccc[nH]1 ZINC000841753296 1132391430 /nfs/dbraw/zinc/39/14/30/1132391430.db2.gz YRCKOFKCFQTDQN-NXEZZACHSA-N 1 0 264.756 3.786 20 10 CHCDRO Oc1c(C[N@@H+]2CCC[C@@H](F)CC2)ccc2ccccc21 ZINC001231879685 1132391434 /nfs/dbraw/zinc/39/14/34/1132391434.db2.gz NPKLVOYRKCQMCV-OAHLLOKOSA-N 1 0 273.351 3.869 20 10 CHCDRO C[N@H+](CCc1cccnc1)Cc1ccc2ccccc2c1O ZINC001231880991 1132391617 /nfs/dbraw/zinc/39/16/17/1132391617.db2.gz PNLQKJXSLUEHRC-UHFFFAOYSA-N 1 0 292.382 3.615 20 10 CHCDRO CCCc1ncc(C[NH2+][C@H](C)c2ccc(Cl)cc2O)o1 ZINC000841753378 1132391771 /nfs/dbraw/zinc/39/17/71/1132391771.db2.gz HHUOOUVXSGXCRJ-SNVBAGLBSA-N 1 0 294.782 3.837 20 10 CHCDRO CO[C@@H](C[NH2+][C@H](C)c1c(C)cc(C)cc1O)CC(C)C ZINC000841754708 1132392011 /nfs/dbraw/zinc/39/20/11/1132392011.db2.gz BOOQFFJAYGIPSL-HUUCEWRRSA-N 1 0 279.424 3.721 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)c1ccc[nH]1 ZINC000841753298 1132392533 /nfs/dbraw/zinc/39/25/33/1132392533.db2.gz YRCKOFKCFQTDQN-UWVGGRQHSA-N 1 0 264.756 3.786 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H]2COCc3ccccc32)c1 ZINC000841758348 1132394911 /nfs/dbraw/zinc/39/49/11/1132394911.db2.gz AOKMYHVAFOGHOJ-CXAGYDPISA-N 1 0 283.371 3.623 20 10 CHCDRO CC(C)O[C@H]1C[C@@H]([NH2+][C@@H](C)c2ccc(Cl)cc2O)C1 ZINC000841757619 1132395049 /nfs/dbraw/zinc/39/50/49/1132395049.db2.gz NVVNWVJBYUUVKB-WCFLWFBJSA-N 1 0 283.799 3.652 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H](CO)CC2CCCCC2)c(O)c1 ZINC000841760978 1132396989 /nfs/dbraw/zinc/39/69/89/1132396989.db2.gz HLJFXZKJRWYVIW-GDBMZVCRSA-N 1 0 291.435 3.683 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH+]1CCC(OC2CCC2)CC1 ZINC000841888611 1132400140 /nfs/dbraw/zinc/40/01/40/1132400140.db2.gz NAYNQTRPTGEPLS-UHFFFAOYSA-N 1 0 295.810 3.579 20 10 CHCDRO CC[C@H]1CC[C@@H]([NH2+][C@@H](C)c2ccc(N(C)C)cc2)C1 ZINC001173269250 1132434469 /nfs/dbraw/zinc/43/44/69/1132434469.db2.gz UJFYTAYSXNCDTR-OFQRWUPVSA-N 1 0 260.425 3.982 20 10 CHCDRO CC(C)C1CC[NH+](Cc2cc(Cl)c(O)cc2O)CC1 ZINC001232262818 1132445074 /nfs/dbraw/zinc/44/50/74/1132445074.db2.gz RJHQLFRDHMNGFQ-UHFFFAOYSA-N 1 0 283.799 3.619 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CCC3(CCCC3)C2)cc1Cl ZINC001232264937 1132447563 /nfs/dbraw/zinc/44/75/63/1132447563.db2.gz ORRIHURZNOGALG-UHFFFAOYSA-N 1 0 295.810 3.820 20 10 CHCDRO CCOCc1cc(C[NH2+][C@@H]2CC[C@@H]3C[C@@H]3C2)ccc1OC ZINC000842775439 1132461008 /nfs/dbraw/zinc/46/10/08/1132461008.db2.gz CLKHPGORIDNSLE-BFYDXBDKSA-N 1 0 289.419 3.510 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]CC1CCC(F)CC1 ZINC000842780495 1132461366 /nfs/dbraw/zinc/46/13/66/1132461366.db2.gz VSFODLOTKQOQPD-UHFFFAOYSA-N 1 0 271.763 3.664 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H](C)CC(F)F)c(O)c1 ZINC000842892782 1132474614 /nfs/dbraw/zinc/47/46/14/1132474614.db2.gz FFNPPZVBTOXSBV-JQWIXIFHSA-N 1 0 271.351 3.951 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CCS[C@H]2C)c(O)c1 ZINC000842930945 1132478153 /nfs/dbraw/zinc/47/81/53/1132478153.db2.gz ZJZCTGSULKEBKM-RWMBFGLXSA-N 1 0 265.422 3.554 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CC[C@H]2C[C@H]2C1)c1ccc(C)cc1O ZINC000842931000 1132478174 /nfs/dbraw/zinc/47/81/74/1132478174.db2.gz ZXOUFUCMGAMBQF-AYDFFVQHSA-N 1 0 259.393 3.930 20 10 CHCDRO COc1cccc([C@@H](C)N2CCCc3cc(C[NH3+])ccc32)c1 ZINC000843350954 1132522629 /nfs/dbraw/zinc/52/26/29/1132522629.db2.gz YROJRDOFRCDECY-CQSZACIVSA-N 1 0 296.414 3.668 20 10 CHCDRO CC(C)[N@H+](Cc1ccccc1)Cc1ccc(N(C)C)cc1O ZINC001232834753 1132528370 /nfs/dbraw/zinc/52/83/70/1132528370.db2.gz LOBVFUHJJCHYOI-UHFFFAOYSA-N 1 0 298.430 3.869 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC[C@H]2c2ccccc2)c(O)c1 ZINC001232838443 1132529164 /nfs/dbraw/zinc/52/91/64/1132529164.db2.gz FPZGUFVNFGHHED-SFHVURJKSA-N 1 0 296.414 3.795 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)CCCc2ccccc2)c(O)c1 ZINC001232839700 1132529461 /nfs/dbraw/zinc/52/94/61/1132529461.db2.gz UGGLFVGBKGNPTC-UHFFFAOYSA-N 1 0 298.430 3.523 20 10 CHCDRO CC(C)O[C@@H]1CC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC000843414277 1132529788 /nfs/dbraw/zinc/52/97/88/1132529788.db2.gz YOYHEECULKYOAR-MRXNPFEDSA-N 1 0 285.387 3.545 20 10 CHCDRO CC(C)(C)c1ccc(O)c(C[NH+]2C[C@H]3CCC[C@@H]3C2)c1 ZINC001233284412 1132594283 /nfs/dbraw/zinc/59/42/83/1132594283.db2.gz TYLMJGVJGSYEDO-ZIAGYGMSSA-N 1 0 273.420 3.922 20 10 CHCDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CCC[C@H]3C[C@H]32)c1 ZINC001233286976 1132595015 /nfs/dbraw/zinc/59/50/15/1132595015.db2.gz QVDPDRJAQLYWFF-SWLSCSKDSA-N 1 0 259.393 3.674 20 10 CHCDRO Nc1ccc(Nc2cc[nH+]cc2Oc2ccccc2)cc1 ZINC001159115977 1132808561 /nfs/dbraw/zinc/80/85/61/1132808561.db2.gz WVIFUGIOERTGLF-UHFFFAOYSA-N 1 0 277.327 3.622 20 10 CHCDRO Cc1c[nH+]ccc1Nc1ccc(Cl)c(Cl)c1O ZINC001174539453 1132900188 /nfs/dbraw/zinc/90/01/88/1132900188.db2.gz GFEWZHSMZHRJHI-UHFFFAOYSA-N 1 0 269.131 3.568 20 10 CHCDRO CC[NH2+]Cc1cccc(Nc2ccc3c(c2)CCCN3)c1 ZINC001159955966 1132928548 /nfs/dbraw/zinc/92/85/48/1132928548.db2.gz BKBRLGJKRSRIDS-UHFFFAOYSA-N 1 0 281.403 3.898 20 10 CHCDRO Oc1ccc(F)cc1Nc1cc[nH+]cc1Oc1ccccc1 ZINC001174627132 1132930964 /nfs/dbraw/zinc/93/09/64/1132930964.db2.gz OSFOPSXFZOHKLC-UHFFFAOYSA-N 1 0 296.301 3.884 20 10 CHCDRO Cc1c[nH+]c(NCc2c(C)cc(C)cc2O)c(C)c1 ZINC001160809864 1132982547 /nfs/dbraw/zinc/98/25/47/1132982547.db2.gz BJHFKMLBIYBVGO-UHFFFAOYSA-N 1 0 256.349 3.633 20 10 CHCDRO Cc1cc(C)c(CNc2cc(N3CCCC3)cc[nH+]2)c(O)c1 ZINC001160810239 1132983263 /nfs/dbraw/zinc/98/32/63/1132983263.db2.gz NUDFHPZSOWLQNH-UHFFFAOYSA-N 1 0 297.402 3.616 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2cccc(Cl)c2C)c1 ZINC001206715284 1133266326 /nfs/dbraw/zinc/26/63/26/1133266326.db2.gz PSRBMAZEWRNBJR-UHFFFAOYSA-N 1 0 275.779 3.952 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CC[C@@H](C)C(F)(F)CC2)c1O ZINC001203602324 1133343768 /nfs/dbraw/zinc/34/37/68/1133343768.db2.gz PCWLTSPBFDZYBN-GFCCVEGCSA-N 1 0 299.361 3.658 20 10 CHCDRO CCOc1cccc(C[N@@H+]2Cc3cccc(C)c3C2)c1O ZINC001203602155 1133344219 /nfs/dbraw/zinc/34/42/19/1133344219.db2.gz FAKXGBARUAYOIO-UHFFFAOYSA-N 1 0 283.371 3.615 20 10 CHCDRO CC[C@@H](c1ccccc1)[N@H+](C)Cc1cccc(OC)c1O ZINC001203596507 1133344321 /nfs/dbraw/zinc/34/43/21/1133344321.db2.gz FPNBTCJWWGTBDA-INIZCTEOSA-N 1 0 285.387 3.984 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CC[C@H]2CCC[C@H]2C1 ZINC001203650906 1133348228 /nfs/dbraw/zinc/34/82/28/1133348228.db2.gz GEFWCXJNLALZRC-NEPJUHHUSA-N 1 0 265.784 3.668 20 10 CHCDRO Oc1cccc2c1C[N@H+](Cc1cccc(Cl)c1)CC2 ZINC001203801741 1133371205 /nfs/dbraw/zinc/37/12/05/1133371205.db2.gz ZGGDDDSHRZCVLT-UHFFFAOYSA-N 1 0 273.763 3.604 20 10 CHCDRO CC1(c2ccccc2)CC[NH+](Cc2ccc(O)c(O)c2)CC1 ZINC001203878756 1133378141 /nfs/dbraw/zinc/37/81/41/1133378141.db2.gz BIEMYYKEMNBEBC-UHFFFAOYSA-N 1 0 297.398 3.652 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CC[C@H]3CCCC[C@@H]3C2)cc1 ZINC001203935683 1133385683 /nfs/dbraw/zinc/38/56/83/1133385683.db2.gz AUFIENSMUKZSQO-IAGOWNOFSA-N 1 0 272.436 3.765 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CC[C@H](Cc3ccccc3)C2)cc1 ZINC001203934100 1133386830 /nfs/dbraw/zinc/38/68/30/1133386830.db2.gz MFDOHRLWFZSINE-LJQANCHMSA-N 1 0 294.442 3.817 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2C[C@H](C)CC23CC3)cc1 ZINC001203942449 1133387573 /nfs/dbraw/zinc/38/75/73/1133387573.db2.gz QUIMZFCMFAIJHL-OAHLLOKOSA-N 1 0 272.436 3.907 20 10 CHCDRO CO[C@H]1CCC[N@H+](Cc2ccc(N(C)C)c3ccccc23)C1 ZINC001204233275 1133422735 /nfs/dbraw/zinc/42/27/35/1133422735.db2.gz PLXAVDFEOXBYMR-INIZCTEOSA-N 1 0 298.430 3.517 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2C[C@@H]3C[C@H]2C[C@H]3F)c2ccccc21 ZINC001204242412 1133424665 /nfs/dbraw/zinc/42/46/65/1133424665.db2.gz PFPNTRURXFJONL-RLFYNMQTSA-N 1 0 298.405 3.838 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2ccc(N3CCCC3)cc2)CCC1(F)F ZINC001204326294 1133438548 /nfs/dbraw/zinc/43/85/48/1133438548.db2.gz WUJZKXPXBVVLKO-CQSZACIVSA-N 1 0 294.389 3.764 20 10 CHCDRO C[N@H+](Cc1ccc(N2CCCC2)cc1)C1CCCC1 ZINC001204326346 1133438877 /nfs/dbraw/zinc/43/88/77/1133438877.db2.gz GFEQNPDTTBGDQP-UHFFFAOYSA-N 1 0 258.409 3.661 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CC[C@H](C)[C@H]3CCCC[C@@H]32)c1 ZINC001204880681 1133495294 /nfs/dbraw/zinc/49/52/94/1133495294.db2.gz FGRXADFAOURPCU-XKQJLSEDSA-N 1 0 289.419 3.801 20 10 CHCDRO CC[N@@H+](Cc1ccc(N(C)C)cc1)C[C@@H](CC(C)C)OC ZINC001205143571 1133536318 /nfs/dbraw/zinc/53/63/18/1133536318.db2.gz PVDQBLQNRVGRSM-GOSISDBHSA-N 1 0 292.467 3.636 20 10 CHCDRO Cn1cccc1[C@@H]1CCC[N@@H+]1Cc1ccc(Cl)cc1O ZINC001205162410 1133539012 /nfs/dbraw/zinc/53/90/12/1133539012.db2.gz NZHLVHLHKCPICL-HNNXBMFYSA-N 1 0 290.794 3.721 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CC[C@H](C)C(C)(C)C2)c1O ZINC001205298885 1133556877 /nfs/dbraw/zinc/55/68/77/1133556877.db2.gz JREWYIKVTWWOSZ-NSHDSACASA-N 1 0 297.826 3.922 20 10 CHCDRO Cc1cnc([C@@H](C)C[NH2+]Cc2ccc(Cl)cc2O)s1 ZINC001205300219 1133557477 /nfs/dbraw/zinc/55/74/77/1133557477.db2.gz WBSBBTPKPBPZNT-VIFPVBQESA-N 1 0 296.823 3.704 20 10 CHCDRO Oc1cccc2c1C[N@H+](Cc1sccc1Cl)CC2 ZINC001205347319 1133565740 /nfs/dbraw/zinc/56/57/40/1133565740.db2.gz LMJJGAVYSWUEED-UHFFFAOYSA-N 1 0 279.792 3.665 20 10 CHCDRO CC(C)c1ccc(O)c(C[NH2+]CC[C@H]2CCO[C@H](C)C2)c1 ZINC001205391146 1133573151 /nfs/dbraw/zinc/57/31/51/1133573151.db2.gz JORVACWHKLZYLG-CABCVRRESA-N 1 0 291.435 3.810 20 10 CHCDRO CCC[C@@]1(COC)CCC[N@@H+]1Cc1ccc(Cl)cc1O ZINC001205540868 1133585579 /nfs/dbraw/zinc/58/55/79/1133585579.db2.gz LHNXTUDUPTZSIS-INIZCTEOSA-N 1 0 297.826 3.827 20 10 CHCDRO CCC[C@H](C[N@H+](C)Cc1ccc(N2CCCC2)cc1)OC ZINC001205708958 1133604496 /nfs/dbraw/zinc/60/44/96/1133604496.db2.gz MSSOHEULJSKWGF-GOSISDBHSA-N 1 0 290.451 3.534 20 10 CHCDRO CCCC[C@H](C)[N@H+](C)Cc1cc(C)cc(OC)c1O ZINC001206122811 1133660424 /nfs/dbraw/zinc/66/04/24/1133660424.db2.gz VWAGRDOAEUREOP-ZDUSSCGKSA-N 1 0 265.397 3.720 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)CC(C)(C)C ZINC001206167960 1133666796 /nfs/dbraw/zinc/66/67/96/1133666796.db2.gz NHQBSYIQIIVQQO-AWEZNQCLSA-N 1 0 262.441 3.975 20 10 CHCDRO COC1([C@@H](C)[NH2+]Cc2cc(C(C)C)ccc2O)CCC1 ZINC001206308384 1133687881 /nfs/dbraw/zinc/68/78/81/1133687881.db2.gz RQHYZDJVIUHSHO-CYBMUJFWSA-N 1 0 277.408 3.563 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]Cc1ccc(C(F)F)nc1 ZINC001206516980 1133713072 /nfs/dbraw/zinc/71/30/72/1133713072.db2.gz JFCOQNCJLOBMJA-UHFFFAOYSA-N 1 0 298.720 3.668 20 10 CHCDRO C[C@H]([NH2+]C1CCC2(CSC2)CC1)c1ccccc1O ZINC001207160243 1133772989 /nfs/dbraw/zinc/77/29/89/1133772989.db2.gz OYILFLMBQGQEDK-LBPRGKRZSA-N 1 0 277.433 3.719 20 10 CHCDRO CCc1cccc(C[NH2+]C(C)(C)/C=C\Cl)c1O ZINC001207595360 1133827161 /nfs/dbraw/zinc/82/71/61/1133827161.db2.gz YQDAIDUBVOVQJW-HJWRWDBZSA-N 1 0 253.773 3.575 20 10 CHCDRO CCCC[C@@H](C)[NH2+]C[C@@H](c1ccc(N(C)C)cc1)N(C)C ZINC001207748301 1133845367 /nfs/dbraw/zinc/84/53/67/1133845367.db2.gz IKMQNYJVPMIUKV-QAPCUYQASA-N 1 0 291.483 3.524 20 10 CHCDRO CS[C@@H](C)CC[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001208141354 1133885277 /nfs/dbraw/zinc/88/52/77/1133885277.db2.gz KCVSXUPLJFUUQO-HNNXBMFYSA-N 1 0 292.492 3.860 20 10 CHCDRO CCO[C@@H]1CC[N@H+](Cc2ccc(-n3c(C)ccc3C)cc2)C1 ZINC001209520048 1134033802 /nfs/dbraw/zinc/03/38/02/1134033802.db2.gz MAMNEKYCMWUNLF-LJQANCHMSA-N 1 0 298.430 3.705 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(C[NH+]2CC(C)C2)cc1 ZINC001209519009 1134033842 /nfs/dbraw/zinc/03/38/42/1134033842.db2.gz PPNWXXPRLZBRJM-UHFFFAOYSA-N 1 0 254.377 3.546 20 10 CHCDRO CC[C@@H](C[NH2+]Cc1cc(C)ccc1O)CC(F)(F)F ZINC000402598913 1134663187 /nfs/dbraw/zinc/66/31/87/1134663187.db2.gz MZDQNSHQASLHIZ-LLVKDONJSA-N 1 0 275.314 3.769 20 10 CHCDRO Oc1ccc2ccccc2c1CN1CCCC(F)(F)C1 ZINC000404777059 1134949132 /nfs/dbraw/zinc/94/91/32/1134949132.db2.gz AOCFXKBXOLHOAT-UHFFFAOYSA-N 1 0 277.314 3.777 20 10 CHCDRO CN(C)c1ccc(/N=N/c2ccc(OC3C[NH2+]C3)cc2)cc1 ZINC001218051932 1135049808 /nfs/dbraw/zinc/04/98/08/1135049808.db2.gz CZWQRDMQZORMRW-FMQUCBEESA-N 1 0 296.374 3.519 20 10 CHCDRO C[C@@H](Oc1ccccc1NN=C1C=CC=CC1=O)C1C[NH2+]C1 ZINC001218193065 1135067513 /nfs/dbraw/zinc/06/75/13/1135067513.db2.gz GVOKFMPOIYDITH-WMSNYHIESA-N 1 0 297.358 3.794 20 10 CHCDRO CCOC1(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)CCCC1 ZINC000315301039 1135153454 /nfs/dbraw/zinc/15/34/54/1135153454.db2.gz XVWHCQWGSNRPDU-OAHLLOKOSA-N 1 0 290.451 3.753 20 10 CHCDRO Oc1ccc(F)cc1C[NH+]1CCCCCCCC1 ZINC000322238617 1135649615 /nfs/dbraw/zinc/64/96/15/1135649615.db2.gz KTBLYSUIBAAOGR-UHFFFAOYSA-N 1 0 251.345 3.688 20 10 CHCDRO C[C@H]1CC[C@@H]([NH2+]Cc2cc(Cl)ccc2O)CC1 ZINC000106255644 186105976 /nfs/dbraw/zinc/10/59/76/186105976.db2.gz WDHNZDWDVVYTRT-MJHDQNEOSA-N 1 0 253.773 3.714 20 10 CHCDRO c1coc(CC[NH2+]Cc2ccc(N3CCCCC3)cc2)c1 ZINC000035121489 134788012 /nfs/dbraw/zinc/78/80/12/134788012.db2.gz KEHYVRQRQKNOFK-UHFFFAOYSA-N 1 0 284.403 3.602 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)c2ccc(C)cc2O)cc1 ZINC000020088435 170988587 /nfs/dbraw/zinc/98/85/87/170988587.db2.gz CGYMWSSTPUKSSG-ZDUSSCGKSA-N 1 0 271.360 3.560 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1ccccn1)c1ccccc1O ZINC000020123556 171005167 /nfs/dbraw/zinc/00/51/67/171005167.db2.gz ZJASMSCGSHPGGK-GXTWGEPZSA-N 1 0 256.349 3.589 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCc2ccccc21)c1ccccc1O ZINC000020129740 171018311 /nfs/dbraw/zinc/01/83/11/171018311.db2.gz JAMZRKGHGBRESE-MLGOLLRUSA-N 1 0 253.345 3.730 20 10 CHCDRO CC[C@H]([NH2+]Cc1cccc(C)c1)c1ccccc1O ZINC000020134233 171021979 /nfs/dbraw/zinc/02/19/79/171021979.db2.gz BPOOYWCNTDZBQE-INIZCTEOSA-N 1 0 255.361 3.942 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@H]2CCCc3ccccc32)c1 ZINC000020133811 171022094 /nfs/dbraw/zinc/02/20/94/171022094.db2.gz DNARGYBSJCEBKR-KRWDZBQOSA-N 1 0 283.371 3.568 20 10 CHCDRO CN(C)c1ccc(C[NH2+]Cc2cccc(Cl)c2)cc1 ZINC000020146113 171032180 /nfs/dbraw/zinc/03/21/80/171032180.db2.gz UOUUGPVNFVTSPF-UHFFFAOYSA-N 1 0 274.795 3.696 20 10 CHCDRO C[C@H]([NH2+]CCCOC1CCCCC1)c1ccccc1O ZINC000020191439 171057729 /nfs/dbraw/zinc/05/77/29/171057729.db2.gz POOHXNQPNWHOJI-AWEZNQCLSA-N 1 0 277.408 3.782 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCCc2occc21)c1ccccc1O ZINC000020204256 171069697 /nfs/dbraw/zinc/06/96/97/171069697.db2.gz YTLCKFNSHLBJDU-SMDDNHRTSA-N 1 0 257.333 3.713 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCCc3occc32)c1 ZINC000020204537 171069723 /nfs/dbraw/zinc/06/97/23/171069723.db2.gz IPDRUEJVNGDUIK-ABAIWWIYSA-N 1 0 287.359 3.722 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]Cc1ccco1 ZINC000022146674 171356754 /nfs/dbraw/zinc/35/67/54/171356754.db2.gz MYTCQOLVZRPEPD-DGCLKSJQSA-N 1 0 257.333 3.632 20 10 CHCDRO CC[C@@H](C)[NH2+]Cc1cc(C)n(-c2ccccc2)c1C ZINC000037329007 173130145 /nfs/dbraw/zinc/13/01/45/173130145.db2.gz SHEDNWFJXBDJDM-CYBMUJFWSA-N 1 0 256.393 3.982 20 10 CHCDRO C[C@@H]1CCCC[C@@H]1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000042859548 174892948 /nfs/dbraw/zinc/89/29/48/174892948.db2.gz PREOXHAETZUGAC-CZUORRHYSA-N 1 0 259.393 3.537 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H](C)CCc2ccccc2)c1 ZINC000071406564 176155856 /nfs/dbraw/zinc/15/58/56/176155856.db2.gz IDJGJWNXQHDAQC-HNNXBMFYSA-N 1 0 269.388 3.812 20 10 CHCDRO COc1ccc(C[NH2+]Cc2ccccc2Cl)cc1C ZINC000035052381 260005897 /nfs/dbraw/zinc/00/58/97/260005897.db2.gz GLAIAAZMZCSTPR-UHFFFAOYSA-N 1 0 275.779 3.947 20 10 CHCDRO Cc1ccccc1[C@@H](C)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000037362789 260094851 /nfs/dbraw/zinc/09/48/51/260094851.db2.gz HUIOYIULRYAZQF-CQSZACIVSA-N 1 0 267.372 3.781 20 10 CHCDRO COCc1ccccc1C[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000037762790 260116943 /nfs/dbraw/zinc/11/69/43/260116943.db2.gz GRAZISLXJDRBHH-AWEZNQCLSA-N 1 0 285.387 3.698 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccc(OC)cc1 ZINC000126986457 260360274 /nfs/dbraw/zinc/36/02/74/260360274.db2.gz KSQSOZXGNWPNLR-GOSISDBHSA-N 1 0 297.398 3.871 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1ccccn1)c1ccc(N(C)C)cc1 ZINC000152369706 261063580 /nfs/dbraw/zinc/06/35/80/261063580.db2.gz CVCJYTOBDVULRH-YOEHRIQHSA-N 1 0 283.419 3.950 20 10 CHCDRO CC[C@H]([NH2+]Cc1cccc(O)c1)c1ccc(N(C)C)cc1 ZINC000154422654 261091681 /nfs/dbraw/zinc/09/16/81/261091681.db2.gz ZVNKDTOZROEVDB-SFHVURJKSA-N 1 0 284.403 3.699 20 10 CHCDRO CC[C@H]([NH2+][C@H](CCCO)c1ccccc1)c1ccccc1O ZINC000155983774 261111186 /nfs/dbraw/zinc/11/11/86/261111186.db2.gz COXIKLJYSOTAPO-ZWKOTPCHSA-N 1 0 299.414 3.947 20 10 CHCDRO CC[C@@H]([NH2+]CC1(CCOC)CCC1)c1ccccc1O ZINC000156357578 261120529 /nfs/dbraw/zinc/12/05/29/261120529.db2.gz ZYBUOTZKNBABSG-OAHLLOKOSA-N 1 0 277.408 3.640 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)C[C@H](O)c1ccccc1)c1ccccc1O ZINC000156413975 261123127 /nfs/dbraw/zinc/12/31/27/261123127.db2.gz PZTRCASRBPAFSQ-BJZITVGISA-N 1 0 299.414 3.945 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCC[C@@H]2CCCCO2)c(O)c1 ZINC000183985597 262003624 /nfs/dbraw/zinc/00/36/24/262003624.db2.gz VUXKIFWSSLLDGS-GJZGRUSLSA-N 1 0 277.408 3.701 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCC[C@@H]2CCCCO2)c1 ZINC000183985220 262003977 /nfs/dbraw/zinc/00/39/77/262003977.db2.gz BHOFLUVAFSXAAA-CABCVRRESA-N 1 0 277.408 3.701 20 10 CHCDRO CCOc1cccc(C[NH2+][C@H]2CCC[C@@H](SC)C2)c1O ZINC000117395187 262024313 /nfs/dbraw/zinc/02/43/13/262024313.db2.gz VUURVNJGQIIBHQ-UONOGXRCSA-N 1 0 295.448 3.555 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(F)c(C)c2)c(O)c1 ZINC000184911790 262033047 /nfs/dbraw/zinc/03/30/47/262033047.db2.gz OGABXRTVVYOIBT-CYBMUJFWSA-N 1 0 273.351 3.999 20 10 CHCDRO CC(=O)Nc1cccc(C[NH2+][C@H](C)c2ccc(C)cc2O)c1 ZINC000185021094 262037521 /nfs/dbraw/zinc/03/75/21/262037521.db2.gz UYRGZESSFGJLBC-CYBMUJFWSA-N 1 0 298.386 3.510 20 10 CHCDRO CO[C@H](C[NH2+][C@H](C)c1ccc(C)cc1O)c1ccccc1 ZINC000185102043 262040908 /nfs/dbraw/zinc/04/09/08/262040908.db2.gz NCKDFIKUZPOZOO-RDTXWAMCSA-N 1 0 285.387 3.739 20 10 CHCDRO CO[C@@H](C[NH2+][C@@H](C)c1cc(C)ccc1O)c1ccccc1 ZINC000185101689 262041221 /nfs/dbraw/zinc/04/12/21/262041221.db2.gz KHZNLPPSRRRSCI-KSSFIOAISA-N 1 0 285.387 3.739 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCCOC2CCCC2)c(O)c1 ZINC000185240680 262047850 /nfs/dbraw/zinc/04/78/50/262047850.db2.gz QWXVGWYUVNUNDN-CQSZACIVSA-N 1 0 277.408 3.701 20 10 CHCDRO CCc1nc(CC[NH2+][C@H](C)c2ccc(C)cc2O)cs1 ZINC000185310880 262049506 /nfs/dbraw/zinc/04/95/06/262049506.db2.gz MBRVHBMIIKTWEC-GFCCVEGCSA-N 1 0 290.432 3.613 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H](CCCO)c2ccccc2)c(O)c1 ZINC000185532589 262058893 /nfs/dbraw/zinc/05/88/93/262058893.db2.gz ADPXLEZRADDGSH-QAPCUYQASA-N 1 0 299.414 3.865 20 10 CHCDRO C[C@H]([NH2+][C@H]1[C@@H]2CCO[C@@H]2C1(C)C)c1cc(Cl)ccc1O ZINC000185534271 262059112 /nfs/dbraw/zinc/05/91/12/262059112.db2.gz KQRHFUGRCSJOEH-YIVQXAGMSA-N 1 0 295.810 3.510 20 10 CHCDRO CCOCCC1(C[NH2+][C@@H](C)c2ccc(C)cc2O)CCC1 ZINC000186116051 262079770 /nfs/dbraw/zinc/07/97/70/262079770.db2.gz NQEGZWPVQFHXBM-HNNXBMFYSA-N 1 0 291.435 3.948 20 10 CHCDRO C[C@@H]([NH2+]Cc1nc(C2CC2)cs1)c1cc(F)ccc1O ZINC000186117737 262080318 /nfs/dbraw/zinc/08/03/18/262080318.db2.gz AWIVKYDMSQETAB-SECBINFHSA-N 1 0 292.379 3.716 20 10 CHCDRO Cc1noc(C)c1[C@H](C)C[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000186158027 262082572 /nfs/dbraw/zinc/08/25/72/262082572.db2.gz PESAFQVXBDRGKM-NEPJUHHUSA-N 1 0 288.391 3.760 20 10 CHCDRO Cc1noc(C)c1[C@@H](C)C[NH2+][C@H](C)c1cc(F)ccc1O ZINC000186158362 262082900 /nfs/dbraw/zinc/08/29/00/262082900.db2.gz NCQCGRSHQSQXOV-VHSXEESVSA-N 1 0 292.354 3.590 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(Cl)cn2)c1 ZINC000186229867 262085254 /nfs/dbraw/zinc/08/52/54/262085254.db2.gz NUVOISZTBQJILM-NSHDSACASA-N 1 0 276.767 3.600 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(C(C)(C)O)cc2)c(O)c1 ZINC000186602882 262101480 /nfs/dbraw/zinc/10/14/80/262101480.db2.gz NQCOGXDKZXXSRR-CQSZACIVSA-N 1 0 299.414 3.779 20 10 CHCDRO C[C@@H]([NH2+]C[C@H](C)c1nccs1)c1cc(Cl)ccc1O ZINC000186727292 262107023 /nfs/dbraw/zinc/10/70/23/262107023.db2.gz JJRMKFHIZBPUCG-VHSXEESVSA-N 1 0 296.823 3.956 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCCOCC1)c1ccc2ccccc2c1O ZINC000186234490 262312395 /nfs/dbraw/zinc/31/23/95/262312395.db2.gz SZACOSGZDAOETR-DZGCQCFKSA-N 1 0 285.387 3.765 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H]2c2ccncc2)cc1F ZINC000289886294 263112830 /nfs/dbraw/zinc/11/28/30/263112830.db2.gz SIVNLRBWLHXLAZ-QGZVFWFLSA-N 1 0 299.393 3.624 20 10 CHCDRO CO[C@@H]1CCC[N@H+](Cc2c(O)ccc3ccccc32)CC1 ZINC000370707307 267340814 /nfs/dbraw/zinc/34/08/14/267340814.db2.gz NTBMHHYPHYVTCH-OAHLLOKOSA-N 1 0 285.387 3.546 20 10 CHCDRO COc1cccc(CNc2cc[nH+]c3ccc(C)cc23)c1O ZINC000302156587 328830743 /nfs/dbraw/zinc/83/07/43/328830743.db2.gz NALJAWPWNKSXSM-UHFFFAOYSA-N 1 0 294.354 3.870 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@H](c1ccccn1)C1CCC1)CC2 ZINC000527969284 330301365 /nfs/dbraw/zinc/30/13/65/330301365.db2.gz SWOFYKQFMCQTNX-BEFAXECRSA-N 1 0 294.398 3.906 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)c1ncccc1F)c1cc(Cl)ccc1O ZINC000528034936 330302505 /nfs/dbraw/zinc/30/25/05/330302505.db2.gz BYLNUMHRQSZHIA-UWVGGRQHSA-N 1 0 294.757 3.992 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ncccc2F)c(O)c1C ZINC000528035048 330302569 /nfs/dbraw/zinc/30/25/69/330302569.db2.gz DJBXMIPAKOXOSH-STQMWFEESA-N 1 0 288.366 3.955 20 10 CHCDRO C[C@H]([NH2+][C@H]1[C@@H](C)[C@H](C)O[C@H]1C)c1ccc(Cl)cc1O ZINC000528008395 330303549 /nfs/dbraw/zinc/30/35/49/330303549.db2.gz TZKCDTUBMHBFTC-DMZJWBPISA-N 1 0 283.799 3.508 20 10 CHCDRO C[C@H]([NH2+][C@@H]1[C@H](C)O[C@H](C)[C@H]1C)c1ccc(Cl)cc1O ZINC000528008396 330303606 /nfs/dbraw/zinc/30/36/06/330303606.db2.gz TZKCDTUBMHBFTC-QSJCVTFJSA-N 1 0 283.799 3.508 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCSC1)c1ccc2ccccc2c1O ZINC000230667650 333320337 /nfs/dbraw/zinc/32/03/37/333320337.db2.gz CRXMAJSUWQSBDJ-AAEUAGOBSA-N 1 0 273.401 3.702 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H]1CCC1(C)C ZINC000381844142 336074202 /nfs/dbraw/zinc/07/42/02/336074202.db2.gz KPTIKGKEGQHFPS-INIZCTEOSA-N 1 0 256.393 3.765 20 10 CHCDRO CCCC[C@@H](C)[NH2+][C@@H](C)c1cc(OC)ccc1O ZINC000050886953 521010623 /nfs/dbraw/zinc/01/06/23/521010623.db2.gz SXIOGTAZOKLCKU-NEPJUHHUSA-N 1 0 251.370 3.630 20 10 CHCDRO CC(C)(C[NH2+]Cc1ccccc1O)c1cccs1 ZINC000083601805 519267944 /nfs/dbraw/zinc/26/79/44/519267944.db2.gz OQYGUHDMOKWCIV-UHFFFAOYSA-N 1 0 261.390 3.521 20 10 CHCDRO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)Cc1cccnc1 ZINC000263808607 519655156 /nfs/dbraw/zinc/65/51/56/519655156.db2.gz VXVAFJASWXVFEX-UHFFFAOYSA-N 1 0 283.419 3.558 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CCC(C)(F)F)cc1 ZINC000296240634 520286850 /nfs/dbraw/zinc/28/68/50/520286850.db2.gz ASVATRBYXGVRID-LBPRGKRZSA-N 1 0 270.367 3.839 20 10 CHCDRO CCC[C@H](CCO)C[NH2+][C@H](CC)c1ccc(C)cc1O ZINC000280224658 521097367 /nfs/dbraw/zinc/09/73/67/521097367.db2.gz UYVYKWDNNNPRMT-GDBMZVCRSA-N 1 0 279.424 3.540 20 10 CHCDRO CCC[C@H]([NH2+][C@H](C)c1ccccc1O)[C@H](O)c1ccccc1 ZINC000279999920 521176251 /nfs/dbraw/zinc/17/62/51/521176251.db2.gz FXIVTEMKRQUFPM-DKSSEZFCSA-N 1 0 299.414 3.945 20 10 CHCDRO CCOc1cccc(C[N@H+](C)C2CCC(F)(F)CC2)c1O ZINC000290113067 521330973 /nfs/dbraw/zinc/33/09/73/521330973.db2.gz ILCVMVABROXOIS-UHFFFAOYSA-N 1 0 299.361 3.801 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCC[C@@H]2c2ccncc2)c1O ZINC000289982853 521336601 /nfs/dbraw/zinc/33/66/01/521336601.db2.gz ZYHLAVHMXWZAQZ-MRXNPFEDSA-N 1 0 298.386 3.523 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCC[C@H]2c2ccncc2)c1O ZINC000289982850 521340483 /nfs/dbraw/zinc/34/04/83/521340483.db2.gz ZYHLAVHMXWZAQZ-INIZCTEOSA-N 1 0 298.386 3.523 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CC[C@H](CC(F)(F)F)C2)cc1 ZINC000278392074 522182496 /nfs/dbraw/zinc/18/24/96/522182496.db2.gz MXLZRJLDPPCMEX-CYBMUJFWSA-N 1 0 286.341 3.527 20 10 CHCDRO CC[C@H]([NH2+]CC[C@@H]1CCO[C@@H](C)C1)c1ccc(C)cc1O ZINC000280288063 522601325 /nfs/dbraw/zinc/60/13/25/522601325.db2.gz ZATOHAIZAJOIRU-UXLLHSPISA-N 1 0 291.435 3.947 20 10 CHCDRO CC[C@H]([NH2+]Cc1cccc(OC)c1)c1ccc(C)cc1O ZINC000280156365 522655009 /nfs/dbraw/zinc/65/50/09/522655009.db2.gz QLLJMPNZEHRMHD-KRWDZBQOSA-N 1 0 285.387 3.950 20 10 CHCDRO CC[C@H]([NH2+]Cc1cnc(C)s1)c1ccc(C)cc1O ZINC000280191534 522662745 /nfs/dbraw/zinc/66/27/45/522662745.db2.gz SGDSEXFMYXZNMG-AWEZNQCLSA-N 1 0 276.405 3.706 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)[C@@H](O)c1ccccc1)c1ccccc1O ZINC000290192293 522736327 /nfs/dbraw/zinc/73/63/27/522736327.db2.gz GADHXXDAFZINNR-RPVQJOFSSA-N 1 0 285.387 3.555 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CCCc2c1cnn2C)c1ccc(C)cc1O ZINC000280272576 522924891 /nfs/dbraw/zinc/92/48/91/522924891.db2.gz YABYPQNEXFHBIX-HZPDHXFCSA-N 1 0 299.418 3.552 20 10 CHCDRO CO[C@@H](C)CC[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000268878338 523401475 /nfs/dbraw/zinc/40/14/75/523401475.db2.gz VYWLMLJTQUHEGN-HOTGVXAUSA-N 1 0 290.451 3.753 20 10 CHCDRO CO[C@H](C)[C@@H](C)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000290234606 523891212 /nfs/dbraw/zinc/89/12/12/523891212.db2.gz RZZCKOGAOBSDNJ-JHJVBQTASA-N 1 0 273.376 3.619 20 10 CHCDRO Cc1cc(C[NH+](C)C)cc(N[C@@H](C)c2ccccc2O)c1 ZINC000272815097 524659291 /nfs/dbraw/zinc/65/92/91/524659291.db2.gz DXKYQXQISJGKBP-AWEZNQCLSA-N 1 0 284.403 3.935 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)CCc2ccco2)c1 ZINC000020144909 524765836 /nfs/dbraw/zinc/76/58/36/524765836.db2.gz PCHZJVJHVAHTCG-CHWSQXEVSA-N 1 0 289.375 3.666 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccccc2C)c1 ZINC000037718890 524766066 /nfs/dbraw/zinc/76/60/66/524766066.db2.gz VJZMJOUPTYVWNK-CYBMUJFWSA-N 1 0 271.360 3.560 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)CCc2ccco2)c1 ZINC000020144907 524773063 /nfs/dbraw/zinc/77/30/63/524773063.db2.gz PCHZJVJHVAHTCG-STQMWFEESA-N 1 0 289.375 3.666 20 10 CHCDRO C[C@@H]1COCC[C@@H]1[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000277252222 525133805 /nfs/dbraw/zinc/13/38/05/525133805.db2.gz AHOJEAGKOMCLCQ-KDOFPFPSSA-N 1 0 297.398 3.574 20 10 CHCDRO CSC1(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)CC1 ZINC000278594543 525335387 /nfs/dbraw/zinc/33/53/87/525335387.db2.gz AGQGPDNZQAHYJV-LBPRGKRZSA-N 1 0 265.422 3.555 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC(C)(C)[C@@H]2c2cccnc2)c1 ZINC000366545598 525339698 /nfs/dbraw/zinc/33/96/98/525339698.db2.gz QQMLQBRAFCULIQ-KRWDZBQOSA-N 1 0 282.387 3.679 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H]2CCC[C@@H](C(F)(F)F)C2)c1 ZINC000071407917 525351672 /nfs/dbraw/zinc/35/16/72/525351672.db2.gz WMPYGTADAPGMGI-CHWSQXEVSA-N 1 0 287.325 3.911 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CC[C@H]2CCO[C@H](C)C2)c1 ZINC000273410682 525363295 /nfs/dbraw/zinc/36/32/95/525363295.db2.gz HRYBFYOSQJAXSE-ILXRZTDVSA-N 1 0 277.408 3.556 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccco1 ZINC000050286495 525450909 /nfs/dbraw/zinc/45/09/09/525450909.db2.gz UAQLGLZIKXACHK-ZDUSSCGKSA-N 1 0 270.376 3.513 20 10 CHCDRO C[C@@H]([NH2+]Cc1cccc(F)c1)c1ccc(N(C)C)cc1 ZINC000037246812 525533139 /nfs/dbraw/zinc/53/31/39/525533139.db2.gz MDHFSBJSHVWGHB-CYBMUJFWSA-N 1 0 272.367 3.743 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccccc1O)c1ccccc1OC(F)F ZINC000037084592 525538043 /nfs/dbraw/zinc/53/80/43/525538043.db2.gz MZZDWMIYGUIYOS-LLVKDONJSA-N 1 0 293.313 3.844 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCc2c1cccc2O)c1ccc(N(C)C)cc1 ZINC000130333953 525631666 /nfs/dbraw/zinc/63/16/66/525631666.db2.gz YHOIYGFUROTYOK-UGSOOPFHSA-N 1 0 296.414 3.796 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)c1ccccc1O)c1cccc([N+](=O)[O-])c1 ZINC000037775503 525662442 /nfs/dbraw/zinc/66/24/42/525662442.db2.gz RPFBFHMWJZKYGP-VXGBXAGGSA-N 1 0 286.331 3.712 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2COc3ccccc32)c(O)c1C ZINC000290334261 525730766 /nfs/dbraw/zinc/73/07/66/525730766.db2.gz OZYDGFKVKWKZBU-HUUCEWRRSA-N 1 0 297.398 3.836 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CCCCSC)cc1 ZINC000133608191 1125480452 /nfs/dbraw/zinc/48/04/52/1125480452.db2.gz CHGGTKISGHBZTF-AWEZNQCLSA-N 1 0 280.481 3.937 20 10 CHCDRO C[C@@H]1C[C@@H]([NH2+]CCC(C)(F)F)c2c1c(F)ccc2O ZINC000834819163 1118572735 /nfs/dbraw/zinc/57/27/35/1118572735.db2.gz SZLJZAOYLOTSIG-PSASIEDQSA-N 1 0 273.298 3.715 20 10 CHCDRO Cc1cscc1C[NH2+][C@H](C)c1cc(C)ccc1O ZINC000094877273 1118884178 /nfs/dbraw/zinc/88/41/78/1118884178.db2.gz PYAPLTGJDVVHHH-GFCCVEGCSA-N 1 0 261.390 3.921 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCCC1(C)C)c1ccc(N(C)C)cc1 ZINC000094321268 1119912506 /nfs/dbraw/zinc/91/25/06/1119912506.db2.gz INGBGSJPTZRLBK-XJKSGUPXSA-N 1 0 260.425 3.982 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCN1C(C)(C)C)c1cc(Cl)ccc1O ZINC000850480743 1123273068 /nfs/dbraw/zinc/27/30/68/1123273068.db2.gz DDFARENKMXIHQD-AAEUAGOBSA-N 1 0 296.842 3.569 20 10 CHCDRO C[C@H](CSC(C)(C)C)[NH2+][C@@H](C)c1ccccc1O ZINC000877757421 1125073724 /nfs/dbraw/zinc/07/37/24/1125073724.db2.gz ZWHUSXBOVCQUOV-NEPJUHHUSA-N 1 0 267.438 3.963 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+][C@@H]2CCCC[C@@H]2C)c1O ZINC000228669729 1125250349 /nfs/dbraw/zinc/25/03/49/1125250349.db2.gz GCLKTHRNRQOHNM-GXFFZTMASA-N 1 0 283.799 3.723 20 10 CHCDRO C[C@]1(C[NH2+]Cc2cc(Cl)ccc2O)CC1(Cl)Cl ZINC000824765126 1131482809 /nfs/dbraw/zinc/48/28/09/1131482809.db2.gz HULDGWOJILGNOY-LLVKDONJSA-N 1 0 294.609 3.719 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@@]2(CCSC2)C1 ZINC000825214933 1131501831 /nfs/dbraw/zinc/50/18/31/1131501831.db2.gz BFBPCGLVCMWBSN-OAHLLOKOSA-N 1 0 297.851 3.765 20 10 CHCDRO COCC1(C)CC[NH+](Cc2cc(Cl)c(C)cc2O)CC1 ZINC000825456170 1131512676 /nfs/dbraw/zinc/51/26/76/1131512676.db2.gz SEPNWEXQEQTPAH-UHFFFAOYSA-N 1 0 297.826 3.603 20 10 CHCDRO CO[C@@H]([C@H](C)[NH2+][C@H](C)c1cc(Cl)cc(C)c1O)C1CC1 ZINC000834904971 1131727934 /nfs/dbraw/zinc/72/79/34/1131727934.db2.gz RKBAECRNCFAORY-GDLVEWKHSA-N 1 0 297.826 3.818 20 10 CHCDRO Cc1cc(Cl)cc(C[NH+]2CC(C)(CC(F)F)C2)c1O ZINC000843424769 1132533709 /nfs/dbraw/zinc/53/37/09/1132533709.db2.gz IYBASOBNXNUIRQ-UHFFFAOYSA-N 1 0 289.753 3.831 20 10 CHCDRO C[N@H+](Cc1ccc(C(F)(F)F)cc1O)C(C)(C)C ZINC001233454524 1132624397 /nfs/dbraw/zinc/62/43/97/1132624397.db2.gz XUSRSXCKMGNYQS-UHFFFAOYSA-N 1 0 261.287 3.641 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C2(c3ccc(F)cc3)CC2)cc1 ZINC000729685512 1125550460 /nfs/dbraw/zinc/55/04/60/1125550460.db2.gz FKXUVSDJRWBLCY-UHFFFAOYSA-N 1 0 284.378 3.671 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000282917400 1125556541 /nfs/dbraw/zinc/55/65/41/1125556541.db2.gz DVNJSGASJPVSSG-CQSZACIVSA-N 1 0 299.336 3.947 20 10 CHCDRO C[C@H]1CC[C@@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC000135147778 1125580297 /nfs/dbraw/zinc/58/02/97/1125580297.db2.gz NPAIESKTJBLRKC-GOEBONIOSA-N 1 0 258.409 3.565 20 10 CHCDRO Oc1c(C[NH2+]C[C@H]2CC[C@H](C3CC3)O2)ccc2ccccc21 ZINC000897506278 1125594906 /nfs/dbraw/zinc/59/49/06/1125594906.db2.gz XSZMREPTMKWGHU-SJLPKXTDSA-N 1 0 297.398 3.593 20 10 CHCDRO CCC[C@@H](C[NH2+][C@@H](C)c1ccc(Cl)cc1O)OC ZINC000841758084 1125598325 /nfs/dbraw/zinc/59/83/25/1125598325.db2.gz RZMFTUYVUZGEIY-JQWIXIFHSA-N 1 0 271.788 3.511 20 10 CHCDRO CCc1nc(C[NH2+][C@H](C)c2ccc(Cl)cc2O)cs1 ZINC000841762761 1125601763 /nfs/dbraw/zinc/60/17/63/1125601763.db2.gz KAHGHEFFTPKDCH-SECBINFHSA-N 1 0 296.823 3.915 20 10 CHCDRO CC[C@@H]1CC[C@H](C)[N@@H+]1Cc1cc(Cl)ccc1O ZINC000136819737 1125647873 /nfs/dbraw/zinc/64/78/73/1125647873.db2.gz ANPCJPKVEYGTCG-GXFFZTMASA-N 1 0 253.773 3.809 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H]2CCCC[C@H]2SC)c1O ZINC000219199553 1125673101 /nfs/dbraw/zinc/67/31/01/1125673101.db2.gz AVBZGLOTEHKOBS-UKRRQHHQSA-N 1 0 295.448 3.555 20 10 CHCDRO Cc1ccc(C)c(C[NH2+]Cc2ccc(N(C)C)cc2)c1 ZINC000042296264 1126717326 /nfs/dbraw/zinc/71/73/26/1126717326.db2.gz DAABKVNWHAUADB-UHFFFAOYSA-N 1 0 268.404 3.659 20 10 CHCDRO COCCCC[N@H+](Cc1ccccc1)Cc1ccccc1O ZINC000179563633 1126829723 /nfs/dbraw/zinc/82/97/23/1126829723.db2.gz UDYOBWSBOYXJPD-UHFFFAOYSA-N 1 0 299.414 3.821 20 10 CHCDRO CCC[NH+](Cc1ccccc1O)Cc1ccccc1O ZINC000179565617 1126830085 /nfs/dbraw/zinc/83/00/85/1126830085.db2.gz QOYRKOVRVJOWCA-UHFFFAOYSA-N 1 0 271.360 3.510 20 10 CHCDRO COc1cccc(CCC[NH2+][C@H](C)c2ccccc2O)c1 ZINC000179875747 1126835927 /nfs/dbraw/zinc/83/59/27/1126835927.db2.gz GFUHOAWIPYLHTA-CQSZACIVSA-N 1 0 285.387 3.684 20 10 CHCDRO CCOc1ccccc1C[NH2+][C@H](C)c1ccccc1O ZINC000179878186 1126836141 /nfs/dbraw/zinc/83/61/41/1126836141.db2.gz NTSNHDCCFRJXHS-CYBMUJFWSA-N 1 0 271.360 3.642 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccccc1O ZINC000183414111 1126886669 /nfs/dbraw/zinc/88/66/69/1126886669.db2.gz ZEUCWXFQVZRUIZ-OAHLLOKOSA-N 1 0 296.414 3.843 20 10 CHCDRO COCc1cc(C[NH2+][C@@H](C)c2ccccc2O)ccc1F ZINC000183521199 1126887335 /nfs/dbraw/zinc/88/73/35/1126887335.db2.gz WJNBAWHNEOKACE-LBPRGKRZSA-N 1 0 289.350 3.529 20 10 CHCDRO CCOc1ccc(C[NH2+][C@@H](C)c2ccccc2O)cc1F ZINC000183499589 1126887858 /nfs/dbraw/zinc/88/78/58/1126887858.db2.gz DWQIOBQSVOIYNM-LBPRGKRZSA-N 1 0 289.350 3.781 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1ccccc1O)c1ccncc1 ZINC000183529180 1126888699 /nfs/dbraw/zinc/88/86/99/1126888699.db2.gz ZHMKWWMJOQPOBC-IUODEOHRSA-N 1 0 256.349 3.589 20 10 CHCDRO C[C@H](C[C@H](O)c1cccs1)[NH2+][C@@H](C)c1ccccc1O ZINC000183587981 1126889564 /nfs/dbraw/zinc/88/95/64/1126889564.db2.gz AVXPUUSSKMEEBU-XUJVJEKNSA-N 1 0 291.416 3.617 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1ccc(C)cc1O)c1ccncc1 ZINC000185541499 1126900257 /nfs/dbraw/zinc/90/02/57/1126900257.db2.gz FRVODIXBXOMUFR-BBRMVZONSA-N 1 0 270.376 3.898 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1cc(F)ccc1O)c1ccncc1 ZINC000185541919 1126900295 /nfs/dbraw/zinc/90/02/95/1126900295.db2.gz SRAKESJUTGGJFD-IAQYHMDHSA-N 1 0 274.339 3.728 20 10 CHCDRO CC[C@@H]([NH2+]CC[C@](C)(O)c1ccccc1)c1ccccc1O ZINC000187889882 1126916826 /nfs/dbraw/zinc/91/68/26/1126916826.db2.gz JIFSWMOEHAFFKU-MJGOQNOKSA-N 1 0 299.414 3.731 20 10 CHCDRO C[C@H]([NH2+][C@H]1C[C@H]1c1cccc(F)c1)c1ccccc1O ZINC000906594272 1126961328 /nfs/dbraw/zinc/96/13/28/1126961328.db2.gz CTSXMOLYWGBIOE-UVBJJODRSA-N 1 0 271.335 3.738 20 10 CHCDRO CC(C)CC[N@H+](C)Cc1cc(Cl)cc(F)c1[O-] ZINC000775650349 1130885136 /nfs/dbraw/zinc/88/51/36/1130885136.db2.gz YPEYNMRAJITVAQ-UHFFFAOYSA-N 1 0 259.752 3.663 20 10 CHCDRO C[N@@H+](Cc1ccc(N2CCCCC2)cc1)CC1CC1 ZINC000155443271 1127003388 /nfs/dbraw/zinc/00/33/88/1127003388.db2.gz GFYYSRULHLCIKW-UHFFFAOYSA-N 1 0 258.409 3.519 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC2(C(F)(F)F)CC2)c(O)c1 ZINC000797070327 1130958553 /nfs/dbraw/zinc/95/85/53/1130958553.db2.gz KJLPCRDLTFJATB-SNVBAGLBSA-N 1 0 273.298 3.694 20 10 CHCDRO CC[C@@H]([NH2+]CC(C)(C)CCCO)c1ccc(N(C)C)cc1 ZINC000271369373 1127076812 /nfs/dbraw/zinc/07/68/12/1127076812.db2.gz GJYSFRZSAYXMEM-QGZVFWFLSA-N 1 0 292.467 3.592 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CCC[C@H](C)[C@@H]2C)c(Cl)c1 ZINC001236798220 1131009220 /nfs/dbraw/zinc/00/92/20/1131009220.db2.gz DFJRQULRTXIYCS-QWRGUYRKSA-N 1 0 283.799 3.675 20 10 CHCDRO COCCC(C)(C)C[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000274187367 1127110772 /nfs/dbraw/zinc/11/07/72/1127110772.db2.gz JNUOJYVXSJHSQO-AWEZNQCLSA-N 1 0 279.424 3.722 20 10 CHCDRO COc1ccc2ccc(O)c(C[NH+]3C4CCC3CC4)c2c1 ZINC000912786476 1127111762 /nfs/dbraw/zinc/11/17/62/1127111762.db2.gz IBZIFXGBFBCDDC-UHFFFAOYSA-N 1 0 283.371 3.681 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCC(C)(C)C1)c1ccc(N(C)C)cc1 ZINC000163633109 1127126222 /nfs/dbraw/zinc/12/62/22/1127126222.db2.gz HSJCDVAXXVIWIX-ZFWWWQNUSA-N 1 0 260.425 3.982 20 10 CHCDRO COc1cc(C)cc(C[N@H+](C)Cc2ccc(C)s2)c1O ZINC000164280111 1127160180 /nfs/dbraw/zinc/16/01/80/1127160180.db2.gz JMOBZACTHXTMNN-UHFFFAOYSA-N 1 0 291.416 3.711 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CCC[C@H]1[C@H]1CCCO1 ZINC000284016712 1127169950 /nfs/dbraw/zinc/16/99/50/1127169950.db2.gz HXVXPPMESBQCPZ-PKOBYXMFSA-N 1 0 297.398 3.689 20 10 CHCDRO C[C@H]([NH2+][C@H]1C=CCC1)c1ccc2ccccc2c1O ZINC000698192234 1127185461 /nfs/dbraw/zinc/18/54/61/1127185461.db2.gz VETBCJWKJWAPNA-JSGCOSHPSA-N 1 0 253.345 3.915 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CC[C@H]2CCO[C@@H](C)C2)c(O)c1 ZINC000285293286 1127221893 /nfs/dbraw/zinc/22/18/93/1127221893.db2.gz RTRAVUKIILJEEH-JYJNAYRXSA-N 1 0 291.435 3.865 20 10 CHCDRO CSCc1ccc(C[NH2+]Cc2cc(C)ccc2O)cc1 ZINC000285435965 1127227644 /nfs/dbraw/zinc/22/76/44/1127227644.db2.gz HVABGHIGKGNHQO-UHFFFAOYSA-N 1 0 287.428 3.853 20 10 CHCDRO C[N@H+](CCc1nccs1)Cc1c(O)ccc2ccccc21 ZINC000157131396 1127229182 /nfs/dbraw/zinc/22/91/82/1127229182.db2.gz UUQDIRQKQMZETP-UHFFFAOYSA-N 1 0 298.411 3.676 20 10 CHCDRO CS[C@@H]1CC[C@@H]([NH2+][C@@H](C)c2ccc(N(C)C)cc2)C1 ZINC000224273269 1127257275 /nfs/dbraw/zinc/25/72/75/1127257275.db2.gz DVHSTWCVKOCGFR-JGGQBBKZSA-N 1 0 278.465 3.687 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCCSC1)c1cc(Cl)ccc1O ZINC000287045592 1127283904 /nfs/dbraw/zinc/28/39/04/1127283904.db2.gz MOIVBBDHGDMGQQ-QWRGUYRKSA-N 1 0 285.840 3.839 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCCc2cccc(C)n2)c1 ZINC000287636211 1127311457 /nfs/dbraw/zinc/31/14/57/1127311457.db2.gz UKBDSJFKDATLDE-HNNXBMFYSA-N 1 0 284.403 3.687 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(C)nc1)c1cccc(Cl)c1[O-] ZINC000287554615 1127309666 /nfs/dbraw/zinc/30/96/66/1127309666.db2.gz FUKQLZGHLBKVHI-OAHLLOKOSA-N 1 0 290.794 3.990 20 10 CHCDRO CSCc1ccc(C[NH2+]Cc2cc(F)ccc2O)cc1 ZINC000289211752 1127377506 /nfs/dbraw/zinc/37/75/06/1127377506.db2.gz BZWUJJRMBJSZQY-UHFFFAOYSA-N 1 0 291.391 3.684 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)C[C@@H]2C[C@H]2C)cc1 ZINC001308646023 1127413584 /nfs/dbraw/zinc/41/35/84/1127413584.db2.gz ZFPYXCOMONBRJH-ZBFHGGJFSA-N 1 0 260.425 3.621 20 10 CHCDRO Cc1ccc(OC[C@@H](C)[NH2+]Cc2cccc(C)c2O)cc1 ZINC000158123033 1127451753 /nfs/dbraw/zinc/45/17/53/1127451753.db2.gz QPVJWRLDCFDSSB-OAHLLOKOSA-N 1 0 285.387 3.566 20 10 CHCDRO CC[C@@H]([NH2+]CCC1(COC)CCC1)c1ccccc1O ZINC000293567976 1127506053 /nfs/dbraw/zinc/50/60/53/1127506053.db2.gz BBJRXTVNCWLAHE-OAHLLOKOSA-N 1 0 277.408 3.640 20 10 CHCDRO CCC[N@@H+](Cc1cc(Cl)cc(OC)c1O)CC1CC1 ZINC000761183851 1127506654 /nfs/dbraw/zinc/50/66/54/1127506654.db2.gz CIPXFWHJJSCKEI-UHFFFAOYSA-N 1 0 283.799 3.676 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2cccc(O)c2)c(O)c1 ZINC000293722873 1127514982 /nfs/dbraw/zinc/51/49/82/1127514982.db2.gz MOIIPOVGVSCWIH-CYBMUJFWSA-N 1 0 271.360 3.565 20 10 CHCDRO CC(F)(F)c1ccc(C[NH2+]Cc2cc(F)ccc2O)cc1 ZINC000293886940 1127529581 /nfs/dbraw/zinc/52/95/81/1127529581.db2.gz KDRJDRZPQJBUKN-UHFFFAOYSA-N 1 0 295.304 3.933 20 10 CHCDRO Cc1cc(C[N@@H+](C)[C@H](C)c2ccncc2)ccc1N(C)C ZINC000293917334 1127533525 /nfs/dbraw/zinc/53/35/25/1127533525.db2.gz XPKNXXCKKRAFDK-OAHLLOKOSA-N 1 0 283.419 3.649 20 10 CHCDRO Oc1ccccc1C[NH2+]Cc1cc(C2CC2)ccc1F ZINC000294669082 1127589677 /nfs/dbraw/zinc/58/96/77/1127589677.db2.gz AKUXIFBOYHARCH-UHFFFAOYSA-N 1 0 271.335 3.699 20 10 CHCDRO CC[C@@H]([NH2+]CC(C)(C)c1ccccn1)c1ccccc1O ZINC000294733310 1127595742 /nfs/dbraw/zinc/59/57/42/1127595742.db2.gz GMPJYKCSKRHQAR-OAHLLOKOSA-N 1 0 284.403 3.806 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@H]2CCOC(C)(C)C2)c(O)c1 ZINC000294856431 1127604541 /nfs/dbraw/zinc/60/45/41/1127604541.db2.gz SSWYYKSCSQFKSJ-KBPBESRZSA-N 1 0 277.408 3.617 20 10 CHCDRO CO[C@@H]1CC[N@H+](Cc2c(O)ccc3ccccc32)CC1(C)C ZINC000295121634 1127621914 /nfs/dbraw/zinc/62/19/14/1127621914.db2.gz XLRXMKYGLXPDIX-GOSISDBHSA-N 1 0 299.414 3.792 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1OCCc2ccccc21)c1ccccc1O ZINC000362488602 1127639783 /nfs/dbraw/zinc/63/97/83/1127639783.db2.gz RVMJOJRSDLWNFO-PKOBYXMFSA-N 1 0 297.398 3.747 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@H]1CCOc3c(F)cccc31)CC2 ZINC000296435913 1127671893 /nfs/dbraw/zinc/67/18/93/1127671893.db2.gz MHLKCVFAVCJZAX-LSDHHAIUSA-N 1 0 299.345 3.632 20 10 CHCDRO Cc1cccnc1CCC[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000296571426 1127676862 /nfs/dbraw/zinc/67/68/62/1127676862.db2.gz SYDFETUCFAZUJP-MRXNPFEDSA-N 1 0 297.446 3.739 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)CC(F)(F)F)c1ccccc1O ZINC000229578845 1127696969 /nfs/dbraw/zinc/69/69/69/1127696969.db2.gz JIYZDTFYWZJIDA-GXSJLCMTSA-N 1 0 261.287 3.774 20 10 CHCDRO CCc1nc([C@H](C)[NH2+][C@@H]2CCc3cccc(O)c32)cs1 ZINC000297685632 1127704170 /nfs/dbraw/zinc/70/41/70/1127704170.db2.gz LRZHDEFSDRJAPV-CMPLNLGQSA-N 1 0 288.416 3.749 20 10 CHCDRO Oc1cc2c(cc1C[NH+]1CCC(C(F)(F)F)CC1)CCC2 ZINC000173418417 1127829286 /nfs/dbraw/zinc/82/92/86/1127829286.db2.gz UXCGVMHFZZCACW-UHFFFAOYSA-N 1 0 299.336 3.655 20 10 CHCDRO Cc1ccc2c(c1)[C@@H]([NH2+][C@H](C)c1ccc(C)cc1O)CO2 ZINC000373263966 1127830853 /nfs/dbraw/zinc/83/08/53/1127830853.db2.gz ALZQDANLCCULLR-CJNGLKHVSA-N 1 0 283.371 3.793 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CCCc2cn[nH]c21)c1ccc(C)cc1O ZINC000373559702 1127849013 /nfs/dbraw/zinc/84/90/13/1127849013.db2.gz CPXRPEVAYCWMQT-CABCVRRESA-N 1 0 285.391 3.542 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CCC2(C1)CCCCC2 ZINC000311361693 1127925579 /nfs/dbraw/zinc/92/55/79/1127925579.db2.gz FHEZMWVAWZFVGT-UHFFFAOYSA-N 1 0 263.356 3.688 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)Cc2ccc(Cl)nc2)cc1C ZINC000029886165 1128068047 /nfs/dbraw/zinc/06/80/47/1128068047.db2.gz AMFSWFSETHBPJK-UHFFFAOYSA-N 1 0 290.794 3.689 20 10 CHCDRO CC[C@H]([NH2+]CCSCC(F)(F)F)c1ccccc1O ZINC000698952795 1128069556 /nfs/dbraw/zinc/06/95/56/1128069556.db2.gz LUAIRKKSKXXEEO-NSHDSACASA-N 1 0 293.354 3.728 20 10 CHCDRO CC[C@H](COC)[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000152853446 1128153690 /nfs/dbraw/zinc/15/36/90/1128153690.db2.gz CXXDZBMOECMHOQ-DOTOQJQBSA-N 1 0 290.451 3.753 20 10 CHCDRO CC(C)[C@H]1C[C@H]([NH2+]Cc2ccc(N(C)C)c(F)c2)CS1 ZINC000754120426 1128196735 /nfs/dbraw/zinc/19/67/35/1128196735.db2.gz HVKMZNXGGMGXLV-XJKSGUPXSA-N 1 0 296.455 3.511 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1C[C@H]1C(F)(F)F)c1ccc(N(C)C)cc1 ZINC000926951183 1128205052 /nfs/dbraw/zinc/20/50/52/1128205052.db2.gz XCKQTVGLBVTXFX-SCDSUCTJSA-N 1 0 286.341 3.602 20 10 CHCDRO C[C@H]([NH2+]CC[C@H]1CCC2(CCC2)O1)c1cc(F)ccc1O ZINC000927127208 1128220979 /nfs/dbraw/zinc/22/09/79/1128220979.db2.gz GOAVHEHNQXMPRE-GXTWGEPZSA-N 1 0 293.382 3.674 20 10 CHCDRO COc1cc(C[N@@H+]2CCc3cccc(C)c3C2)c(O)cc1C ZINC000762087816 1128267801 /nfs/dbraw/zinc/26/78/01/1128267801.db2.gz PAUHJYOTGKTOCH-UHFFFAOYSA-N 1 0 297.398 3.576 20 10 CHCDRO CCCC[N@H+](Cc1cc2c(cc1O)CCC2)C1CC1 ZINC000914783815 1128243339 /nfs/dbraw/zinc/24/33/39/1128243339.db2.gz GPINTGOMUYNLAJ-UHFFFAOYSA-N 1 0 259.393 3.645 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+]C2Cc3ccccc3C2)c2c1c(F)ccc2O ZINC000762776129 1128318048 /nfs/dbraw/zinc/31/80/48/1128318048.db2.gz CWGSATOMNRNBJG-BZNIZROVSA-N 1 0 297.373 3.837 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCOC(C)(C)[C@H]2C)cc1C(C)C ZINC000763212652 1128377661 /nfs/dbraw/zinc/37/76/61/1128377661.db2.gz OYUPSQUNYQTDLC-CQSZACIVSA-N 1 0 291.435 3.823 20 10 CHCDRO C[C@H]([NH2+][C@@H](C1CC1)C1CCC1)c1cc(F)ccc1O ZINC000324606571 1128390072 /nfs/dbraw/zinc/39/00/72/1128390072.db2.gz BJRZXUUFPGHJAE-MGPLVRAMSA-N 1 0 263.356 3.761 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C[C@H]2CCC(C)(C)O2)cc1 ZINC000778207857 1128446653 /nfs/dbraw/zinc/44/66/53/1128446653.db2.gz ABEBYSWRUVBEQN-QGZVFWFLSA-N 1 0 290.451 3.580 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)c2ccc3c(c2)OCO3)cc1C ZINC000042203106 1128568811 /nfs/dbraw/zinc/56/88/11/1128568811.db2.gz PMTMNZBINNEUDQ-CYBMUJFWSA-N 1 0 299.370 3.583 20 10 CHCDRO Oc1ccccc1C[N@H+](Cc1ccc(F)cc1)C1CC1 ZINC000155238071 1128602721 /nfs/dbraw/zinc/60/27/21/1128602721.db2.gz ORLZYTUZZHHURV-UHFFFAOYSA-N 1 0 271.335 3.696 20 10 CHCDRO CC(C)C[C@@H](C)[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1 ZINC000155306941 1128604169 /nfs/dbraw/zinc/60/41/69/1128604169.db2.gz IZTMEVBJZNNCBT-CVEARBPZSA-N 1 0 290.451 3.608 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccco1)c1ccc(N(C)C)cc1 ZINC000155972418 1128621418 /nfs/dbraw/zinc/62/14/18/1128621418.db2.gz WFKCOOAEHJLLHA-KRWDZBQOSA-N 1 0 272.392 3.629 20 10 CHCDRO CN1CCCc2cc(C[N@H+](C)CC3CCCC3)ccc21 ZINC001138355874 1128626080 /nfs/dbraw/zinc/62/60/80/1128626080.db2.gz FNLLCNDVZZCWTB-UHFFFAOYSA-N 1 0 272.436 3.691 20 10 CHCDRO C[C@H]1C[N@H+](Cc2cc(F)ccc2O)Cc2ccccc21 ZINC000778995389 1128675740 /nfs/dbraw/zinc/67/57/40/1128675740.db2.gz RJLJRPFURCUAGD-LBPRGKRZSA-N 1 0 271.335 3.651 20 10 CHCDRO C[C@@]1(c2ccccc2)CC[N@H+](Cc2cc(F)ccc2O)C1 ZINC000779022442 1128685189 /nfs/dbraw/zinc/68/51/89/1128685189.db2.gz BTCNNIBOSJUDMT-GOSISDBHSA-N 1 0 285.362 3.695 20 10 CHCDRO C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2cc(F)ccc2O)o1 ZINC000779065326 1128716091 /nfs/dbraw/zinc/71/60/91/1128716091.db2.gz PDUVMHROXBXODX-HZMBPMFUSA-N 1 0 275.323 3.538 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C2CC2)C2CCC2)c1 ZINC000325004528 1117779057 /nfs/dbraw/zinc/77/90/57/1117779057.db2.gz BBZOZKAQBKDARH-PIGZYNQJSA-N 1 0 275.392 3.630 20 10 CHCDRO CCC(CC)(C[NH2+][C@H](C)c1ccccc1O)SC ZINC000228794991 1117791083 /nfs/dbraw/zinc/79/10/83/1117791083.db2.gz VMQMVZYEJHXQMN-GFCCVEGCSA-N 1 0 267.438 3.965 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(C#N)cc2F)c(O)c1 ZINC000185378071 1117814658 /nfs/dbraw/zinc/81/46/58/1117814658.db2.gz HIYAAYCXIWOBRX-LBPRGKRZSA-N 1 0 284.334 3.562 20 10 CHCDRO Cc1nc(C)c(CC[NH2+][C@@H](C)c2ccc(C)cc2O)s1 ZINC000185403016 1117820366 /nfs/dbraw/zinc/82/03/66/1117820366.db2.gz CEYNUSBTNOGAHU-NSHDSACASA-N 1 0 290.432 3.667 20 10 CHCDRO CC(C)[NH+](CCC[NH2+][C@@H](C)c1ccc(F)cc1[O-])C(C)C ZINC000185626714 1117860015 /nfs/dbraw/zinc/86/00/15/1117860015.db2.gz ZDLVIKAKCFAGEC-AWEZNQCLSA-N 1 0 296.430 3.691 20 10 CHCDRO Oc1ccc2ccncc2c1C[N@@H+]1CCC[C@H]1C1CCC1 ZINC000728196648 1117869484 /nfs/dbraw/zinc/86/94/84/1117869484.db2.gz OIGBARGTYUSALY-KRWDZBQOSA-N 1 0 282.387 3.705 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2ccc(N3CCCCC3)cc2)C[C@@H]1F ZINC000779151212 1128753006 /nfs/dbraw/zinc/75/30/06/1128753006.db2.gz VSMHNPYEGFYKIQ-QAPCUYQASA-N 1 0 290.426 3.857 20 10 CHCDRO C[C@@H]([NH2+]C/C=C/c1cccc(F)c1)c1ccccc1O ZINC001203536484 1118147523 /nfs/dbraw/zinc/14/75/23/1118147523.db2.gz VMHQPBZWZOZTPH-VUDGCMKMSA-N 1 0 271.335 3.895 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2cc(C)cc(C)c2)c1 ZINC000693131544 1118218770 /nfs/dbraw/zinc/21/87/70/1118218770.db2.gz OEGWSPHHKUJLNJ-UHFFFAOYSA-N 1 0 255.361 3.607 20 10 CHCDRO C[C@@H]([NH2+]C[C@](C)(O)C1CCCCC1)c1cc(F)ccc1O ZINC000188664686 1128763939 /nfs/dbraw/zinc/76/39/39/1128763939.db2.gz PZRPTNKZJJUEBN-PXAZEXFGSA-N 1 0 295.398 3.513 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1ccncc1OC)c1ccccc1O ZINC000188763260 1128764824 /nfs/dbraw/zinc/76/48/24/1128764824.db2.gz SMNMKAYQTVLEMP-SWLSCSKDSA-N 1 0 286.375 3.598 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CC[C@H](c2ccccc2)C1 ZINC000179934876 1128767229 /nfs/dbraw/zinc/76/72/29/1128767229.db2.gz BPMFOJMTGPBLPA-AWEZNQCLSA-N 1 0 271.335 3.521 20 10 CHCDRO CC(C)=CCC[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000397724897 1118321605 /nfs/dbraw/zinc/32/16/05/1118321605.db2.gz YIAWCPCQVXXRKV-UHFFFAOYSA-N 1 0 258.409 3.733 20 10 CHCDRO CCOC1CC(CC[NH2+][C@H](CC)c2ccccc2O)C1 ZINC000189247488 1128769823 /nfs/dbraw/zinc/76/98/23/1128769823.db2.gz SZNJSAMXFCKQBJ-ZBCRRDGASA-N 1 0 277.408 3.638 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@](C)(O)C2CCCCC2)c(O)c1 ZINC000188661133 1118326158 /nfs/dbraw/zinc/32/61/58/1118326158.db2.gz LJRNTZHXSUEXFD-KDOFPFPSSA-N 1 0 291.435 3.683 20 10 CHCDRO C[N@H+](CCc1cccc(Cl)c1)Cc1ccccc1O ZINC001203556183 1118368777 /nfs/dbraw/zinc/36/87/77/1118368777.db2.gz MLCBOSVAWABTCQ-UHFFFAOYSA-N 1 0 275.779 3.720 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCC[C@H]1c1ccccc1F ZINC001203556177 1118368943 /nfs/dbraw/zinc/36/89/43/1118368943.db2.gz MKPRKNMKCJCVOT-INIZCTEOSA-N 1 0 271.335 3.868 20 10 CHCDRO Oc1ccccc1C[NH+]1CCC(Cc2ccccc2F)CC1 ZINC001203556917 1118388861 /nfs/dbraw/zinc/38/88/61/1118388861.db2.gz WKYUXLIHSGZHGR-UHFFFAOYSA-N 1 0 299.389 3.986 20 10 CHCDRO Cc1cc([C@H](C)[NH2+]Cc2ccc3c(c2)CCO3)cs1 ZINC000834554505 1118440590 /nfs/dbraw/zinc/44/05/90/1118440590.db2.gz BOBMUQNKAZYPBA-LBPRGKRZSA-N 1 0 273.401 3.842 20 10 CHCDRO CC[C@@H]([NH2+]CC[C@H]1CCCCO1)c1ccc(N(C)C)cc1 ZINC000180255686 1128784387 /nfs/dbraw/zinc/78/43/87/1128784387.db2.gz SNDJBTSBLYVSLX-QZTJIDSGSA-N 1 0 290.451 3.753 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+]CCC(C)(F)F)c2c1c(F)ccc2O ZINC000834819164 1118572826 /nfs/dbraw/zinc/57/28/26/1118572826.db2.gz SZLJZAOYLOTSIG-SCZZXKLOSA-N 1 0 273.298 3.715 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1CCCC12CC2 ZINC000706937030 1118572982 /nfs/dbraw/zinc/57/29/82/1118572982.db2.gz RVQYVTCXWZWKTG-QGZVFWFLSA-N 1 0 268.404 3.909 20 10 CHCDRO C[C@@H]1CCSCC[N@@H+]1Cc1c(O)ccc2ccccc21 ZINC000189915031 1128787500 /nfs/dbraw/zinc/78/75/00/1128787500.db2.gz UGPIMMWAJUXHDC-CYBMUJFWSA-N 1 0 287.428 3.873 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCOC(C)(C)C1)c1cc(Cl)ccc1O ZINC000834908929 1118628027 /nfs/dbraw/zinc/62/80/27/1118628027.db2.gz ISXCHWTYAFGMNG-NWDGAFQWSA-N 1 0 297.826 3.901 20 10 CHCDRO CCCC[N@H+](CC)Cc1c(O)cccc1Br ZINC000707140129 1118643774 /nfs/dbraw/zinc/64/37/74/1118643774.db2.gz BIGAQFIZAREXPG-UHFFFAOYSA-N 1 0 286.213 3.777 20 10 CHCDRO Cc1csc(C[NH2+][C@H](C)c2ccc(C)cc2O)c1 ZINC000382259695 1118653450 /nfs/dbraw/zinc/65/34/50/1118653450.db2.gz GYCNCYGUYDNITP-GFCCVEGCSA-N 1 0 261.390 3.921 20 10 CHCDRO CCS[C@@H]1CC[C@@H]([N@H+](C)Cc2cc(OC)ccc2O)C1 ZINC000180668268 1128801358 /nfs/dbraw/zinc/80/13/58/1128801358.db2.gz ODWQRYCQDXHAOW-UKRRQHHQSA-N 1 0 295.448 3.507 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1ccc(C)cc1O)[C@@H]1CCCOC1 ZINC000723990761 1118797343 /nfs/dbraw/zinc/79/73/43/1118797343.db2.gz TYMHFOXNBRNMEA-LZWOXQAQSA-N 1 0 277.408 3.556 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]C23CCC(CC2)C3)cc1 ZINC000835047009 1118819149 /nfs/dbraw/zinc/81/91/49/1118819149.db2.gz BOMWSXSUTOYPCC-ONEGZZNKSA-N 1 0 270.420 3.688 20 10 CHCDRO CSC1(C[NH2+]C/C=C/c2ccc(N(C)C)cc2)CCC1 ZINC000835051056 1118829411 /nfs/dbraw/zinc/82/94/11/1118829411.db2.gz BBPLUSFTHBLHSU-GQCTYLIASA-N 1 0 290.476 3.641 20 10 CHCDRO CC1(C)CCC([NH2+]Cc2cc(F)ccc2O)CC1 ZINC000226611361 1119224258 /nfs/dbraw/zinc/22/42/58/1119224258.db2.gz JNPPHOMNKPCUCZ-UHFFFAOYSA-N 1 0 251.345 3.590 20 10 CHCDRO CC1(C)CCC[C@@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000094266138 1128832005 /nfs/dbraw/zinc/83/20/05/1128832005.db2.gz WIYWRVGPLKUKCX-KRWDZBQOSA-N 1 0 272.436 3.955 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@H]1CCOC(C)(C)C1 ZINC000250987085 1119616275 /nfs/dbraw/zinc/61/62/75/1119616275.db2.gz SZLSQCGZKQYAAW-HZSPNIEDSA-N 1 0 289.419 3.796 20 10 CHCDRO COc1cc(O)c(C[N@H+](C)C2CCCCCC2)cc1OC ZINC000179434938 1119736974 /nfs/dbraw/zinc/73/69/74/1119736974.db2.gz RCSZMZBQENYCFN-UHFFFAOYSA-N 1 0 293.407 3.564 20 10 CHCDRO Cc1ccc(OC2CC[NH+](Cc3ccccc3O)CC2)cc1 ZINC000179559055 1119750516 /nfs/dbraw/zinc/75/05/16/1119750516.db2.gz SQUIPTZWQXQOEQ-UHFFFAOYSA-N 1 0 297.398 3.744 20 10 CHCDRO C[C@@H]([NH2+]CCOc1ccc(Cl)cc1)c1ccccc1O ZINC000179887160 1119791185 /nfs/dbraw/zinc/79/11/85/1119791185.db2.gz ZBLNVBPBFRICCU-GFCCVEGCSA-N 1 0 291.778 3.775 20 10 CHCDRO CC[N@H+](Cc1ccccc1F)Cc1ccc(O)c(C)c1O ZINC001140748445 1119795624 /nfs/dbraw/zinc/79/56/24/1119795624.db2.gz GQACIHUUGQPMAK-UHFFFAOYSA-N 1 0 289.350 3.567 20 10 CHCDRO CSCC1CCC([NH2+]Cc2cccc(C)c2O)CC1 ZINC000295079923 1119851510 /nfs/dbraw/zinc/85/15/10/1119851510.db2.gz QFWYRVYXJSABLQ-UHFFFAOYSA-N 1 0 279.449 3.712 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccoc1 ZINC000177975956 1119893989 /nfs/dbraw/zinc/89/39/89/1119893989.db2.gz HXFKJHOKYGZSMA-CQSZACIVSA-N 1 0 270.376 3.731 20 10 CHCDRO Nc1ccc(C[N@@H+]2CC[C@@H](C3CCCCC3)C2)cc1 ZINC000708822365 1119905705 /nfs/dbraw/zinc/90/57/05/1119905705.db2.gz QAMFNSXZMVKRBA-MRXNPFEDSA-N 1 0 258.409 3.671 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)[C@@]12C[C@@H]1CCCC2 ZINC000708837098 1119916566 /nfs/dbraw/zinc/91/65/66/1119916566.db2.gz MCZJJXOHDUDNCZ-QANKJYHBSA-N 1 0 271.404 3.680 20 10 CHCDRO Cc1nc2c(s1)[C@H]([NH2+][C@H](C)c1ccccc1O)CCC2 ZINC000376351230 1119951600 /nfs/dbraw/zinc/95/16/00/1119951600.db2.gz JXXNQBQJUFMWSV-ZWNOBZJWSA-N 1 0 288.416 3.885 20 10 CHCDRO CCSCC[C@@H](C)[NH2+][C@@H](C)c1ccccc1O ZINC000167455278 1120081156 /nfs/dbraw/zinc/08/11/56/1120081156.db2.gz BQLBDTATNNGIHP-NEPJUHHUSA-N 1 0 253.411 3.575 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+][C@@H]1CCCC(F)(F)C1 ZINC000695097682 1120105377 /nfs/dbraw/zinc/10/53/77/1120105377.db2.gz QDMGMNKNYDGVIJ-LLVKDONJSA-N 1 0 275.726 3.713 20 10 CHCDRO Cc1ccc(C[N@@H+]2CCc3c(C)cccc3C2)c(O)c1 ZINC001140947988 1120127139 /nfs/dbraw/zinc/12/71/39/1120127139.db2.gz OLISBLGCFSWEAI-UHFFFAOYSA-N 1 0 267.372 3.567 20 10 CHCDRO Clc1csc(C[NH2+]Cc2ccc3c(c2)CCO3)c1 ZINC000785448257 1120128482 /nfs/dbraw/zinc/12/84/82/1120128482.db2.gz NCFXEQSTGRROOO-UHFFFAOYSA-N 1 0 279.792 3.626 20 10 CHCDRO Cc1ccc(CC[N@@H+](C)Cc2ccc(C)cc2O)cc1 ZINC001140950934 1120135958 /nfs/dbraw/zinc/13/59/58/1120135958.db2.gz PPJCRHSCPZYIPM-UHFFFAOYSA-N 1 0 269.388 3.684 20 10 CHCDRO C[C@H]([NH2+]CC1CCOCC1)c1ccc2ccccc2c1O ZINC000111159189 1120138214 /nfs/dbraw/zinc/13/82/14/1120138214.db2.gz ZIOUFXBSXRDPJW-ZDUSSCGKSA-N 1 0 285.387 3.623 20 10 CHCDRO [O-]c1cc(Cl)c(Cl)cc1C[N@@H+]1C[C@@H]2C[C@H]1C[C@@H]2F ZINC001236799250 1128893061 /nfs/dbraw/zinc/89/30/61/1128893061.db2.gz MYADZEGMFXZIKH-DXBFQKDVSA-N 1 0 290.165 3.631 20 10 CHCDRO CC(C)n1cc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCCO3)cn1 ZINC000921734844 1120178687 /nfs/dbraw/zinc/17/86/87/1120178687.db2.gz IEUZEKRIBDTTNW-CQSZACIVSA-N 1 0 299.418 3.640 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CC2(OC)CCCC2)cc1 ZINC000314352190 1120188772 /nfs/dbraw/zinc/18/87/72/1120188772.db2.gz OFQKOKSDVVBVHJ-UHFFFAOYSA-N 1 0 290.451 3.582 20 10 CHCDRO CCC(CC)[C@H](O)C[NH2+][C@@H](CC)c1ccc(N(C)C)cc1 ZINC000765929612 1120213947 /nfs/dbraw/zinc/21/39/47/1120213947.db2.gz WHLOSUCXYONRHG-ZWKOTPCHSA-N 1 0 292.467 3.590 20 10 CHCDRO Cc1ccc(O)c(C[NH+]2CCC(Oc3ccccc3)CC2)c1 ZINC000091682578 1120228921 /nfs/dbraw/zinc/22/89/21/1120228921.db2.gz HAYRECGSRDVAEY-UHFFFAOYSA-N 1 0 297.398 3.744 20 10 CHCDRO Clc1cccc2c1C[C@H]([NH2+]Cc1ccc3c(c1)CCO3)C2 ZINC001168692564 1120267969 /nfs/dbraw/zinc/26/79/69/1120267969.db2.gz QZFMHIDSBMNGIV-OAHLLOKOSA-N 1 0 299.801 3.532 20 10 CHCDRO Cc1nc(C)c(C[NH2+][C@H](C)c2cc(C)ccc2O)s1 ZINC000312100534 1120294977 /nfs/dbraw/zinc/29/49/77/1120294977.db2.gz UHCULCIUOIMAQU-SNVBAGLBSA-N 1 0 276.405 3.625 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2[C@H]3CCCO[C@H]3C2(C)C)c1 ZINC000363849322 1120338078 /nfs/dbraw/zinc/33/80/78/1120338078.db2.gz GOQFMZOESMMNEM-NSNWQYSKSA-N 1 0 289.419 3.555 20 10 CHCDRO C[C@H]([NH2+]C[C@H](C1CCCCC1)N(C)C)c1ccccc1O ZINC000183425847 1120341678 /nfs/dbraw/zinc/34/16/78/1120341678.db2.gz JCOARAKJLAEOFD-WMLDXEAASA-N 1 0 290.451 3.553 20 10 CHCDRO CC(C)(CC(F)(F)F)[NH2+]Cc1ccc2c(c1)CCCO2 ZINC000922037197 1120345166 /nfs/dbraw/zinc/34/51/66/1120345166.db2.gz NTDLNFMWNYUKNT-UHFFFAOYSA-N 1 0 287.325 3.832 20 10 CHCDRO COC1(C[NH2+][C@@H](C)c2cc(C)ccc2O)CCCCC1 ZINC000186510531 1120351675 /nfs/dbraw/zinc/35/16/75/1120351675.db2.gz SCPVPHYVWMQZNN-AWEZNQCLSA-N 1 0 277.408 3.701 20 10 CHCDRO c1cc(C[NH2+]Cc2ccc(N3CCCCC3)cc2)co1 ZINC000069833045 1128910835 /nfs/dbraw/zinc/91/08/35/1128910835.db2.gz WAEKNRUZNOPKJF-UHFFFAOYSA-N 1 0 270.376 3.560 20 10 CHCDRO COc1cccc(C[N@H+](C)CC2(c3ccccc3)CC2)c1O ZINC000188716955 1120462693 /nfs/dbraw/zinc/46/26/93/1120462693.db2.gz AHKKUSVETKALGL-UHFFFAOYSA-N 1 0 297.398 3.564 20 10 CHCDRO C[C@H]([NH2+]CCSC(C)(C)C)c1ccc(N(C)C)cc1 ZINC000397458863 1120488225 /nfs/dbraw/zinc/48/82/25/1120488225.db2.gz PQKXTRMNEGOHJU-ZDUSSCGKSA-N 1 0 280.481 3.935 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H](C)c2ccc(F)cc2C)c1 ZINC000922664476 1120577007 /nfs/dbraw/zinc/57/70/07/1120577007.db2.gz DCUFOOPYNXKYPF-CYBMUJFWSA-N 1 0 273.351 3.999 20 10 CHCDRO CCO[C@H](C[NH2+]Cc1ccc(N(C)C)cc1)c1ccccc1 ZINC000194461236 1120599947 /nfs/dbraw/zinc/59/99/47/1120599947.db2.gz NXVYXKBHWSNKNX-LJQANCHMSA-N 1 0 298.430 3.620 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1COCC1(C)C)c1ccc2ccccc2c1O ZINC000313016796 1120672290 /nfs/dbraw/zinc/67/22/90/1120672290.db2.gz GZFGIPRPQVLJSI-MLGOLLRUSA-N 1 0 285.387 3.621 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CSc2ccccc21 ZINC000766030569 1120673636 /nfs/dbraw/zinc/67/36/36/1120673636.db2.gz UGBAPTMOVSMVDA-QGZVFWFLSA-N 1 0 298.455 3.998 20 10 CHCDRO C[C@@H]1CC[C@@H]([NH2+]Cc2cc(Cl)ccc2O)C[C@@H]1C ZINC000085040900 1120714829 /nfs/dbraw/zinc/71/48/29/1120714829.db2.gz YVTIHNGCIJUMQJ-UHIISALHSA-N 1 0 267.800 3.960 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+][C@H]1CCOC2(CCCC2)C1 ZINC000136691579 1120844300 /nfs/dbraw/zinc/84/43/00/1120844300.db2.gz HGUHJLQIWWHUOW-LBPRGKRZSA-N 1 0 295.810 3.627 20 10 CHCDRO COc1ccccc1CC[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000184861385 1120906413 /nfs/dbraw/zinc/90/64/13/1120906413.db2.gz UIIDLPBKARWNKU-AWEZNQCLSA-N 1 0 285.387 3.603 20 10 CHCDRO COC1(C[NH2+][C@@H](C)c2ccc3ccccc3c2O)CCC1 ZINC000186509336 1120920945 /nfs/dbraw/zinc/92/09/45/1120920945.db2.gz VJJLDZYCOIHAQR-ZDUSSCGKSA-N 1 0 285.387 3.765 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2ccc(C3CC3)cc2)c1 ZINC000191681842 1128951233 /nfs/dbraw/zinc/95/12/33/1128951233.db2.gz RWZCCKCWHIULRQ-UHFFFAOYSA-N 1 0 267.372 3.868 20 10 CHCDRO Oc1ccccc1C[N@@H+](Cc1ccccc1)C[C@H]1CCCO1 ZINC000078680583 1128954688 /nfs/dbraw/zinc/95/46/88/1128954688.db2.gz RXFRELYLZWRFOJ-GOSISDBHSA-N 1 0 297.398 3.573 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCCC2(C)C)c1 ZINC000094321596 1121001034 /nfs/dbraw/zinc/00/10/34/1121001034.db2.gz BBHUUZUMGPHOJU-IAQYHMDHSA-N 1 0 263.381 3.630 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CCCC(C)(C)CO ZINC000393424073 1121006554 /nfs/dbraw/zinc/00/65/54/1121006554.db2.gz LBGLSRSXSBQILO-KGLIPLIRSA-N 1 0 291.435 3.637 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H](C)CC(F)F)c1 ZINC000700156048 1121086410 /nfs/dbraw/zinc/08/64/10/1121086410.db2.gz QJLZGPAMKTWBCL-MNOVXSKESA-N 1 0 257.324 3.643 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1C=CCC1)c1cc(Br)ccc1O ZINC000700586049 1121107236 /nfs/dbraw/zinc/10/72/36/1121107236.db2.gz GJOPMPBYFYVUBR-DGCLKSJQSA-N 1 0 296.208 3.914 20 10 CHCDRO CC(C)N(C)CC[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000054110883 1121118687 /nfs/dbraw/zinc/11/86/87/1121118687.db2.gz HUXXKNRFSWXDKH-AWEZNQCLSA-N 1 0 286.419 3.536 20 10 CHCDRO CC[C@@H](CC(F)F)CN1CCCc2cc(C[NH3+])ccc21 ZINC000700861225 1121124777 /nfs/dbraw/zinc/12/47/77/1121124777.db2.gz MAUIDSROUJAFKY-LBPRGKRZSA-N 1 0 282.378 3.579 20 10 CHCDRO Cc1cc(C[NH2+]Cc2c(O)cccc2Cl)ccc1F ZINC000113316689 1121142506 /nfs/dbraw/zinc/14/25/06/1121142506.db2.gz OFUSJUIEMUQZFO-UHFFFAOYSA-N 1 0 279.742 3.783 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)CC(F)(F)F)c1ccccc1O ZINC000229578861 1121206390 /nfs/dbraw/zinc/20/63/90/1121206390.db2.gz JIYZDTFYWZJIDA-MWLCHTKSSA-N 1 0 261.287 3.774 20 10 CHCDRO C[C@H]([NH2+]CCc1ccccc1F)c1cc(F)ccc1O ZINC000094616649 1121216170 /nfs/dbraw/zinc/21/61/70/1121216170.db2.gz PRVXQHDIYYEHDM-NSHDSACASA-N 1 0 277.314 3.564 20 10 CHCDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]CCCOC(C)C ZINC000020198227 1121231405 /nfs/dbraw/zinc/23/14/05/1121231405.db2.gz IMSSTSORPFRVAI-UONOGXRCSA-N 1 0 277.408 3.654 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](OC)C1CCCC1)c1ccccc1O ZINC000703128688 1121235405 /nfs/dbraw/zinc/23/54/05/1121235405.db2.gz PDWOULSTTKCVPD-DOTOQJQBSA-N 1 0 277.408 3.638 20 10 CHCDRO C[C@]1(CC[NH2+]Cc2ccc(N3CCCC3)cc2)CC1(F)F ZINC001118424242 1121664676 /nfs/dbraw/zinc/66/46/76/1121664676.db2.gz VMBHQLVIEHVMOI-INIZCTEOSA-N 1 0 294.389 3.812 20 10 CHCDRO CCC[N@H+](CCc1ccc(OC)cc1)Cc1ccccc1O ZINC000727831358 1121749738 /nfs/dbraw/zinc/74/97/38/1121749738.db2.gz XMOWLWCANHIBSY-UHFFFAOYSA-N 1 0 299.414 3.856 20 10 CHCDRO COc1ccc(C[NH2+]Cc2ccc(OC)c(C)c2)c(C)c1 ZINC001177991154 1121763259 /nfs/dbraw/zinc/76/32/59/1121763259.db2.gz XPWZOWHJVLWYMO-UHFFFAOYSA-N 1 0 285.387 3.610 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2ccc[nH]2)cc1F ZINC001178398549 1121783247 /nfs/dbraw/zinc/78/32/47/1121783247.db2.gz RPNNTTCAMNOZAN-CYBMUJFWSA-N 1 0 289.398 3.851 20 10 CHCDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]CCCC(F)F ZINC001119542182 1121800329 /nfs/dbraw/zinc/80/03/29/1121800329.db2.gz XQDOWZRNBUZDPF-WDEREUQCSA-N 1 0 269.335 3.884 20 10 CHCDRO C[C@@H]1C[C@H](F)C[N@@H+]1Cc1ccc(N(C)C)c2ccccc12 ZINC001204232706 1121828677 /nfs/dbraw/zinc/82/86/77/1121828677.db2.gz IVIMJUAQMROBND-HIFRSBDPSA-N 1 0 286.394 3.838 20 10 CHCDRO CCN(C)c1ccc(C[N@H+](C)[C@@H](C)c2ccncc2)cc1 ZINC000773805692 1121859171 /nfs/dbraw/zinc/85/91/71/1121859171.db2.gz FVXGYWIJLGUSEX-HNNXBMFYSA-N 1 0 283.419 3.731 20 10 CHCDRO CCC[C@H](C[NH2+]Cc1c(O)cc(C)cc1Cl)OCC ZINC001179248081 1121864524 /nfs/dbraw/zinc/86/45/24/1121864524.db2.gz NGLNVYABJQKOAO-GFCCVEGCSA-N 1 0 285.815 3.649 20 10 CHCDRO CCCC[N@H+](CCOC)Cc1c(O)ccc2ccccc21 ZINC000731661237 1121877716 /nfs/dbraw/zinc/87/77/16/1121877716.db2.gz UVYGKVBEGNPRAC-UHFFFAOYSA-N 1 0 287.403 3.794 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCCc2ccccc2C1)c1ccccc1O ZINC001179494337 1121884617 /nfs/dbraw/zinc/88/46/17/1121884617.db2.gz PSTCSPHYDVFSSR-WMLDXEAASA-N 1 0 281.399 3.990 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[NH2+][C@@H]1C[C@H]2CCC[C@@H]21 ZINC001179767646 1121906125 /nfs/dbraw/zinc/90/61/25/1121906125.db2.gz BXRPPCAVXVFYOG-BPQIPLTHSA-N 1 0 270.420 3.565 20 10 CHCDRO CC[C@@H](C)C[N@H+](C)Cc1cc(C(C)(C)C)cc(O)c1O ZINC000732183403 1121911076 /nfs/dbraw/zinc/91/10/76/1121911076.db2.gz PBKWQDMWWGGIDE-GFCCVEGCSA-N 1 0 279.424 3.873 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C[C@H]2CCc3ccccc32)cc1 ZINC000732229864 1121911591 /nfs/dbraw/zinc/91/15/91/1121911591.db2.gz MCXSTAQPMLVJIN-QGZVFWFLSA-N 1 0 280.415 3.572 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2C[C@@H](C)C[C@H]2C)c(Cl)c1 ZINC001179898777 1121918713 /nfs/dbraw/zinc/91/87/13/1121918713.db2.gz UIQUZOGPDXCUSL-WDEREUQCSA-N 1 0 253.773 3.584 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]C/C=C\c1ccccc1 ZINC000732986934 1121950709 /nfs/dbraw/zinc/95/07/09/1121950709.db2.gz OSNZGJFLRAIVLO-DAXSKMNVSA-N 1 0 273.763 3.849 20 10 CHCDRO C[C@@H]1CC[C@H](C)[N@H+]1C/C=C\c1ccc(N(C)C)cc1 ZINC001180108869 1121952843 /nfs/dbraw/zinc/95/28/43/1121952843.db2.gz ZFFRYYZBDDHBAN-YPDHSMTDSA-N 1 0 258.409 3.639 20 10 CHCDRO CCN(C)c1ccc(C[NH2+][C@H](C)c2cnccc2C)cc1 ZINC000773840802 1121962740 /nfs/dbraw/zinc/96/27/40/1121962740.db2.gz QOQGVVPGIGNJTK-OAHLLOKOSA-N 1 0 283.419 3.697 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CC[C@@H](C(C)(C)C)C1 ZINC001180317492 1121973874 /nfs/dbraw/zinc/97/38/74/1121973874.db2.gz GZHLBNIXTDVKPR-MRXNPFEDSA-N 1 0 274.452 3.929 20 10 CHCDRO COc1ccc(C[NH2+]Cc2ccc(O)c(Cl)c2)cc1C ZINC000733327165 1121977578 /nfs/dbraw/zinc/97/75/78/1121977578.db2.gz MYKALVSDYLKZTA-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]C/C=C/c1ccccc1 ZINC000733326567 1121977832 /nfs/dbraw/zinc/97/78/32/1121977832.db2.gz LWCNWCPMSSKTDQ-VMPITWQZSA-N 1 0 273.763 3.849 20 10 CHCDRO Oc1ccccc1C[NH2+]CCc1ccc(F)cc1Cl ZINC000733329270 1121978275 /nfs/dbraw/zinc/97/82/75/1121978275.db2.gz BGTSUSZUTRMMDK-UHFFFAOYSA-N 1 0 279.742 3.517 20 10 CHCDRO CC[C@H]1CCCC[N@@H+]1Cc1cc(F)c(N(C)C)cc1F ZINC001180372569 1121985814 /nfs/dbraw/zinc/98/58/14/1121985814.db2.gz VCGBPWKIDGIYSU-ZDUSSCGKSA-N 1 0 282.378 3.795 20 10 CHCDRO CC(C)c1ccc(O)c(C[NH2+][C@@H]2CCO[C@H](C3CC3)C2)c1 ZINC001180592362 1122002539 /nfs/dbraw/zinc/00/25/39/1122002539.db2.gz FIXVLEGWYDKNDQ-AEFFLSMTSA-N 1 0 289.419 3.563 20 10 CHCDRO COc1cc(C)c(C[NH2+]C[C@@H]2CCC[C@@H](C)[C@H]2C)c(O)c1 ZINC001181235337 1122044956 /nfs/dbraw/zinc/04/49/56/1122044956.db2.gz UZFPSOQBGXDIKQ-YUELXQCFSA-N 1 0 291.435 3.871 20 10 CHCDRO CCC[C@H]([NH2+]Cc1cccc(OC)c1O)[C@H]1CC1(C)C ZINC001181487957 1122058493 /nfs/dbraw/zinc/05/84/93/1122058493.db2.gz RFWQXAKBNJBVCW-KGLIPLIRSA-N 1 0 277.408 3.705 20 10 CHCDRO CC[C@@H]1CC[C@@H](C)[N@@H+]1Cc1ccc(Cl)cc1O ZINC001181543955 1122061959 /nfs/dbraw/zinc/06/19/59/1122061959.db2.gz IYRNOBWGQURMGT-ZWNOBZJWSA-N 1 0 253.773 3.809 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]C2CCC(F)(F)CC2)c1 ZINC000688525564 1129032394 /nfs/dbraw/zinc/03/23/94/1129032394.db2.gz WBOKDKJDQGCASK-SNVBAGLBSA-N 1 0 285.334 3.629 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]C[C@@H]1CCC[C@H]2C[C@H]21 ZINC001182919237 1122193891 /nfs/dbraw/zinc/19/38/91/1122193891.db2.gz XKWTVCCTYRRNPU-QILLFSRXSA-N 1 0 272.436 3.587 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCC[C@@H]1c1ccsc1 ZINC000272249111 1122195992 /nfs/dbraw/zinc/19/59/92/1122195992.db2.gz HWMKTRGLSYPKHE-CQSZACIVSA-N 1 0 259.374 3.791 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2cccs2)c(O)c1C ZINC000273297581 1122226987 /nfs/dbraw/zinc/22/69/87/1122226987.db2.gz AMYBVVRBAUBBSL-LBPRGKRZSA-N 1 0 261.390 3.921 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCO[C@H](C)C1)c1cc(Cl)ccc1O ZINC000273347904 1122229207 /nfs/dbraw/zinc/22/92/07/1122229207.db2.gz BBCFRRYUCUGDAT-UTUOFQBUSA-N 1 0 283.799 3.511 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@H]3OCC[C@@H]32)c(O)c1C ZINC000273363329 1122230544 /nfs/dbraw/zinc/23/05/44/1122230544.db2.gz AVXQQBSSRQZWLT-RKTXRCNFSA-N 1 0 289.419 3.617 20 10 CHCDRO C=C/C=C/CC[NH2+]Cc1cc(Br)cc(C)c1O ZINC001183582274 1122230639 /nfs/dbraw/zinc/23/06/39/1122230639.db2.gz KOZARXJZQZRRJN-SNAWJCMRSA-N 1 0 296.208 3.685 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2cccnc2)c(O)c1C ZINC000273412844 1122232037 /nfs/dbraw/zinc/23/20/37/1122232037.db2.gz QEENPNDNHXCAHI-KGLIPLIRSA-N 1 0 270.376 3.816 20 10 CHCDRO COCC[C@H]([NH2+][C@H](C)c1ccc(C)cc1O)c1ccco1 ZINC000273431091 1122232357 /nfs/dbraw/zinc/23/23/57/1122232357.db2.gz LCGWRLHBSMHXTF-HIFRSBDPSA-N 1 0 289.375 3.722 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCO[C@H](C(C)(C)C)C2)c1 ZINC000273483350 1122235617 /nfs/dbraw/zinc/23/56/17/1122235617.db2.gz MRCSZSIJKNWHLA-ZQIUZPCESA-N 1 0 291.435 3.945 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCc2c1cccc2O)c1cc(F)ccc1O ZINC000273562940 1122238623 /nfs/dbraw/zinc/23/86/23/1122238623.db2.gz IPYMCRLKEHMSCA-ZUZCIYMTSA-N 1 0 287.334 3.575 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccncc1)c1cc2c(cc1O)CCCC2 ZINC000273565968 1122238942 /nfs/dbraw/zinc/23/89/42/1122238942.db2.gz JMHXOUKDGWMQMT-CQSZACIVSA-N 1 0 296.414 3.559 20 10 CHCDRO Cc1nc(C)c(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)s1 ZINC000273598039 1122239851 /nfs/dbraw/zinc/23/98/51/1122239851.db2.gz RCEMDWSXSNJZQI-NSHDSACASA-N 1 0 290.432 3.933 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](CCO)CC(C)C)c(O)c1C ZINC000273608499 1122239978 /nfs/dbraw/zinc/23/99/78/1122239978.db2.gz UYEMGKAXAOAXBF-CVEARBPZSA-N 1 0 293.451 3.704 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H](CCO)CC(C)C)c(O)c1C ZINC000273608509 1122240262 /nfs/dbraw/zinc/24/02/62/1122240262.db2.gz UYEMGKAXAOAXBF-JKSUJKDBSA-N 1 0 293.451 3.704 20 10 CHCDRO C[C@H]([NH2+]CC1(CCO)CCCC1)c1cc(Cl)ccc1O ZINC000273581457 1122240279 /nfs/dbraw/zinc/24/02/79/1122240279.db2.gz MRCXBWVCVDSSLZ-LBPRGKRZSA-N 1 0 297.826 3.639 20 10 CHCDRO Cc1cc(Cl)ccc1C[NH2+]Cc1c([O-])cccc1F ZINC001183919749 1122248094 /nfs/dbraw/zinc/24/80/94/1122248094.db2.gz ORVVMJYKUURUMB-UHFFFAOYSA-N 1 0 279.742 3.783 20 10 CHCDRO C[C@@H]([NH2+]CC1(c2ccc(F)cc2)CC1)c1ccccc1O ZINC000183427037 1129054488 /nfs/dbraw/zinc/05/44/88/1129054488.db2.gz IIIHPBBDPMTJAD-CYBMUJFWSA-N 1 0 285.362 3.914 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000775134034 1122435234 /nfs/dbraw/zinc/43/52/34/1122435234.db2.gz ANWDCQTWCIPZCN-VIFPVBQESA-N 1 0 293.716 3.820 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000775134033 1122435255 /nfs/dbraw/zinc/43/52/55/1122435255.db2.gz ANWDCQTWCIPZCN-SECBINFHSA-N 1 0 293.716 3.820 20 10 CHCDRO CCCN(Cc1ccc(Cl)nc1)c1ccc(C[NH3+])cc1 ZINC000775140641 1122439192 /nfs/dbraw/zinc/43/91/92/1122439192.db2.gz OAHUAEYDFMISRC-UHFFFAOYSA-N 1 0 289.810 3.610 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H](C)CC1(OC)CCC1 ZINC000775141176 1122440363 /nfs/dbraw/zinc/44/03/63/1122440363.db2.gz XNKGGTFQVHOVIB-HNNXBMFYSA-N 1 0 290.451 3.709 20 10 CHCDRO COc1ccc(O)c(C[N@H+](C)[C@@H](C)Cc2ccccc2C)c1 ZINC000775203716 1122478401 /nfs/dbraw/zinc/47/84/01/1122478401.db2.gz HISZMSHDAKRCFY-HNNXBMFYSA-N 1 0 299.414 3.772 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCCN(c2ccccc2)C1)c1ccccc1O ZINC000183514204 1129059731 /nfs/dbraw/zinc/05/97/31/1129059731.db2.gz XJGCZCLLONZOOY-CVEARBPZSA-N 1 0 296.414 3.712 20 10 CHCDRO COc1cc(CC[NH2+][C@@H](C)c2ccccc2O)ccc1C ZINC000183527558 1129061055 /nfs/dbraw/zinc/06/10/55/1129061055.db2.gz IKSYXEKHGLDXGU-AWEZNQCLSA-N 1 0 285.387 3.603 20 10 CHCDRO CC[C@@H](CSC)[NH2+][C@@H](C)c1ccc(N(C)CC)cc1 ZINC000775420207 1122559509 /nfs/dbraw/zinc/55/95/09/1122559509.db2.gz IBVUUAIXPUDSOL-ZFWWWQNUSA-N 1 0 280.481 3.935 20 10 CHCDRO Cc1cc(C[N@H+]2CC[C@@H](CC(C)C)C2)ccc1N(C)C ZINC001191344728 1122592258 /nfs/dbraw/zinc/59/22/58/1122592258.db2.gz ZYGPTYIMNLCNNF-KRWDZBQOSA-N 1 0 274.452 3.929 20 10 CHCDRO CC([NH2+]Cc1cccc(Cl)c1[O-])(C1CC1)C1CC1 ZINC000691862791 1129065506 /nfs/dbraw/zinc/06/55/06/1129065506.db2.gz XJPUQKLWSACEOR-UHFFFAOYSA-N 1 0 265.784 3.714 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)C1CC1)c1cc(Cl)ccc1O ZINC000775485390 1122616240 /nfs/dbraw/zinc/61/62/40/1122616240.db2.gz SPNNFWLIYVTGIG-NOZJJQNGSA-N 1 0 253.773 3.885 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](C)N(C)c1ccccc1)c1ccccc1O ZINC000775487021 1122616942 /nfs/dbraw/zinc/61/69/42/1122616942.db2.gz GAQORXMILILJDU-QAPCUYQASA-N 1 0 298.430 3.958 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccc(Cl)cn1 ZINC000775501470 1122628761 /nfs/dbraw/zinc/62/87/61/1122628761.db2.gz RHUJUSSLFJIKSA-NSHDSACASA-N 1 0 288.778 3.521 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1cnn(C)c1)c1cc(Cl)ccc1O ZINC000775508573 1122629560 /nfs/dbraw/zinc/62/95/60/1122629560.db2.gz CVEDUGRDNDCINM-HZMBPMFUSA-N 1 0 293.798 3.581 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CC[C@H](CO)CC1)c1cc(Cl)ccc1O ZINC000775511863 1122633746 /nfs/dbraw/zinc/63/37/46/1122633746.db2.gz DOUDYVVVFQQAEA-WHOFXGATSA-N 1 0 297.826 3.637 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1cnccc1C)c1ccccc1O ZINC000775519606 1122638711 /nfs/dbraw/zinc/63/87/11/1122638711.db2.gz MSLSCFBDWBCPQP-BBRMVZONSA-N 1 0 270.376 3.898 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]CC[C@@H]2C[C@H]2C2CC2)c1O ZINC000712687103 1122704237 /nfs/dbraw/zinc/70/42/37/1122704237.db2.gz SVBPPVWYBNULQD-RISCZKNCSA-N 1 0 295.810 3.580 20 10 CHCDRO Cc1csc([C@H](C)[NH2+][C@H](C)c2ccc(N(C)C)cc2)n1 ZINC000080272827 1129080119 /nfs/dbraw/zinc/08/01/19/1129080119.db2.gz DDHUNIYPNQKNLI-OLZOCXBDSA-N 1 0 289.448 3.929 20 10 CHCDRO Cc1csc([C@@H](C)[NH2+][C@H](C)c2cc(C)ccc2O)n1 ZINC000080270206 1129080134 /nfs/dbraw/zinc/08/01/34/1129080134.db2.gz DUMGTTJHONUXDT-VXGBXAGGSA-N 1 0 276.405 3.877 20 10 CHCDRO Cc1cccc(OCC[N@@H+](C)Cc2cccc(C)c2O)c1 ZINC000775645769 1122853147 /nfs/dbraw/zinc/85/31/47/1122853147.db2.gz ABOGBIKXYZYWLU-UHFFFAOYSA-N 1 0 285.387 3.520 20 10 CHCDRO COc1ccc(O)c(C[N@H+](Cc2cccs2)C(C)C)c1 ZINC000775650927 1122865878 /nfs/dbraw/zinc/86/58/78/1122865878.db2.gz IHUIMJLNUKVSNO-UHFFFAOYSA-N 1 0 291.416 3.873 20 10 CHCDRO CC[N@H+](CCc1cccs1)Cc1cccc(C)c1O ZINC000775656488 1122871427 /nfs/dbraw/zinc/87/14/27/1122871427.db2.gz HMXYEDOIVRMAAA-UHFFFAOYSA-N 1 0 275.417 3.827 20 10 CHCDRO Cc1cccc(C[N@@H+]2CC[C@H](c3cccc(F)c3)C2)c1O ZINC000775680823 1122902145 /nfs/dbraw/zinc/90/21/45/1122902145.db2.gz JRYYJTWXHIDZEH-HNNXBMFYSA-N 1 0 285.362 3.829 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCc3c(Cl)cccc3C2)c1O ZINC000775689340 1122909161 /nfs/dbraw/zinc/90/91/61/1122909161.db2.gz GZZKFRHCBVRNSU-UHFFFAOYSA-N 1 0 287.790 3.912 20 10 CHCDRO Cc1cc(Br)cc(C[N@H+]2CC=C(C)CC2)c1O ZINC000775701186 1122912359 /nfs/dbraw/zinc/91/23/59/1122912359.db2.gz DHMWNHGLWLCGAH-UHFFFAOYSA-N 1 0 296.208 3.615 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CCC[C@]3(CC=CCC3)C2)c1 ZINC000775698159 1122912410 /nfs/dbraw/zinc/91/24/10/1122912410.db2.gz KGVBQQCOKPGHFN-GOSISDBHSA-N 1 0 287.403 3.723 20 10 CHCDRO Cc1cccc(CN2CCc3c(F)ccc(F)c3C2)c1O ZINC000775728879 1122927717 /nfs/dbraw/zinc/92/77/17/1122927717.db2.gz YQNSFZCGPCCJOR-UHFFFAOYSA-N 1 0 289.325 3.537 20 10 CHCDRO Cc1cccc(C[N@@H+](C)[C@H](C)[C@H]2Cc3ccccc3O2)c1O ZINC000775741601 1122933326 /nfs/dbraw/zinc/93/33/26/1122933326.db2.gz TVWKODAQLJFZRM-RDTXWAMCSA-N 1 0 297.398 3.525 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)c(C)n1 ZINC000775837394 1122985702 /nfs/dbraw/zinc/98/57/02/1122985702.db2.gz SBRKWXZHCRGWCE-AWEZNQCLSA-N 1 0 283.419 3.615 20 10 CHCDRO C[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001198958920 1123016823 /nfs/dbraw/zinc/01/68/23/1123016823.db2.gz FTVHGIAAAKBSDS-CZUORRHYSA-N 1 0 259.393 3.680 20 10 CHCDRO Cc1ccc(NCc2cc(Cl)cc(F)c2O)nc1 ZINC000776032352 1123043121 /nfs/dbraw/zinc/04/31/21/1123043121.db2.gz AHEVYGFTEMZNIK-UHFFFAOYSA-N 1 0 266.703 3.500 20 10 CHCDRO CC1=CCC[C@H](C)[C@H]1C[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC001199865682 1123045661 /nfs/dbraw/zinc/04/56/61/1123045661.db2.gz SXYSFGKKYMYNNG-HOCLYGCPSA-N 1 0 290.426 3.974 20 10 CHCDRO C[C@@H](Cc1ccccc1F)[NH2+]Cc1cccc(Cl)c1[O-] ZINC000776038598 1123050284 /nfs/dbraw/zinc/05/02/84/1123050284.db2.gz IPQFYMLBVDFHDZ-NSHDSACASA-N 1 0 293.769 3.906 20 10 CHCDRO Cc1cc(Br)cc(C[NH2+][C@H](C)C2(C)CC2)c1O ZINC000776068218 1123051917 /nfs/dbraw/zinc/05/19/17/1123051917.db2.gz HEYNVVCDAWEHAI-SNVBAGLBSA-N 1 0 298.224 3.741 20 10 CHCDRO COc1cccc(Cl)c1C[NH2+][C@H](C)c1ccccc1O ZINC000188281477 1123056564 /nfs/dbraw/zinc/05/65/64/1123056564.db2.gz FUQAYSMZGHXYGZ-LLVKDONJSA-N 1 0 291.778 3.905 20 10 CHCDRO COc1cccc(O)c1C[NH2+]CC[C@H](C)c1ccccc1 ZINC000776153651 1123086627 /nfs/dbraw/zinc/08/66/27/1123086627.db2.gz BZFJSTZFUPLRMI-AWEZNQCLSA-N 1 0 285.387 3.684 20 10 CHCDRO CC[C@](C)([NH2+]Cc1cc(OC)ccc1O)c1ccccc1 ZINC000776179789 1123096219 /nfs/dbraw/zinc/09/62/19/1123096219.db2.gz YJYPAVVQDMVABK-SFHVURJKSA-N 1 0 285.387 3.816 20 10 CHCDRO Cc1ccc2c(c1)[C@H]([NH2+]Cc1cc(C)ccc1O)CC2 ZINC000776174349 1123101361 /nfs/dbraw/zinc/10/13/61/1123101361.db2.gz JPCNODCNCDTKCY-QGZVFWFLSA-N 1 0 267.372 3.786 20 10 CHCDRO CCOc1ccc(C[NH2+][C@@H]2CCc3ccc(C)cc32)c(O)c1 ZINC000776174615 1123101438 /nfs/dbraw/zinc/10/14/38/1123101438.db2.gz QCFVNAOQSRHIAN-GOSISDBHSA-N 1 0 297.398 3.876 20 10 CHCDRO CC[C@@H](C)C[N@@H+]1CCc2c(c3cc(OC)ccc3n2C)C1 ZINC001201511336 1123113993 /nfs/dbraw/zinc/11/39/93/1123113993.db2.gz JIELUBMRVDDWHH-CYBMUJFWSA-N 1 0 286.419 3.591 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)c2cc3ccccc3o2)c(O)c1 ZINC000189091562 1123132708 /nfs/dbraw/zinc/13/27/08/1123132708.db2.gz PYZWARSKUANIED-LBPRGKRZSA-N 1 0 297.354 3.998 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+]C[C@@H](C)c2ccncc2)c1O ZINC000776222779 1123156212 /nfs/dbraw/zinc/15/62/12/1123156212.db2.gz VMOUHNWKBQNBQL-GFCCVEGCSA-N 1 0 290.794 3.642 20 10 CHCDRO CCCN(CCC)c1ccc(C[NH2+][C@H](CC)[C@H](C)O)cc1 ZINC001202381516 1123204264 /nfs/dbraw/zinc/20/42/64/1123204264.db2.gz OSEMNMLXBJDLHQ-MAUKXSAKSA-N 1 0 292.467 3.562 20 10 CHCDRO COc1ccc(C[NH2+]CCc2cc(C)ccc2F)cc1C ZINC001202426749 1123206771 /nfs/dbraw/zinc/20/67/71/1123206771.db2.gz MGZYNQLSHLHWFB-UHFFFAOYSA-N 1 0 287.378 3.783 20 10 CHCDRO Cc1cc(C[NH+]2CCCC2)c(C)n1-c1ccccc1 ZINC001137853994 1123213987 /nfs/dbraw/zinc/21/39/87/1123213987.db2.gz DGZWTDVZVIMDRL-UHFFFAOYSA-N 1 0 254.377 3.690 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](C)[C@@H]2CCCOC2)cc1 ZINC000780747102 1123226795 /nfs/dbraw/zinc/22/67/95/1123226795.db2.gz WMUBQBRDJREOTA-YQQAZPJKSA-N 1 0 290.451 3.608 20 10 CHCDRO CC[C@@H](C)[NH2+]Cc1cc(OC)cc(C(C)(C)C)c1O ZINC000850008529 1123236837 /nfs/dbraw/zinc/23/68/37/1123236837.db2.gz VGQGXUYNSAEWKG-LLVKDONJSA-N 1 0 265.397 3.586 20 10 CHCDRO COc1cc(C[NH2+][C@@H]2CC[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC000850296916 1123251958 /nfs/dbraw/zinc/25/19/58/1123251958.db2.gz ZWGHMPKKVZALLG-IAQYHMDHSA-N 1 0 277.408 3.586 20 10 CHCDRO Cc1cc(F)ccc1C[C@H](C)[NH2+]Cc1ccccc1O ZINC000850350407 1123254512 /nfs/dbraw/zinc/25/45/12/1123254512.db2.gz RQMCBCFBBIKLJV-ZDUSSCGKSA-N 1 0 273.351 3.561 20 10 CHCDRO CSCC1(CC[NH2+]Cc2cc(Cl)ccc2O)CC1 ZINC000850356227 1123255489 /nfs/dbraw/zinc/25/54/89/1123255489.db2.gz QPKSWJPUVFNKFT-UHFFFAOYSA-N 1 0 285.840 3.669 20 10 CHCDRO CCOc1cccc(CNc2[nH+]ccc(C)c2C2CC2)c1O ZINC000850363021 1123257560 /nfs/dbraw/zinc/25/75/60/1123257560.db2.gz YBVYFFLLCPPRLM-UHFFFAOYSA-N 1 0 298.386 3.984 20 10 CHCDRO COc1ccc(C[NH2+]CC[C@]2(C)CC2(F)F)cc1C ZINC000850380996 1123261311 /nfs/dbraw/zinc/26/13/11/1123261311.db2.gz SLRGESLGMWJZLY-CQSZACIVSA-N 1 0 269.335 3.529 20 10 CHCDRO COc1cccc(C2([NH2+]Cc3ccccc3O)CCC2)c1 ZINC000850405563 1123263723 /nfs/dbraw/zinc/26/37/23/1123263723.db2.gz UOZIXFYJIWLZLK-UHFFFAOYSA-N 1 0 283.371 3.570 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2COC(C)(C)C2)c1O ZINC000850482590 1123273090 /nfs/dbraw/zinc/27/30/90/1123273090.db2.gz PZWRACBAHWLHEM-CMPLNLGQSA-N 1 0 283.799 3.572 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1COC(C)(C)C1)c1cc(Cl)ccc1O ZINC000850483239 1123274069 /nfs/dbraw/zinc/27/40/69/1123274069.db2.gz VLCKEIUTWODJKD-AAEUAGOBSA-N 1 0 283.799 3.654 20 10 CHCDRO CC[C@H](COCC1CC1)[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000850492213 1123274235 /nfs/dbraw/zinc/27/42/35/1123274235.db2.gz BRMBJYPJVNESKE-GOEBONIOSA-N 1 0 291.435 3.865 20 10 CHCDRO CC[C@@H](COCC1CC1)[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000850492214 1123274449 /nfs/dbraw/zinc/27/44/49/1123274449.db2.gz BRMBJYPJVNESKE-HOCLYGCPSA-N 1 0 291.435 3.865 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1COC(C)(C)C1)c1cc(Cl)ccc1O ZINC000850483240 1123274475 /nfs/dbraw/zinc/27/44/75/1123274475.db2.gz VLCKEIUTWODJKD-DGCLKSJQSA-N 1 0 283.799 3.654 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCc2noc3ccccc23)c(O)c1 ZINC000850483688 1123274546 /nfs/dbraw/zinc/27/45/46/1123274546.db2.gz QYOFOSOHTGUBRZ-CYBMUJFWSA-N 1 0 296.370 3.735 20 10 CHCDRO CSCC1(CC[NH2+][C@H](C)c2ccccc2O)CC1 ZINC000850506097 1123275991 /nfs/dbraw/zinc/27/59/91/1123275991.db2.gz FNRFBWMOGZBRSV-GFCCVEGCSA-N 1 0 265.422 3.576 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H]2COC3(CCC3)C2)cc1 ZINC000850524519 1123281047 /nfs/dbraw/zinc/28/10/47/1123281047.db2.gz GTJOVUUGBHNJPK-ZBFHGGJFSA-N 1 0 288.435 3.505 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@H]2C[C@@H](O)c3ccccc32)c(O)c1 ZINC000850524206 1123281207 /nfs/dbraw/zinc/28/12/07/1123281207.db2.gz ANMOGKFIWPTVQA-RRQGHBQHSA-N 1 0 297.398 3.838 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CCCOC(C)(C)C)c(O)c1 ZINC000850527786 1123282708 /nfs/dbraw/zinc/28/27/08/1123282708.db2.gz ZFHOIKIYRNGQBF-CQSZACIVSA-N 1 0 279.424 3.865 20 10 CHCDRO CC[C@@H]([NH2+]CCC(C)(C)F)c1ccc(N(C)C)cc1 ZINC000850530602 1123285224 /nfs/dbraw/zinc/28/52/24/1123285224.db2.gz ATDUGUVRVUDOIM-OAHLLOKOSA-N 1 0 266.404 3.932 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc(COC)cs1)c1ccccc1O ZINC000850533484 1123286048 /nfs/dbraw/zinc/28/60/48/1123286048.db2.gz ZQAFMOIZXJAQBN-OAHLLOKOSA-N 1 0 291.416 3.841 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCC[C@@H](C)O1)c1ccc(C)cc1O ZINC000850535020 1123286294 /nfs/dbraw/zinc/28/62/94/1123286294.db2.gz PQYKJGHNNSGSSF-FMKPAKJESA-N 1 0 277.408 3.699 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccoc1)c1ccc(C)cc1O ZINC000850532589 1123286313 /nfs/dbraw/zinc/28/63/13/1123286313.db2.gz WFPYLBFMPFZWAM-HNNXBMFYSA-N 1 0 259.349 3.577 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCC[C@@H](C)O1)c1ccc(C)cc1O ZINC000850535022 1123286394 /nfs/dbraw/zinc/28/63/94/1123286394.db2.gz PQYKJGHNNSGSSF-YCPHGPKFSA-N 1 0 277.408 3.699 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@]2(C)CC2(F)F)c(O)c1 ZINC000850536894 1123287086 /nfs/dbraw/zinc/28/70/86/1123287086.db2.gz OSJOEBGGUAYOEO-SMDDNHRTSA-N 1 0 269.335 3.705 20 10 CHCDRO C[C@@H]([NH2+]CC[C@@]1(C)CC1(F)F)c1ccc(N(C)C)cc1 ZINC000850536198 1123287119 /nfs/dbraw/zinc/28/71/19/1123287119.db2.gz IHERMYBWGKMFNN-DOMZBBRYSA-N 1 0 282.378 3.839 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCc2ccc(O)cc21)c1ccccc1O ZINC000850543761 1123288637 /nfs/dbraw/zinc/28/86/37/1123288637.db2.gz PNLHBYGTCDTURU-IRXDYDNUSA-N 1 0 283.371 3.826 20 10 CHCDRO CCSC1(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)CC1 ZINC000850552343 1123289810 /nfs/dbraw/zinc/28/98/10/1123289810.db2.gz MLZORWOVNDGKNC-ZYHUDNBSSA-N 1 0 295.423 3.955 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1C(C)(C)C1(F)F)c1cc(Cl)ccc1O ZINC000850551332 1123289869 /nfs/dbraw/zinc/28/98/69/1123289869.db2.gz GWKBBFGIHAMHIO-UFBFGSQYSA-N 1 0 289.753 3.988 20 10 CHCDRO CCSC1(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)CC1 ZINC000850552337 1123289990 /nfs/dbraw/zinc/28/99/90/1123289990.db2.gz MLZORWOVNDGKNC-CMPLNLGQSA-N 1 0 295.423 3.955 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1C(C)(C)C1(F)F)c1cc(Cl)ccc1O ZINC000850551327 1123290085 /nfs/dbraw/zinc/29/00/85/1123290085.db2.gz GWKBBFGIHAMHIO-PELKAZGASA-N 1 0 289.753 3.988 20 10 CHCDRO CC(C)[C@@H](O)[C@H]([NH2+][C@@H](C)c1ccccc1O)c1ccccc1 ZINC000850555142 1123290868 /nfs/dbraw/zinc/29/08/68/1123290868.db2.gz MIQAYACUKFTLQK-GDIGMMSISA-N 1 0 299.414 3.801 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)C2CCC(F)CC2)c1 ZINC000850554383 1123291185 /nfs/dbraw/zinc/29/11/85/1123291185.db2.gz JHDARAQTTOUJGP-MRFVTOPCSA-N 1 0 295.398 3.968 20 10 CHCDRO C[C@H]([NH2+]CC1SCCS1)c1ccc(Cl)cc1O ZINC000850562536 1123292907 /nfs/dbraw/zinc/29/29/07/1123292907.db2.gz WMMZTGACYZBXLT-QMMMGPOBSA-N 1 0 289.853 3.502 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1CCOC1(C)C)c1cc(Cl)ccc1O ZINC000850572011 1123294979 /nfs/dbraw/zinc/29/49/79/1123294979.db2.gz XWFBOJUCPNBLEP-SMDDNHRTSA-N 1 0 297.826 3.901 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1CCOC1(C)C)c1cc(Cl)ccc1O ZINC000850572008 1123295180 /nfs/dbraw/zinc/29/51/80/1123295180.db2.gz XWFBOJUCPNBLEP-BXUZGUMPSA-N 1 0 297.826 3.901 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H](c2ccccc2)[C@H](C)O)c(O)c1C ZINC000850585152 1123296198 /nfs/dbraw/zinc/29/61/98/1123296198.db2.gz VZHLGAICSDPFML-MPGHIAIKSA-N 1 0 299.414 3.782 20 10 CHCDRO COc1cccc(C[NH2+][C@H](C)c2cc(F)ccc2O)c1C ZINC000850579748 1123296319 /nfs/dbraw/zinc/29/63/19/1123296319.db2.gz ZGEBADWUAODLAP-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO C[C@H](O)[C@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1ccccc1 ZINC000850585145 1123296349 /nfs/dbraw/zinc/29/63/49/1123296349.db2.gz VXACVHRXNBQBFJ-DOXZYTNZSA-N 1 0 298.430 3.525 20 10 CHCDRO CC[C@@H](c1ccccc1)[N@H+](C)Cc1ccccc1O ZINC000109770424 1123326803 /nfs/dbraw/zinc/32/68/03/1123326803.db2.gz CBBUJYCIIPVJLA-INIZCTEOSA-N 1 0 255.361 3.975 20 10 CHCDRO CC[C@H](C[NH2+][C@@H](C)c1cc(OC)ccc1O)CC(F)F ZINC000851900115 1123387670 /nfs/dbraw/zinc/38/76/70/1123387670.db2.gz PIQBJLYXZYCOLF-QWRGUYRKSA-N 1 0 287.350 3.733 20 10 CHCDRO Cc1cc(C)cc(CC[NH2+][C@@H](C)c2ccccc2O)c1 ZINC000783512916 1123408474 /nfs/dbraw/zinc/40/84/74/1123408474.db2.gz HCVZCEHTAWHZEE-HNNXBMFYSA-N 1 0 269.388 3.902 20 10 CHCDRO CC(C)(C[NH2+]Cc1ccc2c(c1)CCO2)CC(F)(F)F ZINC000853096314 1123423877 /nfs/dbraw/zinc/42/38/77/1123423877.db2.gz WZVVOEPTGGGTTB-UHFFFAOYSA-N 1 0 287.325 3.690 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccnn1CC)c1cc(Cl)ccc1O ZINC000853241032 1123429058 /nfs/dbraw/zinc/42/90/58/1123429058.db2.gz SAHHDYCYONJCHX-CQSZACIVSA-N 1 0 293.798 3.503 20 10 CHCDRO Cc1cc(O)c(C[NH+]2CCC(c3ccco3)CC2)cc1C ZINC000853527157 1123443240 /nfs/dbraw/zinc/44/32/40/1123443240.db2.gz MRCMWJWFAKPBPL-UHFFFAOYSA-N 1 0 285.387 3.982 20 10 CHCDRO CC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1c(O)ccc2ccncc21 ZINC000853605921 1123444258 /nfs/dbraw/zinc/44/42/58/1123444258.db2.gz PKLMANGTQIVFNM-LQDVMPOASA-N 1 0 282.387 3.703 20 10 CHCDRO CC(C)(C)c1cc(O)c(O)c(C[N@@H+]2CCC[C@@](C)(F)C2)c1 ZINC000840098893 1123460180 /nfs/dbraw/zinc/46/01/80/1123460180.db2.gz FJHANOXPUDDIBA-QGZVFWFLSA-N 1 0 295.398 3.719 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2cccc(N)c2)cc1 ZINC000854217240 1123477954 /nfs/dbraw/zinc/47/79/54/1123477954.db2.gz JCGAMKNBHJAFDL-CQSZACIVSA-N 1 0 283.419 3.576 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2cccc(N)c2)cc1 ZINC000854217238 1123478104 /nfs/dbraw/zinc/47/81/04/1123478104.db2.gz JCGAMKNBHJAFDL-AWEZNQCLSA-N 1 0 283.419 3.576 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc(Cl)c(C)cc1O)[C@H]1CCCOC1 ZINC000895664132 1123503281 /nfs/dbraw/zinc/50/32/81/1123503281.db2.gz PWMSNOHNLNHQNW-SWLSCSKDSA-N 1 0 297.826 3.649 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H]2c3ccccc3CC[C@@H]2F)c1O ZINC000895693151 1123505496 /nfs/dbraw/zinc/50/54/96/1123505496.db2.gz YZTRBBDJPMDXRJ-DLBZAZTESA-N 1 0 285.362 3.816 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2ccc(OC(C)C)cc2)c1 ZINC000113320081 1123518483 /nfs/dbraw/zinc/51/84/83/1123518483.db2.gz QINXCFLOKFZBDD-UHFFFAOYSA-N 1 0 285.387 3.778 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)[C@@H]1COc2ccccc2C1)c1ccccc1O ZINC000895851039 1123521343 /nfs/dbraw/zinc/52/13/43/1123521343.db2.gz IIJUPZQVTPKIFR-FMKPAKJESA-N 1 0 297.398 3.683 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)C1(C)CC1)c1ccc(N(C)C)cc1 ZINC000776884131 1123559963 /nfs/dbraw/zinc/55/99/63/1123559963.db2.gz ZKIMEWUKEFFRPN-CJNGLKHVSA-N 1 0 260.425 3.982 20 10 CHCDRO CCc1cccc(C[NH2+]CC[C@@H]2CC2(Cl)Cl)c1O ZINC000857061822 1123583520 /nfs/dbraw/zinc/58/35/20/1123583520.db2.gz DQQGUQXPWBENED-GFCCVEGCSA-N 1 0 288.218 3.628 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]CC[C@@H]1CC1(Cl)Cl)CC2 ZINC000857080438 1123585236 /nfs/dbraw/zinc/58/52/36/1123585236.db2.gz GMZPYJFFPITURH-GHMZBOCLSA-N 1 0 286.202 3.553 20 10 CHCDRO C[C@H]([NH2+]CC[C@H]1CC1(F)F)c1cc2c(cc1O)CCCC2 ZINC000857082831 1123585643 /nfs/dbraw/zinc/58/56/43/1123585643.db2.gz YKNKUTHXAOOHTM-FZMZJTMJSA-N 1 0 295.373 3.967 20 10 CHCDRO CC(C)C[C@H]1C[C@@H]([NH2+]Cc2cc(Cl)ccc2O)CCO1 ZINC000776951622 1123612580 /nfs/dbraw/zinc/61/25/80/1123612580.db2.gz XRQKULFJMKHMPA-GJZGRUSLSA-N 1 0 297.826 3.729 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2cccc3c2OC(C)(C)C3)c1 ZINC000858237356 1123638944 /nfs/dbraw/zinc/63/89/44/1123638944.db2.gz KZPSTZGKZLOKOG-UHFFFAOYSA-N 1 0 297.398 3.704 20 10 CHCDRO CC[C@H]([NH2+]C[C@]1(C)C[C@H]2C[C@H]2C1)c1ccccc1O ZINC000858538926 1123661390 /nfs/dbraw/zinc/66/13/90/1123661390.db2.gz ZATKSKUOWMHZJD-YXPYIKCWSA-N 1 0 259.393 3.869 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2CO[C@H](C3CC3)C2)c1O ZINC000858548249 1123661455 /nfs/dbraw/zinc/66/14/55/1123661455.db2.gz RPODEDAHAXRXIK-ZBINZKHDSA-N 1 0 295.810 3.572 20 10 CHCDRO COCC1([NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)CC1 ZINC000777237119 1123795995 /nfs/dbraw/zinc/79/59/95/1123795995.db2.gz GINQBUAEBGDAJI-HNNXBMFYSA-N 1 0 288.435 3.507 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CCC(F)(F)C1)c1ccc(N(C)C)cc1 ZINC000777243732 1123796843 /nfs/dbraw/zinc/79/68/43/1123796843.db2.gz XWXUVJQSIKJDKK-UKRRQHHQSA-N 1 0 282.378 3.981 20 10 CHCDRO CCOc1ccc(C[NH+]2C[C@H](C)C(F)(F)[C@@H](C)C2)c(O)c1 ZINC000862444676 1123811047 /nfs/dbraw/zinc/81/10/47/1123811047.db2.gz XPSBAEBLKKFOCV-RYUDHWBXSA-N 1 0 299.361 3.514 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCC[C@@H]2C[C@@H]21)c1ccc(N(C)C)cc1 ZINC000840820210 1123826624 /nfs/dbraw/zinc/82/66/24/1123826624.db2.gz QRQGZMNVSVEDHN-QIJZBDPFSA-N 1 0 258.409 3.592 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+][C@H]1CCc2ccccc2C1 ZINC000083551414 1129149716 /nfs/dbraw/zinc/14/97/16/1129149716.db2.gz PTQGOEVBKFMUSP-AWEZNQCLSA-N 1 0 287.790 3.693 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCO[C@@H]3CCC[C@@H]32)cc1C(C)C ZINC000863306659 1123859445 /nfs/dbraw/zinc/85/94/45/1123859445.db2.gz OBBIGZPRPXZTPB-FUHWJXTLSA-N 1 0 289.419 3.577 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CS[C@H](C)C1)c1cccc(Cl)c1[O-] ZINC000840860979 1123861550 /nfs/dbraw/zinc/86/15/50/1123861550.db2.gz YKMOSTLBSYJRFO-BREBYQMCSA-N 1 0 285.840 3.980 20 10 CHCDRO CC[C@@H]([NH2+]CCc1cccc(OC)c1)c1ccc(C)cc1O ZINC000794797034 1123949449 /nfs/dbraw/zinc/94/94/49/1123949449.db2.gz LQYYTFSHFBXVPP-GOSISDBHSA-N 1 0 299.414 3.993 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccc(C)o1)c1ccc(C)cc1O ZINC000794797705 1123950506 /nfs/dbraw/zinc/95/05/06/1123950506.db2.gz PXUVFRSFQANKBJ-INIZCTEOSA-N 1 0 273.376 3.885 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc([C@H](C)O)cc1)c1ccc(C)cc1O ZINC000794801682 1123950539 /nfs/dbraw/zinc/95/05/39/1123950539.db2.gz JWTKUVDISCBWOU-KSSFIOAISA-N 1 0 299.414 3.995 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)Cc1ccco1)c1ccc(C)cc1O ZINC000794794012 1123951501 /nfs/dbraw/zinc/95/15/01/1123951501.db2.gz PBGKSXXZNDQTMW-XJKSGUPXSA-N 1 0 273.376 3.966 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)CC(C)(C)OC)c1ccc(C)cc1O ZINC000794803725 1123952990 /nfs/dbraw/zinc/95/29/90/1123952990.db2.gz SMSKBBGIRINUEA-ZFWWWQNUSA-N 1 0 279.424 3.945 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CCC(F)(F)C1)c1ccc(C)cc1O ZINC000794815568 1123957400 /nfs/dbraw/zinc/95/74/00/1123957400.db2.gz WJYJNXDGDXEEIL-WCQYABFASA-N 1 0 269.335 3.929 20 10 CHCDRO CC[C@H]([NH2+][C@@H](CO)CC(C)(C)C)c1ccc(C)cc1O ZINC000794818330 1123960164 /nfs/dbraw/zinc/96/01/64/1123960164.db2.gz RVUKBZYAEOYGAK-HIFRSBDPSA-N 1 0 279.424 3.538 20 10 CHCDRO CC[C@@H]([NH2+]CC1(SC)CC1)c1ccc(C)cc1O ZINC000794826714 1123962000 /nfs/dbraw/zinc/96/20/00/1123962000.db2.gz DCLJXOGOEXVKHZ-CYBMUJFWSA-N 1 0 265.422 3.637 20 10 CHCDRO COC1([C@@H](C)[NH2+][C@@H](C)c2ccc(C)c(C)c2O)CCC1 ZINC000840884665 1123995169 /nfs/dbraw/zinc/99/51/69/1123995169.db2.gz ONEABDYFJSHKQR-UONOGXRCSA-N 1 0 277.408 3.617 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2cc(F)ccc2O)[C@@H]2CCCC[C@H]21 ZINC000783592151 1123995456 /nfs/dbraw/zinc/99/54/56/1123995456.db2.gz DGEMNQLAZUNGGF-BYCMXARLSA-N 1 0 263.356 3.542 20 10 CHCDRO Cc1cccc(C[N@H+]2C[C@H](C)[C@H]3CCCC[C@@H]32)c1O ZINC000783593271 1123998067 /nfs/dbraw/zinc/99/80/67/1123998067.db2.gz OVPWXOLRKLXXNO-IMJJTQAJSA-N 1 0 259.393 3.711 20 10 CHCDRO CCOCc1cc(C[NH2+][C@H]2CCCC23CC3)ccc1OC ZINC000865657256 1124003235 /nfs/dbraw/zinc/00/32/35/1124003235.db2.gz YXQCGYTWBHYJGP-KRWDZBQOSA-N 1 0 289.419 3.654 20 10 CHCDRO Cc1ncc([C@H](C)[NH2+]Cc2cc(Cl)ccc2O)s1 ZINC000865702088 1124007196 /nfs/dbraw/zinc/00/71/96/1124007196.db2.gz USLDEFXGJXHYIJ-QMMMGPOBSA-N 1 0 282.796 3.661 20 10 CHCDRO CC(C)CO[C@@H]1CC[N@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000120893496 1124032288 /nfs/dbraw/zinc/03/22/88/1124032288.db2.gz CXQVWGVAMIFEPC-MRXNPFEDSA-N 1 0 299.414 3.792 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+]Cc2ccc3ccccc3c2O)CS1 ZINC000840958946 1124041396 /nfs/dbraw/zinc/04/13/96/1124041396.db2.gz POTYWRHVJNRHKI-RISCZKNCSA-N 1 0 273.401 3.529 20 10 CHCDRO CCC[C@H](CCO)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000866414761 1124064365 /nfs/dbraw/zinc/06/43/65/1124064365.db2.gz KKPDLQKPWVHRRL-UKRRQHHQSA-N 1 0 287.403 3.747 20 10 CHCDRO CC(C)C[NH2+][C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000121066781 1124066111 /nfs/dbraw/zinc/06/61/11/1124066111.db2.gz QSUUXWKXCCGONR-CYBMUJFWSA-N 1 0 298.377 3.502 20 10 CHCDRO Cc1ncc([C@H](C)[NH2+][C@@H](C)c2ccc(C)cc2O)s1 ZINC000866454572 1124067890 /nfs/dbraw/zinc/06/78/90/1124067890.db2.gz CXVJUBLFQZMYQJ-QWRGUYRKSA-N 1 0 276.405 3.877 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)o1 ZINC000866477541 1124070033 /nfs/dbraw/zinc/07/00/33/1124070033.db2.gz BAXUBSYRJCUZJZ-ZDUSSCGKSA-N 1 0 259.349 3.761 20 10 CHCDRO Oc1ccccc1C[NH2+]CCCCCOc1ccccc1 ZINC000783611058 1124081851 /nfs/dbraw/zinc/08/18/51/1124081851.db2.gz PUKFKFAMDLAKSX-UHFFFAOYSA-N 1 0 285.387 3.731 20 10 CHCDRO CC[C@H]([NH2+]Cc1cccc(OC)c1)c1ccccc1O ZINC000037680201 1129165477 /nfs/dbraw/zinc/16/54/77/1129165477.db2.gz ZYWJHJNPNYKDPV-INIZCTEOSA-N 1 0 271.360 3.642 20 10 CHCDRO CC[C@H](C[C@H](C)O)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000866635049 1124092909 /nfs/dbraw/zinc/09/29/09/1124092909.db2.gz MHYZCLYWMPPIED-GZBFAFLISA-N 1 0 287.403 3.746 20 10 CHCDRO Cc1cc(O)c(CNc2ccc([C@H](C)[NH3+])cc2)cc1C ZINC000841027443 1124106569 /nfs/dbraw/zinc/10/65/69/1124106569.db2.gz BCCMISUAAGENID-ZDUSSCGKSA-N 1 0 270.376 3.641 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]CCCC2CCC2)c1 ZINC000689040502 1129174531 /nfs/dbraw/zinc/17/45/31/1129174531.db2.gz SCGNRUMRACDQTF-LBPRGKRZSA-N 1 0 263.381 3.632 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)o1 ZINC000122797783 1124535592 /nfs/dbraw/zinc/53/55/92/1124535592.db2.gz JKLUKODVBIJVPI-AWEZNQCLSA-N 1 0 272.392 3.813 20 10 CHCDRO CCCC[C@@H](CC)C[NH2+]Cc1cc(OC)ccc1O ZINC000019232157 1124649811 /nfs/dbraw/zinc/64/98/11/1124649811.db2.gz NGXXIAGGIMBMIP-CYBMUJFWSA-N 1 0 265.397 3.707 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H]2C[C@H]3CCC[C@@H]3O2)c(O)c1 ZINC000872106851 1124684814 /nfs/dbraw/zinc/68/48/14/1124684814.db2.gz IKRHMVKEMNOEDC-IVSAIRAKSA-N 1 0 289.419 3.617 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1nccnc1C)c1ccc(N(C)C)cc1 ZINC000872135038 1124693564 /nfs/dbraw/zinc/69/35/64/1124693564.db2.gz UUKZYYPWJJBMEO-RHSMWYFYSA-N 1 0 298.434 3.653 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CC[C@H]2CSC[C@H]2C1 ZINC000872721388 1124726781 /nfs/dbraw/zinc/72/67/81/1124726781.db2.gz FOYCPQFUFMWBLJ-LSDHHAIUSA-N 1 0 299.439 3.730 20 10 CHCDRO CCCOc1ccc(C[NH2+]Cc2ccco2)cc1C ZINC000873007393 1124734505 /nfs/dbraw/zinc/73/45/05/1124734505.db2.gz OQKIOMGBGNTKIS-UHFFFAOYSA-N 1 0 259.349 3.667 20 10 CHCDRO C[C@@H]([NH2+]CC[C@@H]1CNc2ccccc21)c1ccccc1O ZINC000873236881 1124753300 /nfs/dbraw/zinc/75/33/00/1124753300.db2.gz JYFASCWDWIXKLR-ZIAGYGMSSA-N 1 0 282.387 3.642 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]CC[C@H]1CNc3ccccc31)CC2 ZINC000873238276 1124754885 /nfs/dbraw/zinc/75/48/85/1124754885.db2.gz YWYXDRDEDIKEOW-YOEHRIQHSA-N 1 0 294.398 3.569 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccccc1F)c1ccccc1O ZINC000019912777 1124770270 /nfs/dbraw/zinc/77/02/70/1124770270.db2.gz LMTNVQZBKCQOFA-INIZCTEOSA-N 1 0 273.351 3.815 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]C[C@H](C)C(C)(C)C)c1 ZINC000125100092 1124849373 /nfs/dbraw/zinc/84/93/73/1124849373.db2.gz ZRYILRLNAAKVPF-RYUDHWBXSA-N 1 0 265.397 3.734 20 10 CHCDRO CSCCC[N@H+](C)Cc1cc(Cl)c(C)cc1O ZINC000825768179 1124880000 /nfs/dbraw/zinc/88/00/00/1124880000.db2.gz CMDPVSXUEMQGTC-UHFFFAOYSA-N 1 0 273.829 3.539 20 10 CHCDRO Oc1ccccc1C[NH2+]Cc1ccc(Cl)c2cccnc12 ZINC000125406166 1124889730 /nfs/dbraw/zinc/88/97/30/1124889730.db2.gz JDLBWQXMWJRLHY-UHFFFAOYSA-N 1 0 298.773 3.884 20 10 CHCDRO C[N@H+](Cc1ccc(Cl)nc1)Cc1cc(Cl)ccc1O ZINC000125731641 1124921438 /nfs/dbraw/zinc/92/14/38/1124921438.db2.gz PDVJGXSSWCGHPC-UHFFFAOYSA-N 1 0 297.185 3.726 20 10 CHCDRO COc1ccc([C@H](C)[N@H+](C)Cc2cc(C)ccc2O)cc1 ZINC000125830027 1124929923 /nfs/dbraw/zinc/92/99/23/1124929923.db2.gz WIZNVFVNOCZKMX-AWEZNQCLSA-N 1 0 285.387 3.902 20 10 CHCDRO Cc1ccc(C[N@@H+]2CCCO[C@@H](c3ccccc3)C2)c(O)c1 ZINC000876683446 1124971063 /nfs/dbraw/zinc/97/10/63/1124971063.db2.gz BSQIVOXCULHBSH-LJQANCHMSA-N 1 0 297.398 3.664 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H]2CCc3cc(F)ccc32)c(O)c1 ZINC000876973889 1124993070 /nfs/dbraw/zinc/99/30/70/1124993070.db2.gz RLISKVVHQVEVJP-MRXNPFEDSA-N 1 0 271.335 3.617 20 10 CHCDRO Cc1ccc(C[NH2+]CCCCOCc2ccccc2)c(O)c1 ZINC000876990920 1124995446 /nfs/dbraw/zinc/99/54/46/1124995446.db2.gz FCGCNXFXNNTVIY-UHFFFAOYSA-N 1 0 299.414 3.787 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2nc(C(C)(C)C)cs2)c(O)c1 ZINC000877017282 1124998341 /nfs/dbraw/zinc/99/83/41/1124998341.db2.gz GGYOHFICBZMDDI-UHFFFAOYSA-N 1 0 290.432 3.744 20 10 CHCDRO COCCC1CC[NH+](Cc2c(O)ccc3ccccc32)CC1 ZINC000529638306 1125023898 /nfs/dbraw/zinc/02/38/98/1125023898.db2.gz PIWSUSLMQMBVTK-UHFFFAOYSA-N 1 0 299.414 3.794 20 10 CHCDRO CS[C@H]1C[C@H]([NH2+]Cc2ccc3ccccc3c2O)C1 ZINC000877700764 1125064690 /nfs/dbraw/zinc/06/46/90/1125064690.db2.gz VHZCDXRUPHTXJV-HDJSIYSDSA-N 1 0 273.401 3.529 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1Cc2[nH]c3ccccc3c2C1)c1ccccc1O ZINC000877755867 1125071538 /nfs/dbraw/zinc/07/15/38/1125071538.db2.gz PMTJIVYFMIKSRV-OLZOCXBDSA-N 1 0 292.382 3.692 20 10 CHCDRO CSCc1cnc(C[NH2+][C@H](C)c2ccccc2O)s1 ZINC000877755984 1125073240 /nfs/dbraw/zinc/07/32/40/1125073240.db2.gz WNBHDLILUBEIJS-SNVBAGLBSA-N 1 0 294.445 3.563 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc([C@H]2C[C@@H]2C)o1)c1ccccc1O ZINC000877756605 1125073834 /nfs/dbraw/zinc/07/38/34/1125073834.db2.gz XJIHRHBKAQPLPK-ZOWXZIJZSA-N 1 0 271.360 3.959 20 10 CHCDRO COc1ccc(C[C@@H](C)[NH2+][C@@H](C)c2ccccc2O)cc1 ZINC000877757120 1125074041 /nfs/dbraw/zinc/07/40/41/1125074041.db2.gz IADFUTDRGZYQCX-KGLIPLIRSA-N 1 0 285.387 3.683 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCC2)c1ccccc1O ZINC000877757364 1125074901 /nfs/dbraw/zinc/07/49/01/1125074901.db2.gz UAKXQIAOVMUNLY-ZDUSSCGKSA-N 1 0 267.372 3.732 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+][C@@H]1CC=CC[C@H]1C(F)(F)F ZINC000877760409 1125075219 /nfs/dbraw/zinc/07/52/19/1125075219.db2.gz GCCOMLMEPHCNDD-VXGBXAGGSA-N 1 0 289.272 3.518 20 10 CHCDRO CCc1cccc(F)c1C[NH2+][C@@H](C)c1ccccc1O ZINC000877758058 1125075295 /nfs/dbraw/zinc/07/52/95/1125075295.db2.gz HLQCISASLILKER-LBPRGKRZSA-N 1 0 273.351 3.945 20 10 CHCDRO Oc1c(C[NH2+]C[C@@H]2C[C@H]3CCC[C@@H]3O2)ccc2ccccc21 ZINC000877806530 1125082930 /nfs/dbraw/zinc/08/29/30/1125082930.db2.gz PDKHIBIFTDXDPF-HFTRVMKXSA-N 1 0 297.398 3.593 20 10 CHCDRO Cc1conc1C[N@H+](Cc1ccccc1O)C1CCCC1 ZINC000878102618 1125120952 /nfs/dbraw/zinc/12/09/52/1125120952.db2.gz ATZLKWJOSBCCMP-UHFFFAOYSA-N 1 0 286.375 3.633 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]CC[C@@H]2CCCC2(F)F)c1 ZINC000878361022 1125144491 /nfs/dbraw/zinc/14/44/91/1125144491.db2.gz VTMGHPYGWZCLCD-NEPJUHHUSA-N 1 0 299.361 3.877 20 10 CHCDRO COCC[C@H]([NH2+][C@H](C)c1ccccc1O)c1ccccc1 ZINC000879649006 1125222137 /nfs/dbraw/zinc/22/21/37/1125222137.db2.gz GYXBGOUWGRBJGA-PBHICJAKSA-N 1 0 285.387 3.821 20 10 CHCDRO COc1ccccc1CCC[NH2+][C@H](C)c1ccccc1O ZINC000879649179 1125222836 /nfs/dbraw/zinc/22/28/36/1125222836.db2.gz KYYFCVDNYPTVLH-CQSZACIVSA-N 1 0 285.387 3.684 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)Cc2cccn2C)cc1C(C)C ZINC000128303707 1125260160 /nfs/dbraw/zinc/26/01/60/1125260160.db2.gz UNJQASXQYSFGJL-UHFFFAOYSA-N 1 0 286.419 3.795 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccc(Cl)nc1 ZINC000760170168 1125285960 /nfs/dbraw/zinc/28/59/60/1125285960.db2.gz INWCJHIKSFEFIP-LLVKDONJSA-N 1 0 288.778 3.521 20 10 CHCDRO C[N@@H+](Cc1cc(Cl)ccc1O)CC1CCCC1 ZINC000211517532 1125307700 /nfs/dbraw/zinc/30/77/00/1125307700.db2.gz PZKCYLRRBXMLAJ-UHFFFAOYSA-N 1 0 253.773 3.668 20 10 CHCDRO CCOc1cccc(C[N@H+](CC)C[C@H](C)CC)c1O ZINC000211699655 1125321868 /nfs/dbraw/zinc/32/18/68/1125321868.db2.gz ORVSWKKKBWRQAH-CYBMUJFWSA-N 1 0 265.397 3.659 20 10 CHCDRO C[N@H+](Cc1ccc(N2CCCCC2)cc1)[C@@H]1CCSC1 ZINC000130497877 1125362596 /nfs/dbraw/zinc/36/25/96/1125362596.db2.gz OPEAPTLKVNFOOU-QGZVFWFLSA-N 1 0 290.476 3.614 20 10 CHCDRO CO[C@H]1C[C@H](C[NH2+]Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000883263208 1125387812 /nfs/dbraw/zinc/38/78/12/1125387812.db2.gz LQPOMYLLGBIRAT-PPUGGXLSSA-N 1 0 297.398 3.574 20 10 CHCDRO COC[C@H]1C[C@@H]([NH2+][C@H](C)c2ccc3ccccc3c2O)C1 ZINC000883319711 1125395566 /nfs/dbraw/zinc/39/55/66/1125395566.db2.gz MRDHPZFWTODTMF-NFAWXSAZSA-N 1 0 285.387 3.621 20 10 CHCDRO CCOCCC[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000131582474 1125398505 /nfs/dbraw/zinc/39/85/05/1125398505.db2.gz ZHKWCHKNVSKVQT-INIZCTEOSA-N 1 0 290.451 3.754 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@H]2CCC3(CCC3)O2)c(O)c1 ZINC000883357849 1125401495 /nfs/dbraw/zinc/40/14/95/1125401495.db2.gz WFKWOSWZGJCJEN-LSDHHAIUSA-N 1 0 289.419 3.761 20 10 CHCDRO COC[C@H](C)[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000131868683 1125410672 /nfs/dbraw/zinc/41/06/72/1125410672.db2.gz BGYAXMZDXUSCGH-KBPBESRZSA-N 1 0 294.414 3.502 20 10 CHCDRO C[C@H]([NH2+]CCCSc1nccs1)c1ccco1 ZINC000132253941 1125416973 /nfs/dbraw/zinc/41/69/73/1125416973.db2.gz CXKSSOAXNXMRIE-JTQLQIEISA-N 1 0 268.407 3.569 20 10 CHCDRO COc1ccc(O)c(C[N@H+](C)C2CCCCCC2)c1 ZINC000132356289 1125417811 /nfs/dbraw/zinc/41/78/11/1125417811.db2.gz CYBORROMLAEFRG-UHFFFAOYSA-N 1 0 263.381 3.555 20 10 CHCDRO Cc1cc(C[N@H+]2CC[C@@H](C)C(F)(F)CC2)ccc1N(C)C ZINC001139669863 1131356777 /nfs/dbraw/zinc/35/67/77/1131356777.db2.gz QKLXFEOAUOYKOV-CQSZACIVSA-N 1 0 296.405 3.928 20 10 CHCDRO C[C@H](Cc1cccs1)[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000295974599 1129220389 /nfs/dbraw/zinc/22/03/89/1129220389.db2.gz MVIULIGRMYTHOM-BXUZGUMPSA-N 1 0 273.401 3.662 20 10 CHCDRO COc1ccccc1[C@H](C)[NH2+][C@H]1CCc2cccc(O)c21 ZINC000296095490 1129221090 /nfs/dbraw/zinc/22/10/90/1129221090.db2.gz UCKQXESTYMORDI-WFASDCNBSA-N 1 0 283.371 3.739 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2C[C@@H](C)[C@@H]2c2ccccc2)c1 ZINC000245839685 1129227900 /nfs/dbraw/zinc/22/79/00/1129227900.db2.gz JLWOCYYTUWMFIG-FZKQIMNGSA-N 1 0 283.371 3.594 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(C)c(F)c2)c(O)c1 ZINC000184910163 1129261412 /nfs/dbraw/zinc/26/14/12/1129261412.db2.gz KDGWKPXRPNOHAQ-ZDUSSCGKSA-N 1 0 273.351 3.999 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1F)c1ccccc1O ZINC000037763987 1129267076 /nfs/dbraw/zinc/26/70/76/1129267076.db2.gz UFCAIHTZFSGTDN-NWDGAFQWSA-N 1 0 259.324 3.943 20 10 CHCDRO CCOCC(C)(C)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000379134017 1129285560 /nfs/dbraw/zinc/28/55/60/1129285560.db2.gz WOGPYJOFOFOTPI-UHFFFAOYSA-N 1 0 290.451 3.582 20 10 CHCDRO COc1cccc(C[NH2+]CC[C@@H]2CCCC[C@H]2C)c1O ZINC000734005018 1129290589 /nfs/dbraw/zinc/29/05/89/1129290589.db2.gz OCEPZALUVOODLN-KGLIPLIRSA-N 1 0 277.408 3.707 20 10 CHCDRO COc1ccc(C[NH2+]Cc2cccc(C)c2O)cc1Cl ZINC000718883318 1129296489 /nfs/dbraw/zinc/29/64/89/1129296489.db2.gz KJDIXTHGSDIHHP-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C(C)(C)c2cccs2)cc1 ZINC000735087069 1129330821 /nfs/dbraw/zinc/33/08/21/1129330821.db2.gz WBUDZXNEUGDRTB-UHFFFAOYSA-N 1 0 274.433 3.839 20 10 CHCDRO CS[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(N(C)C)c(F)c2)C1 ZINC000735324594 1129339176 /nfs/dbraw/zinc/33/91/76/1129339176.db2.gz UIBZPCQUMMMYTQ-ZIAGYGMSSA-N 1 0 296.455 3.656 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+][C@H]1CSc2ccccc21 ZINC000735508588 1129348817 /nfs/dbraw/zinc/34/88/17/1129348817.db2.gz GQGZCVNKZZSCDU-ZDUSSCGKSA-N 1 0 291.803 3.982 20 10 CHCDRO CC[C@@H](C)[C@H]1CCCC[N@@H+]1Cc1cc2c(cc1O)OCO2 ZINC000738056772 1129389543 /nfs/dbraw/zinc/38/95/43/1129389543.db2.gz QCDCZOYKQCPWRK-TZMCWYRMSA-N 1 0 291.391 3.522 20 10 CHCDRO Cc1cc(O)c(C[NH+]2CCc3ccccc3CC2)cc1C ZINC000738226035 1129390874 /nfs/dbraw/zinc/39/08/74/1129390874.db2.gz JBFHXPIMKVDSJF-UHFFFAOYSA-N 1 0 281.399 3.610 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCSC[C@H]2C)cc1C(C)C ZINC000738284018 1129392319 /nfs/dbraw/zinc/39/23/19/1129392319.db2.gz IMKKLVQPILPYGC-CYBMUJFWSA-N 1 0 279.449 3.761 20 10 CHCDRO CC[C@@H](COC)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000738438766 1129394245 /nfs/dbraw/zinc/39/42/45/1129394245.db2.gz CQZQHUSQGLRKJM-KRWDZBQOSA-N 1 0 285.387 3.574 20 10 CHCDRO CCO[C@@H]1C[C@@H]([NH2+][C@H](C)c2ccccc2O)C12CCCC2 ZINC000248388103 1129416098 /nfs/dbraw/zinc/41/60/98/1129416098.db2.gz QKQSUIJRXQZVQO-KBRIMQKVSA-N 1 0 289.419 3.781 20 10 CHCDRO CC[C@H](C)[C@@H](C)[N@H+](Cc1cccc(OC)c1O)C1CC1 ZINC000093132210 1129417858 /nfs/dbraw/zinc/41/78/58/1129417858.db2.gz DDCVSRMFIRZMLL-QWHCGFSZSA-N 1 0 277.408 3.800 20 10 CHCDRO CCCO[C@@H]1CCC[N@H+](Cc2cc(C)c(C)cc2O)CC1 ZINC000093317054 1129421369 /nfs/dbraw/zinc/42/13/69/1129421369.db2.gz NYMKFXDBXHUROR-QGZVFWFLSA-N 1 0 291.435 3.790 20 10 CHCDRO Cc1cccc([C@@H]2CCC[N@H+]2Cc2ccc(N(C)C)cc2)n1 ZINC000093444902 1129423455 /nfs/dbraw/zinc/42/34/55/1129423455.db2.gz VUHCAJOUOMSILH-IBGZPJMESA-N 1 0 295.430 3.793 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CC[C@H]1C(C)C ZINC000796769995 1129423916 /nfs/dbraw/zinc/42/39/16/1129423916.db2.gz AOGOGFYNGZQGLM-IRXDYDNUSA-N 1 0 260.425 3.585 20 10 CHCDRO C[C@H]([NH2+]CCSc1ccccc1)c1cc(F)ccc1O ZINC000094617725 1129448213 /nfs/dbraw/zinc/44/82/13/1129448213.db2.gz KTHIXBSIEUTIKP-LBPRGKRZSA-N 1 0 291.391 3.974 20 10 CHCDRO CCSCC[N@H+](Cc1ccccc1O)C1CCCC1 ZINC000741785546 1129452994 /nfs/dbraw/zinc/45/29/94/1129452994.db2.gz RJUCOBPZVHXVMY-UHFFFAOYSA-N 1 0 279.449 3.890 20 10 CHCDRO C[C@@H]1CCC[C@H](C)C[N@H+]1Cc1c(O)ccc2ccncc21 ZINC000742154177 1129468443 /nfs/dbraw/zinc/46/84/43/1129468443.db2.gz FBUNGRJJXAUDBA-UONOGXRCSA-N 1 0 284.403 3.951 20 10 CHCDRO CC[C@H](Cc1ccc(C)cc1)[NH2+]Cc1cccc(OC)c1O ZINC000742382774 1129473087 /nfs/dbraw/zinc/47/30/87/1129473087.db2.gz JMKNHQCURSCCTQ-QGZVFWFLSA-N 1 0 299.414 3.820 20 10 CHCDRO Cc1cc(O)c(C[NH2+]Cc2c(C)cccc2F)cc1C ZINC000742380362 1129473270 /nfs/dbraw/zinc/47/32/70/1129473270.db2.gz CUARLDFOGCGHSY-UHFFFAOYSA-N 1 0 273.351 3.746 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H](C)COc2ccccc2)cc1C ZINC000742369711 1129474430 /nfs/dbraw/zinc/47/44/30/1129474430.db2.gz OWIAXELLRJQIFE-OAHLLOKOSA-N 1 0 285.387 3.566 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCC[C@@H](C)C1 ZINC000742370951 1129474520 /nfs/dbraw/zinc/47/45/20/1129474520.db2.gz BFYPJDQGBSXDHC-CJNGLKHVSA-N 1 0 260.425 3.729 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H]2CCC[C@H](C3CC3)C2)c1 ZINC000742377079 1129475616 /nfs/dbraw/zinc/47/56/16/1129475616.db2.gz LVJOPXUXRAFKGX-HOCLYGCPSA-N 1 0 259.393 3.759 20 10 CHCDRO CC[C@@H]1C[N@H+](Cc2c(O)ccc3ccccc32)CCS1 ZINC000743396699 1129521724 /nfs/dbraw/zinc/52/17/24/1129521724.db2.gz BSKVFQFTCWYBHO-CQSZACIVSA-N 1 0 287.428 3.873 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)CCCSC)cc1 ZINC000743839316 1129538792 /nfs/dbraw/zinc/53/87/92/1129538792.db2.gz CUFSKRARBUYYQJ-UHFFFAOYSA-N 1 0 280.481 3.718 20 10 CHCDRO CCC[N@H+](Cc1cccc(N(C)C)c1)Cc1ccccc1O ZINC000743870297 1129542144 /nfs/dbraw/zinc/54/21/44/1129542144.db2.gz PADPOCBTNSCQRL-UHFFFAOYSA-N 1 0 298.430 3.870 20 10 CHCDRO C[C@@H]1CCC[C@H]([NH2+]Cc2ccc3c(c2)CCO3)[C@H]1C ZINC000252213445 1129559258 /nfs/dbraw/zinc/55/92/58/1129559258.db2.gz WZIZOVHYPNVVCX-WWGRRREGSA-N 1 0 259.393 3.536 20 10 CHCDRO CC[C@@H]1C[C@H](C)C[N@@H+]1Cc1cc2c(cc1O)CCC2 ZINC000744444602 1129577483 /nfs/dbraw/zinc/57/74/83/1129577483.db2.gz XQCDMCCTQKBEOF-BLLLJJGKSA-N 1 0 259.393 3.501 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2C[C@@H](OC(C)C)C2(C)C)c(O)c1 ZINC000766330130 1129602867 /nfs/dbraw/zinc/60/28/67/1129602867.db2.gz GXLLEPALNBYOGR-RRQGHBQHSA-N 1 0 291.435 3.943 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2C[C@@H](OC(C)C)C2(C)C)c1 ZINC000766331850 1129604349 /nfs/dbraw/zinc/60/43/49/1129604349.db2.gz NMZUKAUDONQMGH-RRQGHBQHSA-N 1 0 291.435 3.943 20 10 CHCDRO Cc1ccncc1C[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000746449883 1129665347 /nfs/dbraw/zinc/66/53/47/1129665347.db2.gz JNTIEPKXKJXNKG-UHFFFAOYSA-N 1 0 297.446 3.867 20 10 CHCDRO C[NH+]1CCN(c2ccc(C3=CCC(F)(F)CC3)cc2)CC1 ZINC001242233447 1129707242 /nfs/dbraw/zinc/70/72/42/1129707242.db2.gz DFJJAVXAJKKWDA-UHFFFAOYSA-N 1 0 292.373 3.641 20 10 CHCDRO C[C@H]([NH2+]C[C@@]1(C)CC1(Cl)Cl)c1ccccc1O ZINC000828655695 1131394570 /nfs/dbraw/zinc/39/45/70/1131394570.db2.gz GJTYXPGTSYWAQQ-JOYOIKCWSA-N 1 0 274.191 3.627 20 10 CHCDRO CC/C=C/CC[N@@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000767325851 1129786475 /nfs/dbraw/zinc/78/64/75/1129786475.db2.gz XYCLZMNLCPGVFO-REMYHPOOSA-N 1 0 289.419 3.730 20 10 CHCDRO CC1(C)CC[C@@H]1[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000380635721 1129832318 /nfs/dbraw/zinc/83/23/18/1129832318.db2.gz VDKNFZUSGMIYFU-KRWDZBQOSA-N 1 0 272.436 3.955 20 10 CHCDRO CC(C)=CCC[NH2+]Cc1cc(Br)ccc1O ZINC000381263665 1129836616 /nfs/dbraw/zinc/83/66/16/1129836616.db2.gz STIZWAJSTNMWKM-UHFFFAOYSA-N 1 0 284.197 3.601 20 10 CHCDRO C[C@H]([NH2+][C@H]1CC[C@H]1C)c1ccc(Br)cc1O ZINC000381327069 1129837115 /nfs/dbraw/zinc/83/71/15/1129837115.db2.gz RLBYDOWJDMBQOD-PTRXPTGYSA-N 1 0 284.197 3.604 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCC(F)(F)C2)c(O)c1 ZINC000381322873 1129837763 /nfs/dbraw/zinc/83/77/63/1129837763.db2.gz GLHXQOAXZUCJOW-GHMZBOCLSA-N 1 0 255.308 3.539 20 10 CHCDRO COc1cccc(C[N@H+](C)[C@@H]2CCCc3ccccc32)c1O ZINC000768193330 1129842254 /nfs/dbraw/zinc/84/22/54/1129842254.db2.gz KOUYEPAHYVFSQL-QGZVFWFLSA-N 1 0 297.398 3.910 20 10 CHCDRO COc1cccc(O)c1C[N@H+](C)[C@H]1CCCc2ccccc21 ZINC000768192861 1129842804 /nfs/dbraw/zinc/84/28/04/1129842804.db2.gz GBYFGFWHZLNCDH-KRWDZBQOSA-N 1 0 297.398 3.910 20 10 CHCDRO CCc1cccc(C[NH2+][C@@H](C)c2nc(C)cs2)c1O ZINC000691444589 1129846337 /nfs/dbraw/zinc/84/63/37/1129846337.db2.gz JQZZQJDTUKVITJ-NSHDSACASA-N 1 0 276.405 3.570 20 10 CHCDRO Cc1ncccc1C[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000768258873 1129846708 /nfs/dbraw/zinc/84/67/08/1129846708.db2.gz XYOXURMCIQIZHG-UHFFFAOYSA-N 1 0 295.430 3.621 20 10 CHCDRO CCOc1ccc(C[N@H+](C2CC2)C2CCCC2)c(O)c1 ZINC000768253067 1129846722 /nfs/dbraw/zinc/84/67/22/1129846722.db2.gz YFFLOAOPOREOMK-UHFFFAOYSA-N 1 0 275.392 3.698 20 10 CHCDRO CN(C)c1ccc(C[N@H+](Cc2ccoc2)C2CC2)cc1 ZINC000768258871 1129846765 /nfs/dbraw/zinc/84/67/65/1129846765.db2.gz XXAIBUWHWZEZPB-UHFFFAOYSA-N 1 0 270.376 3.510 20 10 CHCDRO Cc1ccc(O)c(C[NH+]2CCC(c3ccc(O)cc3)CC2)c1 ZINC000768235270 1129846882 /nfs/dbraw/zinc/84/68/82/1129846882.db2.gz ZWIGENYHKLTHOW-UHFFFAOYSA-N 1 0 297.398 3.786 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCSC[C@H]2c2ccccc2)c1 ZINC000768247538 1129846889 /nfs/dbraw/zinc/84/68/89/1129846889.db2.gz BMDKWBCIJKERLH-KRWDZBQOSA-N 1 0 299.439 3.991 20 10 CHCDRO CCC1CCC([N@H+](C)Cc2c(O)cccc2OC)CC1 ZINC000768263486 1129849276 /nfs/dbraw/zinc/84/92/76/1129849276.db2.gz RWPTVDLKOCRSHG-UHFFFAOYSA-N 1 0 277.408 3.801 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CCC[C@@H]2c2ccccn2)c(O)c1 ZINC000768353930 1129853884 /nfs/dbraw/zinc/85/38/84/1129853884.db2.gz CKGDMHJSKWMCHR-QGZVFWFLSA-N 1 0 298.386 3.523 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC[C@H](Cc3ccccc3)C2)c1 ZINC000768364653 1129854506 /nfs/dbraw/zinc/85/45/06/1129854506.db2.gz LWWFOIZRKGQWPU-QGZVFWFLSA-N 1 0 281.399 3.765 20 10 CHCDRO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C1CCCC1 ZINC000768425973 1129855859 /nfs/dbraw/zinc/85/58/59/1129855859.db2.gz XOGISUSWKWMILJ-UHFFFAOYSA-N 1 0 260.425 3.906 20 10 CHCDRO COc1cc(C[N@H+](C)Cc2ccccc2C)c(O)cc1C ZINC000768438345 1129856664 /nfs/dbraw/zinc/85/66/64/1129856664.db2.gz RKXOOOBBSLDSTI-UHFFFAOYSA-N 1 0 285.387 3.650 20 10 CHCDRO COc1cc(C[N@H+](C)[C@@H]2CCC[C@H](C)C2)c(O)cc1C ZINC000768442721 1129857931 /nfs/dbraw/zinc/85/79/31/1129857931.db2.gz ZJYVLOKHWMICPL-SWLSCSKDSA-N 1 0 277.408 3.720 20 10 CHCDRO CC(C)C[N@H+](Cc1cc(Cl)ccc1O)C1CC1 ZINC000768532505 1129860726 /nfs/dbraw/zinc/86/07/26/1129860726.db2.gz MAAGROHFMUZBJM-UHFFFAOYSA-N 1 0 253.773 3.666 20 10 CHCDRO C[C@]1(Cc2ccccc2)CCC[N@@H+]1Cc1ccccc1O ZINC000768534616 1129861090 /nfs/dbraw/zinc/86/10/90/1129861090.db2.gz GWVMHQPBYSMHBU-LJQANCHMSA-N 1 0 281.399 3.989 20 10 CHCDRO FC1(F)CCC[C@@H](C[NH2+]Cc2ccc3c(c2)CCO3)C1 ZINC000800278016 1129861869 /nfs/dbraw/zinc/86/18/69/1129861869.db2.gz YXEAPQXWOKWUPA-CYBMUJFWSA-N 1 0 281.346 3.537 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H]2Cc3ccc(Cl)cc3C2)c1 ZINC000800288534 1129865114 /nfs/dbraw/zinc/86/51/14/1129865114.db2.gz RNUUZIOZLWIIAQ-INIZCTEOSA-N 1 0 287.790 3.611 20 10 CHCDRO COc1cccc(C[N@@H+]2CC[C@H](C)[C@H]3CCCC[C@H]32)c1O ZINC000768848469 1129878375 /nfs/dbraw/zinc/87/83/75/1129878375.db2.gz CDKSJYFAYYXNLN-NUEKZKHPSA-N 1 0 289.419 3.801 20 10 CHCDRO C[C@@H]1c2ccccc2OCC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC000768930788 1129882552 /nfs/dbraw/zinc/88/25/52/1129882552.db2.gz PKDYKUPFTBTIKI-OAHLLOKOSA-N 1 0 296.414 3.708 20 10 CHCDRO C[C@H](CCC1CC1)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000768951387 1129885628 /nfs/dbraw/zinc/88/56/28/1129885628.db2.gz GKIOSZKKVFLFGA-GFCCVEGCSA-N 1 0 264.388 3.560 20 10 CHCDRO COc1cccc(C[N@@H+]2CC(C)(C)[C@H]2c2ccccc2)c1O ZINC000769085595 1129890748 /nfs/dbraw/zinc/89/07/48/1129890748.db2.gz KPHJHUZPIPNBNV-GOSISDBHSA-N 1 0 297.398 3.984 20 10 CHCDRO COc1cccc(O)c1C[N@@H+]1CC[C@H](c2ccccc2C)C1 ZINC000769234906 1129897260 /nfs/dbraw/zinc/89/72/60/1129897260.db2.gz YSBXMZNBCFHIEU-HNNXBMFYSA-N 1 0 297.398 3.699 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CCc3ccccc3[C@@H]2C)c(O)c1 ZINC000769349706 1129903425 /nfs/dbraw/zinc/90/34/25/1129903425.db2.gz DIAISQYTJXGGGL-AWEZNQCLSA-N 1 0 297.398 3.910 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CC[C@@H](c3cccc(F)c3)C2)cc1 ZINC000769341200 1129903907 /nfs/dbraw/zinc/90/39/07/1129903907.db2.gz ZQLIKAGXWRPYGN-QGZVFWFLSA-N 1 0 298.405 3.881 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCc3ccccc3[C@@H]2C)c1O ZINC000769353882 1129904377 /nfs/dbraw/zinc/90/43/77/1129904377.db2.gz VZBBOHDHIFZTFV-AWEZNQCLSA-N 1 0 297.398 3.910 20 10 CHCDRO CCS[C@@H]1CCCC[N@H+](Cc2c(O)cccc2OC)C1 ZINC000769403202 1129905930 /nfs/dbraw/zinc/90/59/30/1129905930.db2.gz GLVDMUUSJUVJIJ-CYBMUJFWSA-N 1 0 295.448 3.508 20 10 CHCDRO CCOc1ccc(C[N@@H+]2[C@H](C)C[C@@H]3CCCC[C@H]32)c(O)c1 ZINC000769403306 1129906758 /nfs/dbraw/zinc/90/67/58/1129906758.db2.gz BUHGTQJVKLJULG-JKIFEVAISA-N 1 0 289.419 3.944 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CC[C@@H]2Cc2ccccc2)c1 ZINC000769505692 1129914687 /nfs/dbraw/zinc/91/46/87/1129914687.db2.gz HMZIWMPEPWRLOW-QGZVFWFLSA-N 1 0 297.398 3.608 20 10 CHCDRO CCCC[N@H+](Cc1cccc(C)n1)Cc1ccccc1O ZINC000801596763 1129931700 /nfs/dbraw/zinc/93/17/00/1129931700.db2.gz NSUVWKPHFMTSIE-UHFFFAOYSA-N 1 0 284.403 3.898 20 10 CHCDRO COc1ccsc1[C@H](C)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000769969148 1129932901 /nfs/dbraw/zinc/93/29/01/1129932901.db2.gz PJMMBEVAVRWWCJ-NSHDSACASA-N 1 0 289.400 3.542 20 10 CHCDRO C[C@@H]1CC(CC[NH2+]Cc2c(O)cccc2Cl)C[C@@H](C)O1 ZINC000801731314 1129940562 /nfs/dbraw/zinc/94/05/62/1129940562.db2.gz XWNDHESKSKINEX-VXGBXAGGSA-N 1 0 297.826 3.729 20 10 CHCDRO C[C@@H]([N@H+](C)Cc1ccc(N(C)C)c(F)c1)C1(C)CC1 ZINC000770288238 1129943408 /nfs/dbraw/zinc/94/34/08/1129943408.db2.gz ICIWAIMEELLQOH-GFCCVEGCSA-N 1 0 264.388 3.512 20 10 CHCDRO Cc1ccccc1[C@H]1CC[N@H+](Cc2ccccc2O)C1 ZINC000770511071 1129948905 /nfs/dbraw/zinc/94/89/05/1129948905.db2.gz YNEAYWPJKHTKAJ-HNNXBMFYSA-N 1 0 267.372 3.690 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)c2cnccc2C)cc1C ZINC000770750309 1129958688 /nfs/dbraw/zinc/95/86/88/1129958688.db2.gz MQYJTLLHKWNDHI-CQSZACIVSA-N 1 0 270.376 3.558 20 10 CHCDRO C[C@@H]([NH2+]CCC1C[C@@H](C)O[C@H](C)C1)c1ccccc1O ZINC000802309699 1129991544 /nfs/dbraw/zinc/99/15/44/1129991544.db2.gz UERMYHJGAGWOSP-MGPQQGTHSA-N 1 0 277.408 3.637 20 10 CHCDRO CCC[N@@H+](Cc1ccc(N(C)C)c(F)c1)CC1CC1 ZINC000771924236 1129994813 /nfs/dbraw/zinc/99/48/13/1129994813.db2.gz GDNNWXAWIKXFFK-UHFFFAOYSA-N 1 0 264.388 3.514 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)Cc2ccccc2)cc1F ZINC000771929104 1129995142 /nfs/dbraw/zinc/99/51/42/1129995142.db2.gz SKTVOYPUKCCHEO-UHFFFAOYSA-N 1 0 272.367 3.524 20 10 CHCDRO Cc1cccc(C[N@@H+]2CC[C@@](F)(c3ccccc3)C2)c1O ZINC000802656054 1130027075 /nfs/dbraw/zinc/02/70/75/1130027075.db2.gz CGCKJMIIABZQBA-SFHVURJKSA-N 1 0 285.362 3.771 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC[C@@](F)(c3ccccc3)C2)c1 ZINC000802656924 1130027687 /nfs/dbraw/zinc/02/76/87/1130027687.db2.gz SCHOGRRXRALMTE-SFHVURJKSA-N 1 0 285.362 3.771 20 10 CHCDRO CC[C@@]1(C)C[N@H+](Cc2cc(C(C)C)c(C)cc2O)CCO1 ZINC000785512782 1130037524 /nfs/dbraw/zinc/03/75/24/1130037524.db2.gz UKTJXCXAJATXFN-SFHVURJKSA-N 1 0 291.435 3.825 20 10 CHCDRO CC1=CCC[C@H](C)[C@@H]1C[N@H+](C)Cc1ccccc1O ZINC000785978260 1130070896 /nfs/dbraw/zinc/07/08/96/1130070896.db2.gz SNTRQCPGVUVARL-GOEBONIOSA-N 1 0 259.393 3.816 20 10 CHCDRO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)CC1(C)CC1 ZINC000787091165 1130130740 /nfs/dbraw/zinc/13/07/40/1130130740.db2.gz QGNAOECVWARNLL-UHFFFAOYSA-N 1 0 260.425 3.763 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1O)c1ccc2c(c1)CCO2 ZINC000903238762 1130134121 /nfs/dbraw/zinc/13/41/21/1130134121.db2.gz WIVAXSWWDPXOAY-OLZOCXBDSA-N 1 0 283.371 3.739 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC(C)(C)C2CCOCC2)c(O)c1 ZINC000903244620 1130135260 /nfs/dbraw/zinc/13/52/60/1130135260.db2.gz ZYIVVOYFGURBAH-AWEZNQCLSA-N 1 0 291.435 3.804 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C2CC3(C2)CO[C@H](C)C3)c(O)c1C ZINC000903283112 1130146239 /nfs/dbraw/zinc/14/62/39/1130146239.db2.gz OJXSFPZPDMGBLQ-WOJHUINRSA-N 1 0 289.419 3.617 20 10 CHCDRO C[C@H]([NH2+][C@@H](c1ccccn1)C1CC1)c1cc(F)ccc1O ZINC000903335405 1130160753 /nfs/dbraw/zinc/16/07/53/1130160753.db2.gz OTKCLGUPCIYOIV-APPDUMDISA-N 1 0 286.350 3.728 20 10 CHCDRO Oc1cc2c(cc1C[N@@H+]1CC[C@H](c3ccccc3)C1)CCC2 ZINC000746716716 1130167483 /nfs/dbraw/zinc/16/74/83/1130167483.db2.gz RBBZUBYOGQWKAZ-SFHVURJKSA-N 1 0 293.410 3.870 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCOC23CCCC3)c(O)c1C ZINC000903383045 1130169064 /nfs/dbraw/zinc/16/90/64/1130169064.db2.gz LKCLRMCBUQGDAM-HOCLYGCPSA-N 1 0 289.419 3.761 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@H](c1ccncc1)C1CC1)CC2 ZINC000903427472 1130175972 /nfs/dbraw/zinc/17/59/72/1130175972.db2.gz GMCJOCAICSEJEC-YJBOKZPZSA-N 1 0 280.371 3.515 20 10 CHCDRO CCC(O)(CC)CC[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000788263567 1130179575 /nfs/dbraw/zinc/17/95/75/1130179575.db2.gz SOAMDSOEYCAJPE-NSHDSACASA-N 1 0 285.815 3.637 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCSC(C)(C)CC2)cc1C ZINC000788376227 1130184175 /nfs/dbraw/zinc/18/41/75/1130184175.db2.gz HPVJKCBTVPMPMC-UHFFFAOYSA-N 1 0 279.449 3.727 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2cccc(C)n2)c(O)c1 ZINC000788557958 1130194848 /nfs/dbraw/zinc/19/48/48/1130194848.db2.gz RUXCEYGDTFUKQS-CQSZACIVSA-N 1 0 270.376 3.563 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@](C)(O)CCC(C)C)c(O)c1 ZINC000788600881 1130197566 /nfs/dbraw/zinc/19/75/66/1130197566.db2.gz DVIRXJJRAITCPU-YJBOKZPZSA-N 1 0 293.451 3.847 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@H]2CCC(C)(C)O2)c(O)c1 ZINC000788765385 1130207092 /nfs/dbraw/zinc/20/70/92/1130207092.db2.gz NSZMQIBFOCLKIB-UONOGXRCSA-N 1 0 277.408 3.617 20 10 CHCDRO CCc1cccc(Cl)c1C[NH2+]Cc1ccccc1O ZINC000788959725 1130220401 /nfs/dbraw/zinc/22/04/01/1130220401.db2.gz ANMXDJYJPHTBGP-UHFFFAOYSA-N 1 0 275.779 3.898 20 10 CHCDRO C[C@@H](CC[N@H+](C)Cc1ccccc1O)OCc1ccccc1 ZINC000789348821 1130242902 /nfs/dbraw/zinc/24/29/02/1130242902.db2.gz REVBUVQUWVBABC-INIZCTEOSA-N 1 0 299.414 3.819 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCSC(C)(C)CC2)cc1F ZINC000789763387 1130274905 /nfs/dbraw/zinc/27/49/05/1130274905.db2.gz IQPYNHKQGQFRGG-UHFFFAOYSA-N 1 0 296.455 3.609 20 10 CHCDRO Cc1csc(C[N@@H+]2CCc3cccc(O)c3C2)c1Cl ZINC001137292592 1130306403 /nfs/dbraw/zinc/30/64/03/1130306403.db2.gz GXITXSNYWPVAMP-UHFFFAOYSA-N 1 0 293.819 3.974 20 10 CHCDRO C[C@@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ccc(N(C)C)cc1 ZINC000791580346 1130383627 /nfs/dbraw/zinc/38/36/27/1130383627.db2.gz ZZZDAFJNEJVSHX-RISCZKNCSA-N 1 0 286.341 3.525 20 10 CHCDRO Cc1cccc(C[NH2+]C[C@H]2CCC3(CCCCC3)O2)c1O ZINC000792193174 1130437040 /nfs/dbraw/zinc/43/70/40/1130437040.db2.gz TWBBWUQSGGBMFC-MRXNPFEDSA-N 1 0 289.419 3.672 20 10 CHCDRO CC[C@@H]1C[C@@H]([NH2+]Cc2cc3ccccc3cc2O)CCO1 ZINC001170183405 1130455206 /nfs/dbraw/zinc/45/52/06/1130455206.db2.gz RPTFBACVKUCCBC-DLBZAZTESA-N 1 0 285.387 3.593 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+]CC[C@]2(C)CC2(F)F)c1O ZINC000827251411 1130529774 /nfs/dbraw/zinc/52/97/74/1130529774.db2.gz HJTNRXTVJGBOET-CYBMUJFWSA-N 1 0 289.753 3.879 20 10 CHCDRO COc1ccc(C[NH2+]Cc2ccc(C)c(Cl)c2)c(O)c1 ZINC000793386000 1130551499 /nfs/dbraw/zinc/55/14/99/1130551499.db2.gz FXGJQFZKVSJOKR-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)CCc2ccsc2)c(O)c1 ZINC000793388463 1130552040 /nfs/dbraw/zinc/55/20/40/1130552040.db2.gz OMJOYJOFKPIEEV-GFCCVEGCSA-N 1 0 291.416 3.573 20 10 CHCDRO COc1cccc(C[NH2+]Cc2ccc(Cl)c(C)c2)c1O ZINC000758016103 1130593275 /nfs/dbraw/zinc/59/32/75/1130593275.db2.gz JSCGVTNWWZGDHC-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO CC[N@H+](Cc1cc(Cl)ccc1O)[C@@H]1CCOC(C)(C)C1 ZINC000811511448 1130618661 /nfs/dbraw/zinc/61/86/61/1130618661.db2.gz ISDOMZIYBCTLSX-CQSZACIVSA-N 1 0 297.826 3.825 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CC2(CCC2)[C@H]1C1CC1 ZINC000811513509 1130619817 /nfs/dbraw/zinc/61/98/17/1130619817.db2.gz JAUCRJYKJZOGGN-OAHLLOKOSA-N 1 0 277.795 3.810 20 10 CHCDRO CC(C)CC[C@@H](C)[N@@H+]1CCCc2cc(O)c(O)cc2C1 ZINC001256372160 1130651767 /nfs/dbraw/zinc/65/17/67/1130651767.db2.gz IHXPKZXDPGLQNU-CYBMUJFWSA-N 1 0 277.408 3.671 20 10 CHCDRO C[N@H+](Cc1cccc(-c2ccccc2)c1O)C1CCOCC1 ZINC001234992734 1130700274 /nfs/dbraw/zinc/70/02/74/1130700274.db2.gz QWTRWHAFMGESAJ-UHFFFAOYSA-N 1 0 297.398 3.670 20 10 CHCDRO Oc1c(C[NH+]2CC3(CSC3)C2)cccc1-c1ccccc1 ZINC001234998684 1130700632 /nfs/dbraw/zinc/70/06/32/1130700632.db2.gz MPRGZAVQNYVXHZ-UHFFFAOYSA-N 1 0 297.423 3.608 20 10 CHCDRO C[C@@H](Nc1cc2c(c[nH+]1)CCCC2)c1ccccc1O ZINC000812739200 1130710158 /nfs/dbraw/zinc/71/01/58/1130710158.db2.gz MXGWWJMIVHICLP-GFCCVEGCSA-N 1 0 268.360 3.839 20 10 CHCDRO CC[C@H]([NH2+]C[C@](C)(OC)C1CC1)c1cc(Cl)ccc1O ZINC000812735274 1130710354 /nfs/dbraw/zinc/71/03/54/1130710354.db2.gz ZFVPAQLPJGDAQP-HOCLYGCPSA-N 1 0 297.826 3.901 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H](C)c2ccc3c(c2)CCCO3)c1O ZINC000827962290 1130743448 /nfs/dbraw/zinc/74/34/48/1130743448.db2.gz IBFMZRVVNUVECD-AWEZNQCLSA-N 1 0 297.398 3.876 20 10 CHCDRO Cc1cc(Br)c([O-])c(C[NH2+]CCC2CCC2)c1 ZINC000781918397 1130746944 /nfs/dbraw/zinc/74/69/44/1130746944.db2.gz QAOBSWCYAORJTD-UHFFFAOYSA-N 1 0 298.224 3.743 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cccc3[nH]ccc32)c1 ZINC000813330967 1130760475 /nfs/dbraw/zinc/76/04/75/1130760475.db2.gz KJOJBAYNTPMCDH-LBPRGKRZSA-N 1 0 296.370 3.733 20 10 CHCDRO CC(C)(C)c1ccc(C[N@@H+]2CCCOC(C)(C)C2)c(O)c1 ZINC001235685573 1130768822 /nfs/dbraw/zinc/76/88/22/1130768822.db2.gz RARPFFUFWRTUBQ-UHFFFAOYSA-N 1 0 291.435 3.691 20 10 CHCDRO CC(C)(C)c1ccc(C[N@@H+]2CCC[C@@H](CF)C2)c(O)c1 ZINC001235684735 1130768948 /nfs/dbraw/zinc/76/89/48/1130768948.db2.gz IYQNOCCZFUYFRQ-ZDUSSCGKSA-N 1 0 279.399 3.871 20 10 CHCDRO CCOc1cc(C[N@H+](C)Cc2ccccc2O)ccc1F ZINC001235804876 1130781446 /nfs/dbraw/zinc/78/14/46/1130781446.db2.gz DYUHCWZHCDUEKN-UHFFFAOYSA-N 1 0 289.350 3.562 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C(C)(C)c2ccccc2F)cc1 ZINC000813792847 1130784807 /nfs/dbraw/zinc/78/48/07/1130784807.db2.gz XNRKQELKNFKVAI-UHFFFAOYSA-N 1 0 286.394 3.917 20 10 CHCDRO C[N@H+](CCCc1ccsc1)Cc1ccccc1O ZINC000782949842 1130792131 /nfs/dbraw/zinc/79/21/31/1130792131.db2.gz NYVDVMHUZAAVGB-UHFFFAOYSA-N 1 0 261.390 3.518 20 10 CHCDRO C[C@@H](COc1cccc(F)c1)[NH2+][C@@H](C)c1ccccc1O ZINC000783503529 1130831010 /nfs/dbraw/zinc/83/10/10/1130831010.db2.gz FKVLOGOWRSITBB-STQMWFEESA-N 1 0 289.350 3.649 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc([C@H]2C[C@@H]2C)o1)c1ccccc1O ZINC000783505783 1130831047 /nfs/dbraw/zinc/83/10/47/1130831047.db2.gz XJIHRHBKAQPLPK-HUBLWGQQSA-N 1 0 271.360 3.959 20 10 CHCDRO CCN(CC)[C@@H](C[NH2+][C@@H](C)c1ccccc1O)CC(C)C ZINC000783500520 1130831227 /nfs/dbraw/zinc/83/12/27/1130831227.db2.gz WOXDURGVLCKMOU-JKSUJKDBSA-N 1 0 292.467 3.799 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1O)[C@H]1Oc2ccccc2[C@@H]1C ZINC000783515986 1130832113 /nfs/dbraw/zinc/83/21/13/1130832113.db2.gz AHIPACQAKYBJRD-PJHJGJPPSA-N 1 0 297.398 3.996 20 10 CHCDRO CCC1(CC)[C@H]([NH2+][C@@H](C)c2ccccc2O)C[C@H]1OC ZINC000783518664 1130833778 /nfs/dbraw/zinc/83/37/78/1130833778.db2.gz NKBBZSUPYLATIM-APHBMKBZSA-N 1 0 277.408 3.637 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]C[C@H]1CCCCC(F)(F)C1 ZINC000814169203 1130838242 /nfs/dbraw/zinc/83/82/42/1130838242.db2.gz FEEDXJJPFCSHFU-NSHDSACASA-N 1 0 287.325 3.837 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CC3(CCC3)[C@H]2C(C)C)c1O ZINC000814170667 1130839154 /nfs/dbraw/zinc/83/91/54/1130839154.db2.gz BPJHJTDRJQFSIE-QGZVFWFLSA-N 1 0 289.419 3.801 20 10 CHCDRO Fc1cccc(C[NH2+]Cc2ccc(N3CCCCC3)cc2)n1 ZINC000747938327 1130868494 /nfs/dbraw/zinc/86/84/94/1130868494.db2.gz ORANFMJKXLFXLQ-UHFFFAOYSA-N 1 0 299.393 3.501 20 10 CHCDRO CCOc1cccc(C[NH2+]C2(C)CCC(F)(F)CC2)c1O ZINC000784621986 1130913056 /nfs/dbraw/zinc/91/30/56/1130913056.db2.gz RWQMCXZLXPQPKX-UHFFFAOYSA-N 1 0 299.361 3.849 20 10 CHCDRO CS[C@H](C[NH2+]Cc1ccc(N(C)C)cc1)C(C)(C)C ZINC000784626083 1130913885 /nfs/dbraw/zinc/91/38/85/1130913885.db2.gz NNEXBRMAUCTZJL-OAHLLOKOSA-N 1 0 280.481 3.620 20 10 CHCDRO COc1ccc(C[NH2+]C[C@H](SC)C(C)(C)C)cc1C ZINC000784626239 1130913990 /nfs/dbraw/zinc/91/39/90/1130913990.db2.gz PGUWAMYJRIZDHP-HNNXBMFYSA-N 1 0 281.465 3.871 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CC[C@@H]1C(C)C ZINC000796769994 1130929732 /nfs/dbraw/zinc/92/97/32/1130929732.db2.gz AOGOGFYNGZQGLM-IAGOWNOFSA-N 1 0 260.425 3.585 20 10 CHCDRO Cc1cc(C[N@@H+]2CCC[C@@H]2c2ccncc2)ccc1N(C)C ZINC000815077107 1130956683 /nfs/dbraw/zinc/95/66/83/1130956683.db2.gz YLMMDGQPDSGOHU-LJQANCHMSA-N 1 0 295.430 3.793 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CSC[C@H]1C)c1cc2c(cc1O)CCCC2 ZINC000797066662 1130958583 /nfs/dbraw/zinc/95/85/83/1130958583.db2.gz UIRDSXAKLJYBLE-BFQNTYOBSA-N 1 0 291.460 3.673 20 10 CHCDRO CC[N@H+](Cc1cc(Cl)cc(C)n1)Cc1ccccc1O ZINC001236648980 1130988822 /nfs/dbraw/zinc/98/88/22/1130988822.db2.gz XVIVBYFZRHQFOV-UHFFFAOYSA-N 1 0 290.794 3.771 20 10 CHCDRO CCC(CC)(CCO)C[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000815586011 1131003388 /nfs/dbraw/zinc/00/33/88/1131003388.db2.gz XMYFAXIDBDRKFY-OAHLLOKOSA-N 1 0 293.451 3.848 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CCNc2ccccc2)c(O)c1 ZINC000815587082 1131005133 /nfs/dbraw/zinc/00/51/33/1131005133.db2.gz YXDFWXDGVFUODG-HNNXBMFYSA-N 1 0 284.403 3.772 20 10 CHCDRO CCc1ccc(C[N@@H+]2CCC[C@H](C(F)(F)F)C2)c(O)c1 ZINC001236788377 1131006962 /nfs/dbraw/zinc/00/69/62/1131006962.db2.gz JSZUCBVZANIVNQ-ZDUSSCGKSA-N 1 0 287.325 3.729 20 10 CHCDRO CCc1ccc(C[N@@H+]2CC[C@H](C)C(F)(F)CC2)c(O)c1 ZINC001236784594 1131007717 /nfs/dbraw/zinc/00/77/17/1131007717.db2.gz XBIMFJHCTKZDIC-LBPRGKRZSA-N 1 0 283.362 3.822 20 10 CHCDRO COC(C)(C)[C@H](C)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000815570734 1131007719 /nfs/dbraw/zinc/00/77/19/1131007719.db2.gz LBWBLQXLUUYOMW-HNNXBMFYSA-N 1 0 290.451 3.580 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CC[C@H]3CCC[C@@H]3C2)c(Cl)c1 ZINC001236796642 1131009710 /nfs/dbraw/zinc/00/97/10/1131009710.db2.gz XIXYXZJCYXHDFI-VXGBXAGGSA-N 1 0 295.810 3.676 20 10 CHCDRO C[N@H+](Cc1ccccn1)Cc1cc(Cl)c(Cl)cc1[O-] ZINC001236794289 1131009989 /nfs/dbraw/zinc/00/99/89/1131009989.db2.gz RENCOJUAXPYLSU-UHFFFAOYSA-N 1 0 297.185 3.726 20 10 CHCDRO COc1cc(C)c(C[N@@H+]2CCC[C@@H](C)[C@@H](C)C2)c(O)c1 ZINC001236808421 1131010462 /nfs/dbraw/zinc/01/04/62/1131010462.db2.gz PHWPBLZZCYKVMW-OCCSQVGLSA-N 1 0 277.408 3.577 20 10 CHCDRO Cc1ccoc1C[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000815628979 1131012090 /nfs/dbraw/zinc/01/20/90/1131012090.db2.gz PKURZSQKVPVCFA-CYBMUJFWSA-N 1 0 259.349 3.761 20 10 CHCDRO CCCCC[N@H+](C)Cc1c(O)cc(OC)cc1Cl ZINC001236802257 1131012942 /nfs/dbraw/zinc/01/29/42/1131012942.db2.gz IJIAWBIGWKGSQS-UHFFFAOYSA-N 1 0 271.788 3.676 20 10 CHCDRO COc1cc(C)c(C[N@@H+]2CCCc3ccccc3C2)c(O)c1 ZINC001236812034 1131012960 /nfs/dbraw/zinc/01/29/60/1131012960.db2.gz YIASWGRKULCJKY-UHFFFAOYSA-N 1 0 297.398 3.658 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2cc[nH]c(=O)c2)c(O)c1C ZINC000815642450 1131013936 /nfs/dbraw/zinc/01/39/36/1131013936.db2.gz BQKUGEDVRYKAKV-OLZOCXBDSA-N 1 0 286.375 3.521 20 10 CHCDRO Oc1cc2ccccc2cc1C[N@@H+]1CC[C@H]2CCCO[C@H]2C1 ZINC001236828080 1131017218 /nfs/dbraw/zinc/01/72/18/1131017218.db2.gz ZSQDKUSRMUIAKK-KUHUBIRLSA-N 1 0 297.398 3.546 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1cc(Cl)cc(C)c1O)C(C)(C)O ZINC000815651725 1131018011 /nfs/dbraw/zinc/01/80/11/1131018011.db2.gz BIVDRHYQIRHYRX-MFKMUULPSA-N 1 0 285.815 3.554 20 10 CHCDRO Oc1cc2ccccc2cc1C[N@@H+]1CC[C@]2(C1)CCCOC2 ZINC001236832638 1131018814 /nfs/dbraw/zinc/01/88/14/1131018814.db2.gz JPVYHKGZDHRKOA-IBGZPJMESA-N 1 0 297.398 3.548 20 10 CHCDRO C[N@@H+](Cc1cc2ccccc2cc1O)C[C@@H]1CCCCO1 ZINC001236834576 1131019491 /nfs/dbraw/zinc/01/94/91/1131019491.db2.gz AGEHFLKODBENEZ-KRWDZBQOSA-N 1 0 285.387 3.546 20 10 CHCDRO Oc1cc2ccccc2cc1C[NH+]1CCC(CF)CC1 ZINC001236841618 1131021516 /nfs/dbraw/zinc/02/15/16/1131021516.db2.gz MEPAQQKADDTZHK-UHFFFAOYSA-N 1 0 273.351 3.727 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@H]2c2cccnc2)cc1C ZINC000798190482 1131028069 /nfs/dbraw/zinc/02/80/69/1131028069.db2.gz RPZMDQBOSNVNEO-QGZVFWFLSA-N 1 0 282.387 3.741 20 10 CHCDRO CC(C)c1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)c(O)c1 ZINC001237050000 1131039280 /nfs/dbraw/zinc/03/92/80/1131039280.db2.gz VJOMOGJUEMARRJ-OKILXGFUSA-N 1 0 261.409 3.994 20 10 CHCDRO CC(C)c1ccc(C[NH+]2CCC(C)(F)CC2)c(O)c1 ZINC001237046724 1131039468 /nfs/dbraw/zinc/03/94/68/1131039468.db2.gz WMRZQTSJZKORKR-UHFFFAOYSA-N 1 0 265.372 3.840 20 10 CHCDRO CC(C)c1ccc(C[NH+]2CCC3(CCOC3)CC2)c(O)c1 ZINC001237046944 1131040771 /nfs/dbraw/zinc/04/07/71/1131040771.db2.gz XHASJISHMJWALS-UHFFFAOYSA-N 1 0 289.419 3.518 20 10 CHCDRO CC(C)c1ccc(C[N@H+]2C[C@@H]3[C@H](C2)C3(C)C)c(O)c1 ZINC001237049955 1131040966 /nfs/dbraw/zinc/04/09/66/1131040966.db2.gz UWKZSINHJZQQPM-GASCZTMLSA-N 1 0 259.393 3.603 20 10 CHCDRO CC(C)c1ccc(C[N@@H+]2CCC[C@@H](C(F)F)C2)c(O)c1 ZINC001237050108 1131041125 /nfs/dbraw/zinc/04/11/25/1131041125.db2.gz YHAGSYULIPBAHT-CQSZACIVSA-N 1 0 283.362 3.993 20 10 CHCDRO CC(C)c1ccc(C[N@@H+]2CCn3cccc3[C@@H]2C)c(O)c1 ZINC001237049505 1131041673 /nfs/dbraw/zinc/04/16/73/1131041673.db2.gz QHNSHZYEWZQBJE-AWEZNQCLSA-N 1 0 284.403 3.894 20 10 CHCDRO C[C@@H]1CCCC[N@@H+]1Cc1c(O)ccc(F)c1Cl ZINC001237119879 1131052379 /nfs/dbraw/zinc/05/23/79/1131052379.db2.gz HCVDLLSUFFSDMA-SECBINFHSA-N 1 0 257.736 3.559 20 10 CHCDRO CCC1CC[NH+](Cc2c(O)ccc(F)c2Cl)CC1 ZINC001237119270 1131053361 /nfs/dbraw/zinc/05/33/61/1131053361.db2.gz CPTUPMDFIALKPM-UHFFFAOYSA-N 1 0 271.763 3.807 20 10 CHCDRO CSC1CC[NH+](Cc2c(O)ccc(F)c2Cl)CC1 ZINC001237126701 1131055794 /nfs/dbraw/zinc/05/57/94/1131055794.db2.gz POCXZFDVWPWPRA-UHFFFAOYSA-N 1 0 289.803 3.512 20 10 CHCDRO Oc1ccc(C(F)(F)F)cc1C[NH+]1C[C@@H]2CCC[C@H]2C1 ZINC001237138275 1131055869 /nfs/dbraw/zinc/05/58/69/1131055869.db2.gz WMTCGCOYPLAILY-QWRGUYRKSA-N 1 0 285.309 3.643 20 10 CHCDRO Oc1c(C[NH+]2CCCCCC2)ccc2ccccc21 ZINC000816480751 1131097971 /nfs/dbraw/zinc/09/79/71/1131097971.db2.gz VUKXHLWBJISQHZ-UHFFFAOYSA-N 1 0 255.361 3.921 20 10 CHCDRO CC[C@H]1CO[C@H](C)C[N@@H+]1Cc1ccc2ccccc2c1O ZINC000816480987 1131098871 /nfs/dbraw/zinc/09/88/71/1131098871.db2.gz DIEQCCLEXRYXLF-CJNGLKHVSA-N 1 0 285.387 3.545 20 10 CHCDRO C[C@@H]1C[NH+](Cc2ccc3ccccc3c2O)C[C@@H](C)S1 ZINC000816497609 1131101967 /nfs/dbraw/zinc/10/19/67/1131101967.db2.gz KFCHVGUVCKELTR-CHWSQXEVSA-N 1 0 287.428 3.871 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+]1CC[C@H]2CCCC[C@H]2C1 ZINC001237488420 1131103459 /nfs/dbraw/zinc/10/34/59/1131103459.db2.gz XEKDFCDBZCNCBE-CABCVRRESA-N 1 0 259.393 3.713 20 10 CHCDRO CC[N@H+](Cc1cccc(OC)c1)Cc1c(C)cccc1O ZINC001237486805 1131103519 /nfs/dbraw/zinc/10/35/19/1131103519.db2.gz CKJFJXKAXJZQFE-UHFFFAOYSA-N 1 0 285.387 3.731 20 10 CHCDRO CC[N@@H+](Cc1ccc2ccccc2c1O)CC1CC1 ZINC000816510315 1131103591 /nfs/dbraw/zinc/10/35/91/1131103591.db2.gz RRIOCUFTHHYLRV-UHFFFAOYSA-N 1 0 255.361 3.777 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+]1CC[C@H](c2ccccc2)C1 ZINC001237484326 1131104027 /nfs/dbraw/zinc/10/40/27/1131104027.db2.gz BOIGRVICZYHWAY-INIZCTEOSA-N 1 0 267.372 3.690 20 10 CHCDRO Cc1cccc(O)c1C[NH+]1CCC(c2ccc(O)cc2)CC1 ZINC001237489610 1131104945 /nfs/dbraw/zinc/10/49/45/1131104945.db2.gz CFHWXYAJILBCOM-UHFFFAOYSA-N 1 0 297.398 3.786 20 10 CHCDRO COc1cccc([C@@H]2CC[N@H+](Cc3c(C)cccc3O)C2)c1 ZINC001237490804 1131105136 /nfs/dbraw/zinc/10/51/36/1131105136.db2.gz BKUSCABGFWOIDS-MRXNPFEDSA-N 1 0 297.398 3.699 20 10 CHCDRO Oc1c(C[NH2+]C2CCSCC2)ccc2ccccc21 ZINC000816548656 1131106781 /nfs/dbraw/zinc/10/67/81/1131106781.db2.gz OFLKAPXJOGYPPQ-UHFFFAOYSA-N 1 0 273.401 3.531 20 10 CHCDRO Oc1ccccc1C[NH2+]Cc1ccc2ccccc2c1O ZINC000816545627 1131107195 /nfs/dbraw/zinc/10/71/95/1131107195.db2.gz YMTRCUGGCVTELY-UHFFFAOYSA-N 1 0 279.339 3.541 20 10 CHCDRO CCN1CCCC[C@@H]1C[NH2+]Cc1ccc2ccccc2c1O ZINC000816550223 1131107308 /nfs/dbraw/zinc/10/73/08/1131107308.db2.gz LOMFMCCSAPTWHS-QGZVFWFLSA-N 1 0 298.430 3.509 20 10 CHCDRO Oc1c(C[NH2+]CCc2ccccc2)ccc2ccccc21 ZINC000816529078 1131108479 /nfs/dbraw/zinc/10/84/79/1131108479.db2.gz FVSXMHQXVMXZDC-UHFFFAOYSA-N 1 0 277.367 3.878 20 10 CHCDRO Cc1nc(C[NH2+]Cc2ccc3ccccc3c2O)sc1C ZINC000816554037 1131110009 /nfs/dbraw/zinc/11/00/09/1131110009.db2.gz NGWIGVHLYCHZIX-UHFFFAOYSA-N 1 0 298.411 3.909 20 10 CHCDRO CC1(C)C[C@H]([NH2+]Cc2ccc3ccccc3c2O)CCO1 ZINC000816558526 1131110893 /nfs/dbraw/zinc/11/08/93/1131110893.db2.gz BYWGZTYOSSGZRB-OAHLLOKOSA-N 1 0 285.387 3.593 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2ccc3ccccc3c2O)C[C@H]1F ZINC000816565053 1131111151 /nfs/dbraw/zinc/11/11/51/1131111151.db2.gz ZQNRBKWTCXKFAG-MLGOLLRUSA-N 1 0 273.351 3.725 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2ccc3ccccc3c2O)C[C@@H]1F ZINC000816565054 1131111752 /nfs/dbraw/zinc/11/17/52/1131111752.db2.gz ZQNRBKWTCXKFAG-WBMJQRKESA-N 1 0 273.351 3.725 20 10 CHCDRO C[C@@H]1C[C@@H](CC[NH2+]Cc2ccc3ccccc3c2O)CCO1 ZINC000816567897 1131113264 /nfs/dbraw/zinc/11/32/64/1131113264.db2.gz OYRHTGDIEDLCFY-CABCVRRESA-N 1 0 299.414 3.840 20 10 CHCDRO C[C@H](C[NH2+]Cc1ccc2ccccc2c1O)c1nccs1 ZINC000816569469 1131113366 /nfs/dbraw/zinc/11/33/66/1131113366.db2.gz MYFPQDYLKXKHBB-GFCCVEGCSA-N 1 0 298.411 3.895 20 10 CHCDRO CC1=CCC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816598407 1131114945 /nfs/dbraw/zinc/11/49/45/1131114945.db2.gz AOWXGHYDUPYULL-UHFFFAOYSA-N 1 0 253.345 3.697 20 10 CHCDRO CCC[C@]1(CO)CC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816613158 1131115785 /nfs/dbraw/zinc/11/57/85/1131115785.db2.gz LAJRTPFIPCDPLG-IBGZPJMESA-N 1 0 299.414 3.530 20 10 CHCDRO Oc1ccc(-c2ccc(F)cc2)cc1C[NH+]1CCCC1 ZINC001237641722 1131123833 /nfs/dbraw/zinc/12/38/33/1131123833.db2.gz WHBHTAFJDGPNLP-UHFFFAOYSA-N 1 0 271.335 3.794 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2CC[C@H](C(F)(F)F)C2)c1O ZINC001237685478 1131126920 /nfs/dbraw/zinc/12/69/20/1131126920.db2.gz DAYLICVPQPWCBO-JTQLQIEISA-N 1 0 293.716 3.738 20 10 CHCDRO CCCOC1CC[NH+](Cc2cc(Cl)cc(C)c2O)CC1 ZINC001237686243 1131127332 /nfs/dbraw/zinc/12/73/32/1131127332.db2.gz HCQXQMZFJBYFAR-UHFFFAOYSA-N 1 0 297.826 3.745 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CC12CCSCC2)c1ccccc1O ZINC000817411366 1131160684 /nfs/dbraw/zinc/16/06/84/1131160684.db2.gz QMKHAAAPJBQRQB-ZFWWWQNUSA-N 1 0 291.460 3.966 20 10 CHCDRO Cc1cc(F)cc(C[N@H+](C)Cc2ccc(F)cc2)c1O ZINC001238057811 1131164664 /nfs/dbraw/zinc/16/46/64/1131164664.db2.gz NSYJLQIHBFLGFJ-UHFFFAOYSA-N 1 0 277.314 3.611 20 10 CHCDRO Cc1cccc2c1C[N@H+](Cc1cc(F)cc(C)c1O)C2 ZINC001238058414 1131165392 /nfs/dbraw/zinc/16/53/92/1131165392.db2.gz RTIMNIDCQPHNEY-UHFFFAOYSA-N 1 0 271.335 3.664 20 10 CHCDRO CCCC1CC[NH+](Cc2cc(F)cc(C)c2O)CC1 ZINC001238061954 1131167136 /nfs/dbraw/zinc/16/71/36/1131167136.db2.gz MSSQNGJJMLXDFH-UHFFFAOYSA-N 1 0 265.372 3.852 20 10 CHCDRO CC[N@H+](Cc1cccs1)Cc1cc(F)cc(C)c1O ZINC001238066702 1131167156 /nfs/dbraw/zinc/16/71/56/1131167156.db2.gz JDPJYLHXZQXVSZ-UHFFFAOYSA-N 1 0 279.380 3.923 20 10 CHCDRO Cc1cc(F)cc(C[N@@H+]2CCC[C@H]3CCCC[C@@H]32)c1O ZINC001238062394 1131167206 /nfs/dbraw/zinc/16/72/06/1131167206.db2.gz PNONNUMUZBVPTL-CJNGLKHVSA-N 1 0 277.383 3.994 20 10 CHCDRO Cc1cc(F)cc(C[N@@H+]2CC[C@H]2c2ccccc2)c1O ZINC001238071029 1131168052 /nfs/dbraw/zinc/16/80/52/1131168052.db2.gz QYYNJUWFHATRGQ-INIZCTEOSA-N 1 0 271.335 3.787 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccncc1Cl ZINC000817576725 1131171644 /nfs/dbraw/zinc/17/16/44/1131171644.db2.gz VRVGVPZWAUKLFO-LBPRGKRZSA-N 1 0 289.810 3.652 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccc(N)cc1)c1ccc(N(C)C)cc1 ZINC000817955979 1131190072 /nfs/dbraw/zinc/19/00/72/1131190072.db2.gz MREPJWCGNNHNHV-LJQANCHMSA-N 1 0 297.446 3.618 20 10 CHCDRO Cc1cc(C)cc([C@H](C)[NH2+]CCc2ccc(N)cc2)c1 ZINC000817955744 1131190225 /nfs/dbraw/zinc/19/02/25/1131190225.db2.gz GSTOVLMLVHEIGY-HNNXBMFYSA-N 1 0 268.404 3.779 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccc(N)cc1)c1ccc(N(C)C)cc1 ZINC000817955978 1131190404 /nfs/dbraw/zinc/19/04/04/1131190404.db2.gz MREPJWCGNNHNHV-IBGZPJMESA-N 1 0 297.446 3.618 20 10 CHCDRO Nc1ccc(CC[NH2+][C@H]2CCc3ccc(Cl)cc32)cc1 ZINC000817955490 1131190509 /nfs/dbraw/zinc/19/05/09/1131190509.db2.gz CBFMIJLQQBOHKL-KRWDZBQOSA-N 1 0 286.806 3.742 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccc(N)cc1)c1ccccc1 ZINC000817955726 1131190704 /nfs/dbraw/zinc/19/07/04/1131190704.db2.gz GFRHBLNIMPTWGF-QGZVFWFLSA-N 1 0 254.377 3.552 20 10 CHCDRO Nc1ccc(CC[NH2+][C@@H]2CCCc3cc(F)ccc32)cc1 ZINC000817957693 1131191446 /nfs/dbraw/zinc/19/14/46/1131191446.db2.gz OGVTUBPKPKVGBW-GOSISDBHSA-N 1 0 284.378 3.618 20 10 CHCDRO Nc1ccc(CC[NH2+][C@H]2CCCc3cc(F)ccc32)cc1 ZINC000817957695 1131191669 /nfs/dbraw/zinc/19/16/69/1131191669.db2.gz OGVTUBPKPKVGBW-SFHVURJKSA-N 1 0 284.378 3.618 20 10 CHCDRO Cc1ccc([C@@H](C)NCC[NH2+]C2CCCCCC2)c(O)c1 ZINC000817959353 1131192574 /nfs/dbraw/zinc/19/25/74/1131192574.db2.gz BTFVTWNUMMDHIL-OAHLLOKOSA-N 1 0 290.451 3.664 20 10 CHCDRO C[C@@H]([NH2+]Cc1cccc2c1CCCN2)c1ccccc1O ZINC000817975929 1131193795 /nfs/dbraw/zinc/19/37/95/1131193795.db2.gz QWIUFNXQOOEQHC-CYBMUJFWSA-N 1 0 282.387 3.601 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)CCCC[NH3+])c1cccc(Cl)c1[O-] ZINC000817975787 1131194357 /nfs/dbraw/zinc/19/43/57/1131194357.db2.gz BNSRCXRDPLCGTO-RISCZKNCSA-N 1 0 284.831 3.604 20 10 CHCDRO Cc1cc(N)cc(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)c1 ZINC000817981757 1131194808 /nfs/dbraw/zinc/19/48/08/1131194808.db2.gz UVADKZPBLYQRKA-AWEZNQCLSA-N 1 0 284.403 3.750 20 10 CHCDRO Cc1cc(N)cc(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)c1 ZINC000817981760 1131195256 /nfs/dbraw/zinc/19/52/56/1131195256.db2.gz UVADKZPBLYQRKA-CQSZACIVSA-N 1 0 284.403 3.750 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]Cc1ccc3c(c1)CCCN3)CC2 ZINC000817978154 1131195678 /nfs/dbraw/zinc/19/56/78/1131195678.db2.gz XJDPPTGSZNWZLH-QGZVFWFLSA-N 1 0 294.398 3.527 20 10 CHCDRO COc1ccc(N2CC[C@H](C[NH2+][C@@H](C)CC(C)C)C2)cc1 ZINC000818220087 1131205039 /nfs/dbraw/zinc/20/50/39/1131205039.db2.gz IXACIJBNHPOLSU-JKSUJKDBSA-N 1 0 290.451 3.546 20 10 CHCDRO Oc1ccccc1C[NH2+][C@H]1CCc2cccc(Cl)c2C1 ZINC001170893784 1131206830 /nfs/dbraw/zinc/20/68/30/1131206830.db2.gz NNAPSFQPUYUENX-AWEZNQCLSA-N 1 0 287.790 3.693 20 10 CHCDRO CCC[C@H](CC)[NH2+]C[C@@H]1CCN(c2ccc(OC)cc2)C1 ZINC000818341565 1131209600 /nfs/dbraw/zinc/20/96/00/1131209600.db2.gz ARWDCADKUCOIML-HOTGVXAUSA-N 1 0 290.451 3.690 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCN(c2ccc(OC)cc2)C1)C(C)C ZINC000818345427 1131209734 /nfs/dbraw/zinc/20/97/34/1131209734.db2.gz UOVYLWLZBFIJBA-QAPCUYQASA-N 1 0 290.451 3.546 20 10 CHCDRO COC[C@H]1CC[N@H+](Cc2cc(C)n(-c3ccccc3)c2C)C1 ZINC001137854419 1131424221 /nfs/dbraw/zinc/42/42/21/1131424221.db2.gz VNOKKPSVIVPMQO-KRWDZBQOSA-N 1 0 298.430 3.562 20 10 CHCDRO CC[C@@H]1C[C@@H]([NH2+]Cc2ccc(N(CC)CC)cc2)CCO1 ZINC000823671940 1131436706 /nfs/dbraw/zinc/43/67/06/1131436706.db2.gz YGZAHGIYLQQDNZ-FUHWJXTLSA-N 1 0 290.451 3.580 20 10 CHCDRO COc1cc(C)ccc1C[NH2+]Cc1ccc(N(C)C)cc1C ZINC000823850358 1131444408 /nfs/dbraw/zinc/44/44/08/1131444408.db2.gz AAEXZJDBYDHEKY-UHFFFAOYSA-N 1 0 298.430 3.668 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1cccc(C)c1F ZINC000823850444 1131444568 /nfs/dbraw/zinc/44/45/68/1131444568.db2.gz CXYKXQAGJULGGB-UHFFFAOYSA-N 1 0 286.394 3.798 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C[C@@H]2CSc3ccccc32)cc1 ZINC000824482937 1131470265 /nfs/dbraw/zinc/47/02/65/1131470265.db2.gz FCFPOTQQEKXZQS-OAHLLOKOSA-N 1 0 298.455 3.732 20 10 CHCDRO Oc1ccccc1C[NH2+][C@H]1CCCc2c(F)cccc21 ZINC000824468053 1131471399 /nfs/dbraw/zinc/47/13/99/1131471399.db2.gz BENPETWMHNXAGU-INIZCTEOSA-N 1 0 271.335 3.699 20 10 CHCDRO CC[C@@H](C)[C@H](C[NH2+]Cc1ccc2ccccc2c1O)OC ZINC000824597662 1131476359 /nfs/dbraw/zinc/47/63/59/1131476359.db2.gz WEWVXVCKGXWSAG-DYVFJYSZSA-N 1 0 287.403 3.696 20 10 CHCDRO FC1CC[NH+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC001138215676 1131477981 /nfs/dbraw/zinc/47/79/81/1131477981.db2.gz ODSDPQAVPWHZQU-UHFFFAOYSA-N 1 0 276.399 3.611 20 10 CHCDRO FC[C@H]1CCC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC001138219528 1131478677 /nfs/dbraw/zinc/47/86/77/1131478677.db2.gz FSJZHPXIRRBIDM-QGZVFWFLSA-N 1 0 290.426 3.858 20 10 CHCDRO Cc1cccc(C[N@H+]2CC[C@@H](C(F)(F)F)C[C@H]2C)c1O ZINC000824714726 1131481076 /nfs/dbraw/zinc/48/10/76/1131481076.db2.gz FGGQWGCJNZODJY-DGCLKSJQSA-N 1 0 287.325 3.863 20 10 CHCDRO C[C@@]1(C[NH2+]Cc2cc(Cl)ccc2O)CC1(Cl)Cl ZINC000824765127 1131482380 /nfs/dbraw/zinc/48/23/80/1131482380.db2.gz HULDGWOJILGNOY-NSHDSACASA-N 1 0 294.609 3.719 20 10 CHCDRO CN1CCCc2cc(C[N@@H+]3CCCC[C@@](C)(F)C3)ccc21 ZINC001138354671 1131493620 /nfs/dbraw/zinc/49/36/20/1131493620.db2.gz POFCKUFIKLUOQS-GOSISDBHSA-N 1 0 290.426 3.783 20 10 CHCDRO CN1CCCc2cc(C[N@@H+]3CCC[C@@H]4CCC[C@H]43)ccc21 ZINC001138355738 1131494221 /nfs/dbraw/zinc/49/42/21/1131494221.db2.gz BDCPTXRWNAKFBF-QFBILLFUSA-N 1 0 284.447 3.834 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CCCC(F)(F)F)cc1Cl ZINC000825310625 1131508462 /nfs/dbraw/zinc/50/84/62/1131508462.db2.gz ZNGGDFSTQRWDQM-UHFFFAOYSA-N 1 0 281.705 3.786 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CC[C@H]2CCO[C@@H](C)C2)cc1Cl ZINC000825497236 1131512905 /nfs/dbraw/zinc/51/29/05/1131512905.db2.gz DWGOMZGQGUYSCP-STQMWFEESA-N 1 0 297.826 3.649 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@H](C)c2nccs2)cc1Cl ZINC000825509948 1131514249 /nfs/dbraw/zinc/51/42/49/1131514249.db2.gz SRVAZSAYXJFCLN-JTQLQIEISA-N 1 0 296.823 3.704 20 10 CHCDRO C[C@@H]([NH2+]CC[C@H]1CCc2ccccc2N1)c1ccccc1O ZINC000844924557 1131608404 /nfs/dbraw/zinc/60/84/04/1131608404.db2.gz LXAIIQXBMWQGMY-GDBMZVCRSA-N 1 0 296.414 3.860 20 10 CHCDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]CCc1ccco1 ZINC000035661584 1131608930 /nfs/dbraw/zinc/60/89/30/1131608930.db2.gz BJXVTXCKXGPNIA-GXTWGEPZSA-N 1 0 271.360 3.674 20 10 CHCDRO CCc1cccc(C[N@H+](C)Cc2ccc(N(C)C)cc2)c1 ZINC001144326540 1131618218 /nfs/dbraw/zinc/61/82/18/1131618218.db2.gz FARNUCSEFZGBQR-UHFFFAOYSA-N 1 0 282.431 3.947 20 10 CHCDRO Cc1cc(C[N@@H+]2CC[C@H]3CCC[C@@H]3C2)ccc1N(C)C ZINC001139671507 1131626604 /nfs/dbraw/zinc/62/66/04/1131626604.db2.gz XDKOWSAJNPVEBH-IAGOWNOFSA-N 1 0 272.436 3.683 20 10 CHCDRO Cc1cc(C[NH+]2CCc3ccccc3CC2)ccc1N(C)C ZINC001139672165 1131627103 /nfs/dbraw/zinc/62/71/03/1131627103.db2.gz UISGCRLBKVMVPK-UHFFFAOYSA-N 1 0 294.442 3.662 20 10 CHCDRO COc1ccc2c(c1)CC[N@@H+](Cc1c(C)ccc(C)c1O)C2 ZINC001140178370 1131673246 /nfs/dbraw/zinc/67/32/46/1131673246.db2.gz JTSUFICBFIGEPO-UHFFFAOYSA-N 1 0 297.398 3.576 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCO[C@H](c3ccccc3)C2)c1O ZINC001140181657 1131673270 /nfs/dbraw/zinc/67/32/70/1131673270.db2.gz DVILAVAMDADMRB-SFHVURJKSA-N 1 0 297.398 3.583 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)C2CCSCC2)c1 ZINC000845972762 1131673518 /nfs/dbraw/zinc/67/35/18/1131673518.db2.gz UCXDCZULFYURFC-NWDGAFQWSA-N 1 0 295.448 3.583 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2CC=C(C)CC2)c1 ZINC000845973084 1131674599 /nfs/dbraw/zinc/67/45/99/1131674599.db2.gz WVUYISUIVBIQNV-STQMWFEESA-N 1 0 261.365 3.550 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CC[C@H]2c2ccccc2)c1O ZINC001140182703 1131674577 /nfs/dbraw/zinc/67/45/77/1131674577.db2.gz XRRJAXYUNGMBDX-KRWDZBQOSA-N 1 0 267.372 3.956 20 10 CHCDRO Cc1cc(O)c(C[NH2+]Cc2cc(Cl)ccc2O)cc1C ZINC000846059178 1131680501 /nfs/dbraw/zinc/68/05/01/1131680501.db2.gz ZTVHHPIFZNMGHN-UHFFFAOYSA-N 1 0 291.778 3.658 20 10 CHCDRO C[C@@]1(CC[NH2+]Cc2c(O)cccc2Cl)C[C@@]1(F)Cl ZINC000846040648 1131683264 /nfs/dbraw/zinc/68/32/64/1131683264.db2.gz XPPWBKNUBHGGIK-OLZOCXBDSA-N 1 0 292.181 3.840 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]C[C@H]1CCc3ccccc31)CC2 ZINC000834578535 1131684847 /nfs/dbraw/zinc/68/48/47/1131684847.db2.gz UCXVYKPBYHLKJV-NVXWUHKLSA-N 1 0 279.383 3.699 20 10 CHCDRO CC(C)[C@H]1C[C@H]([NH2+]Cc2cc(Cl)ccc2O)CS1 ZINC000846054482 1131685148 /nfs/dbraw/zinc/68/51/48/1131685148.db2.gz BZEKFQFHSNGLNZ-GXTWGEPZSA-N 1 0 285.840 3.665 20 10 CHCDRO CCOCc1cc(C[NH2+]C2(C3CCC3)CC2)ccc1OC ZINC000846055426 1131685457 /nfs/dbraw/zinc/68/54/57/1131685457.db2.gz LYOLULIZJZTPQY-UHFFFAOYSA-N 1 0 289.419 3.654 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000846108785 1131686918 /nfs/dbraw/zinc/68/69/18/1131686918.db2.gz QFDLWPDAFZWOMA-CYBMUJFWSA-N 1 0 287.737 3.667 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]CCC[C@H]2CC2(Cl)Cl)c1 ZINC000846105673 1131691294 /nfs/dbraw/zinc/69/12/94/1131691294.db2.gz VRBOHLVHEYPIJB-LBPRGKRZSA-N 1 0 288.218 3.764 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H]2CCCC2(C)C)c1O ZINC000846150508 1131691995 /nfs/dbraw/zinc/69/19/95/1131691995.db2.gz QNMHIUQBISUAEB-SMDDNHRTSA-N 1 0 263.381 3.630 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CC2(CC(C)C)CC2)c1O ZINC000846153561 1131692386 /nfs/dbraw/zinc/69/23/86/1131692386.db2.gz JTSZWACWTBUFTB-ZDUSSCGKSA-N 1 0 277.408 3.878 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]C2(C3CCC3)CCC2)c1O ZINC000846168795 1131692917 /nfs/dbraw/zinc/69/29/17/1131692917.db2.gz LNNXSGMEPPMCIH-LBPRGKRZSA-N 1 0 275.392 3.774 20 10 CHCDRO CC(C)OC1CCC([NH2+][C@H]2CCc3cccc(O)c32)CC1 ZINC000834689053 1131694387 /nfs/dbraw/zinc/69/43/87/1131694387.db2.gz IOEUWEPHXKLYSG-GPANFISMSA-N 1 0 289.419 3.705 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1c(C)noc1C ZINC000834692677 1131694398 /nfs/dbraw/zinc/69/43/98/1131694398.db2.gz GWZIKLGAGXMQLJ-ZIAGYGMSSA-N 1 0 286.375 3.725 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CCc2cccc(C)c2)c1O ZINC000846141496 1131694563 /nfs/dbraw/zinc/69/45/63/1131694563.db2.gz KHOHTEASUFXJHK-CQSZACIVSA-N 1 0 285.387 3.603 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]Cc2ccc(Cl)s2)c1O ZINC000846141841 1131695081 /nfs/dbraw/zinc/69/50/81/1131695081.db2.gz AMQBUOMGMILCCB-SECBINFHSA-N 1 0 297.807 3.967 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]C[C@@H]2CCc3ccccc32)c1O ZINC000846144378 1131695126 /nfs/dbraw/zinc/69/51/26/1131695126.db2.gz IWSBZLPRCSQWQC-HIFRSBDPSA-N 1 0 297.398 3.781 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]C[C@@H]2CCc3ccccc32)c1O ZINC000846144387 1131695169 /nfs/dbraw/zinc/69/51/69/1131695169.db2.gz IWSBZLPRCSQWQC-ZFWWWQNUSA-N 1 0 297.398 3.781 20 10 CHCDRO CCc1cccc(C[NH2+][C@H](C)c2cc(F)ccc2O)c1 ZINC000846208724 1131695655 /nfs/dbraw/zinc/69/56/55/1131695655.db2.gz KASQHXDDMVQOCM-GFCCVEGCSA-N 1 0 273.351 3.945 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@@H]2CCCC[C@H]2SC)c1O ZINC000846178529 1131697140 /nfs/dbraw/zinc/69/71/40/1131697140.db2.gz DEYATYKUEVAQFS-UXIGCNINSA-N 1 0 295.448 3.726 20 10 CHCDRO CCC[C@H](C)[C@H](CO)[NH2+][C@H](CC)c1ccc(C)cc1O ZINC000846183994 1131697199 /nfs/dbraw/zinc/69/71/99/1131697199.db2.gz LLPPMKUDFJFFQF-IMJJTQAJSA-N 1 0 279.424 3.538 20 10 CHCDRO C[C@H]([NH2+]CC[C@]1(C)C[C@@]1(F)Cl)c1cc(F)ccc1O ZINC000846185228 1131697894 /nfs/dbraw/zinc/69/78/94/1131697894.db2.gz RESCNIYONLGIMF-FZZIBODNSA-N 1 0 289.753 3.887 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H]2C[C@H]2CC(C)(C)C)c1O ZINC000846192504 1131698973 /nfs/dbraw/zinc/69/89/73/1131698973.db2.gz XWTLOPVFPHTWKF-SGMGOOAPSA-N 1 0 277.408 3.876 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H](C)COCC2CC2)cc1 ZINC000846203057 1131700060 /nfs/dbraw/zinc/70/00/60/1131700060.db2.gz DQCHRHRCYIMNGU-HUUCEWRRSA-N 1 0 290.451 3.608 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]C1(Cc3ccccc3)CC1)CC2 ZINC000834770783 1131704590 /nfs/dbraw/zinc/70/45/90/1131704590.db2.gz XZSSACZJDTWEEQ-MRXNPFEDSA-N 1 0 279.383 3.744 20 10 CHCDRO COC1(C[NH2+][C@H](C)c2cc(Cl)ccc2O)CCCC1 ZINC000834814082 1131707471 /nfs/dbraw/zinc/70/74/71/1131707471.db2.gz DUUMMAYORQTVCY-LLVKDONJSA-N 1 0 283.799 3.655 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCCC2CCOCC2)c(O)c1 ZINC000834817906 1131707733 /nfs/dbraw/zinc/70/77/33/1131707733.db2.gz FJHXFMPYKYNMBR-CQSZACIVSA-N 1 0 277.408 3.558 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H]2CCOC2(C)C)c1O ZINC000834875441 1131716150 /nfs/dbraw/zinc/71/61/50/1131716150.db2.gz OYPVZSMOKNGFGZ-MFKMUULPSA-N 1 0 283.799 3.572 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H](C)CCCCO)c1O ZINC000834876322 1131716185 /nfs/dbraw/zinc/71/61/85/1131716185.db2.gz AKZPWWOTSYAQKN-RYUDHWBXSA-N 1 0 285.815 3.556 20 10 CHCDRO CC(C)[C@H]1C[C@H](C[NH2+][C@@H](C)c2cc(F)ccc2O)CCO1 ZINC000834884622 1131717406 /nfs/dbraw/zinc/71/74/06/1131717406.db2.gz AAUOMQPHOTWHSC-OGHNNQOOSA-N 1 0 295.398 3.633 20 10 CHCDRO C[C@H]([NH2+]C[C@]1(C)CC1(Cl)Cl)c1cc(F)ccc1O ZINC000834884574 1131717553 /nfs/dbraw/zinc/71/75/53/1131717553.db2.gz NQLDLTILOOTYFF-UFBFGSQYSA-N 1 0 292.181 3.766 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@]2(C)CC2(Cl)Cl)c1 ZINC000834885242 1131718600 /nfs/dbraw/zinc/71/86/00/1131718600.db2.gz UKTSEJKHUJSMQQ-ZWNOBZJWSA-N 1 0 288.218 3.935 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2cnccc2C)c(O)c1 ZINC000834887236 1131719265 /nfs/dbraw/zinc/71/92/65/1131719265.db2.gz QHWIFFLBDIXFAR-AWEZNQCLSA-N 1 0 270.376 3.563 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCO[C@@H](C(C)C)C2)c1 ZINC000834887227 1131719690 /nfs/dbraw/zinc/71/96/90/1131719690.db2.gz ZXLCPPUPWRXTGL-HDMKZQKVSA-N 1 0 291.435 3.802 20 10 CHCDRO C[C@@H]([NH2+]C1CCC(OC(F)F)CC1)c1ccccc1O ZINC000834901784 1131724777 /nfs/dbraw/zinc/72/47/77/1131724777.db2.gz CLWQBNFIYVGGHZ-VOMCLLRMSA-N 1 0 285.334 3.593 20 10 CHCDRO CC[C@@H]([NH2+]CCC[C@@H]1CCOC1)c1ccc(N(C)C)cc1 ZINC000834903541 1131727362 /nfs/dbraw/zinc/72/73/62/1131727362.db2.gz KTMIYWIWBGPGJY-CRAIPNDOSA-N 1 0 290.451 3.610 20 10 CHCDRO CCO[C@@H]1CCCC[C@H]1[NH2+][C@H](C)c1ccc(C)cc1O ZINC000834914849 1131733597 /nfs/dbraw/zinc/73/35/97/1131733597.db2.gz WWXIIDDAMAEYNY-FRFSOERESA-N 1 0 277.408 3.699 20 10 CHCDRO CCO[C@@H]1CCCC[C@H]1[NH2+][C@H](C)c1cc(F)cc(F)c1[O-] ZINC000834915391 1131733898 /nfs/dbraw/zinc/73/38/98/1131733898.db2.gz YICIBOACOWUCCE-VCTAVGKDSA-N 1 0 299.361 3.669 20 10 CHCDRO CC[C@@H]([NH2+]CCOC(C)(C)CC)c1ccc(C)cc1O ZINC000834916395 1131734006 /nfs/dbraw/zinc/73/40/06/1131734006.db2.gz XHWNKRBYUHNRDZ-OAHLLOKOSA-N 1 0 279.424 3.947 20 10 CHCDRO Cc1nsc(C)c1C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000846862684 1131745707 /nfs/dbraw/zinc/74/57/07/1131745707.db2.gz WUOSNPPWQIPSKN-LLVKDONJSA-N 1 0 289.448 3.677 20 10 CHCDRO Oc1cc(Cl)ccc1C[N@@H+]1CC[C@H]2CCC[C@H]2C1 ZINC001140462205 1131748767 /nfs/dbraw/zinc/74/87/67/1131748767.db2.gz AKDOIHLNVAPKHL-NEPJUHHUSA-N 1 0 265.784 3.668 20 10 CHCDRO Oc1cc(Cl)ccc1C[NH+]1CCc2ccccc2CC1 ZINC001140466380 1131752769 /nfs/dbraw/zinc/75/27/69/1131752769.db2.gz FECWTIHNFPXVBL-UHFFFAOYSA-N 1 0 287.790 3.646 20 10 CHCDRO CN(C)c1ccc(/C=C/C[N@H+](C)Cc2ccccc2O)cc1 ZINC000835024730 1131759884 /nfs/dbraw/zinc/75/98/84/1131759884.db2.gz BVEZSCZGUONWTB-VOTSOKGWSA-N 1 0 296.414 3.603 20 10 CHCDRO COc1ccccc1C[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC000835034013 1131760722 /nfs/dbraw/zinc/76/07/22/1131760722.db2.gz NDDMVFFVMQDFER-SREVYHEPSA-N 1 0 296.414 3.564 20 10 CHCDRO C[C@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)C1(C)CC1 ZINC000835037253 1131761671 /nfs/dbraw/zinc/76/16/71/1131761671.db2.gz PGKVVWHNWCTQFK-GJBLVYBDSA-N 1 0 258.409 3.544 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]C[C@]2(C)CCCS2)cc1 ZINC000835041440 1131762148 /nfs/dbraw/zinc/76/21/48/1131762148.db2.gz CHFLKWKKOKEPPH-AATOQMJSSA-N 1 0 290.476 3.641 20 10 CHCDRO C[C@@H](C[NH2+]C/C=C/c1ccc(N(C)C)cc1)c1ccncc1 ZINC000835043901 1131762701 /nfs/dbraw/zinc/76/27/01/1131762701.db2.gz VTIGGJCHXKKWDS-APHBUQMISA-N 1 0 295.430 3.554 20 10 CHCDRO COC(C)(C)C[C@@H](C)[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC000835040229 1131763017 /nfs/dbraw/zinc/76/30/17/1131763017.db2.gz OHHVXSRPIYYNFC-ZPIQOJFGSA-N 1 0 290.451 3.559 20 10 CHCDRO C[C@@H](c1ccncc1)[N@H+](C)C/C=C\c1ccc(N(C)C)cc1 ZINC000835046970 1131764032 /nfs/dbraw/zinc/76/40/32/1131764032.db2.gz AZQDGUXOEXAWBV-KJPDOMRESA-N 1 0 295.430 3.854 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]CC2(C(F)(F)F)CC2)cc1 ZINC000835052758 1131766165 /nfs/dbraw/zinc/76/61/65/1131766165.db2.gz HIIKLTRTKBZXFQ-ONEGZZNKSA-N 1 0 298.352 3.698 20 10 CHCDRO Cc1ccc(F)cc1C[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC001140592471 1131814896 /nfs/dbraw/zinc/81/48/96/1131814896.db2.gz NCXKNVVQQWBNNH-UHFFFAOYSA-N 1 0 286.394 3.832 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCc3ccc(C)cc3C2)c1 ZINC001140617452 1131829968 /nfs/dbraw/zinc/82/99/68/1131829968.db2.gz ONBWEZMHXPIDPQ-UHFFFAOYSA-N 1 0 267.372 3.567 20 10 CHCDRO CC[N@H+](Cc1cccc(OC)c1)Cc1cc(C)ccc1O ZINC001140623334 1131833167 /nfs/dbraw/zinc/83/31/67/1131833167.db2.gz NVLIPNVSFDGUTP-UHFFFAOYSA-N 1 0 285.387 3.731 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(NC[C@H]2CCCC[NH2+]2)cc1 ZINC001171335586 1131865932 /nfs/dbraw/zinc/86/59/32/1131865932.db2.gz YUWBBMJQFXBORM-QGZVFWFLSA-N 1 0 283.419 3.648 20 10 CHCDRO Cc1c(O)ccc(CN2Cc3cccc(Cl)c3C2)c1O ZINC001140748168 1131906277 /nfs/dbraw/zinc/90/62/77/1131906277.db2.gz SXTWNGUXQQATSN-UHFFFAOYSA-N 1 0 289.762 3.575 20 10 CHCDRO Cc1cc(C[NH2+][C@H](C)c2ccccc2)ccc1N(C)C ZINC000772999564 1131913351 /nfs/dbraw/zinc/91/33/51/1131913351.db2.gz MQCNEDBMODVVQV-OAHLLOKOSA-N 1 0 268.404 3.912 20 10 CHCDRO CC[N@H+](Cc1ccc(F)cc1C)Cc1ccccc1O ZINC001140780515 1131914680 /nfs/dbraw/zinc/91/46/80/1131914680.db2.gz DBIQSFPKNKLENQ-UHFFFAOYSA-N 1 0 273.351 3.862 20 10 CHCDRO COc1ccccc1[C@H](C)[NH2+]Cc1ccc(N(C)C)c(C)c1 ZINC000773002872 1131916124 /nfs/dbraw/zinc/91/61/24/1131916124.db2.gz ZOELFLLVECMYIX-HNNXBMFYSA-N 1 0 298.430 3.920 20 10 CHCDRO Cc1n[nH]cc1C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000773014711 1131920773 /nfs/dbraw/zinc/92/07/73/1131920773.db2.gz KKMVFTWMLRMOCJ-CQSZACIVSA-N 1 0 298.434 3.559 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)C2CCCC2)c(O)c1 ZINC001140855154 1131947941 /nfs/dbraw/zinc/94/79/41/1131947941.db2.gz PACFJGNLQWZCTO-UHFFFAOYSA-N 1 0 276.424 3.613 20 10 CHCDRO C[C@@H]([NH2+][C@H](c1cccnc1)C1CC1)c1ccc(N(C)C)cc1 ZINC000773120924 1131950203 /nfs/dbraw/zinc/95/02/03/1131950203.db2.gz SUKWJLPKIJOVGV-KUHUBIRLSA-N 1 0 295.430 3.950 20 10 CHCDRO C[C@@H]([NH2+][C@@H](c1cccnc1)C1CC1)c1ccc(N(C)C)cc1 ZINC000773120922 1131951407 /nfs/dbraw/zinc/95/14/07/1131951407.db2.gz SUKWJLPKIJOVGV-AUUYWEPGSA-N 1 0 295.430 3.950 20 10 CHCDRO CN(C)c1ccc(CN2CCC[C@](C)(F)C2)c(Cl)c1 ZINC001140922255 1131964326 /nfs/dbraw/zinc/96/43/26/1131964326.db2.gz LWPQBZGCZCNSSH-HNNXBMFYSA-N 1 0 284.806 3.730 20 10 CHCDRO Cc1ccc(C[N@@H+]2CC[C@H](Oc3ccccc3C)C2)c(O)c1 ZINC001140949819 1131969333 /nfs/dbraw/zinc/96/93/33/1131969333.db2.gz MIMLCPGBCAPLGH-KRWDZBQOSA-N 1 0 297.398 3.662 20 10 CHCDRO Cc1ccc(C[N@@H+]2CC[C@@H]2c2ccccc2)c(O)c1 ZINC001140950923 1131971293 /nfs/dbraw/zinc/97/12/93/1131971293.db2.gz PDVVVGONJHUACG-MRXNPFEDSA-N 1 0 253.345 3.648 20 10 CHCDRO Cc1ccc(C[N@@H+]2CCC[C@H]3CCCC[C@@H]32)c(O)c1 ZINC001140951122 1131971311 /nfs/dbraw/zinc/97/13/11/1131971311.db2.gz ZOSNWXPCVLPRJK-ZBFHGGJFSA-N 1 0 259.393 3.855 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCc2cccc(F)c2)c(O)c1 ZINC000036778586 1131975039 /nfs/dbraw/zinc/97/50/39/1131975039.db2.gz SUYBTLPGMRMGRV-CYBMUJFWSA-N 1 0 273.351 3.733 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1O)c1ccc2c(c1)OCO2 ZINC000036982036 1131985410 /nfs/dbraw/zinc/98/54/10/1131985410.db2.gz MZXIFUIRUKYDSY-NEPJUHHUSA-N 1 0 285.343 3.533 20 10 CHCDRO COc1ccc(N2CC[C@@H]([NH2+]C3CCCCCC3)C2)cc1 ZINC001203090172 1132004397 /nfs/dbraw/zinc/00/43/97/1132004397.db2.gz OTKQVMGZDCRENU-MRXNPFEDSA-N 1 0 288.435 3.586 20 10 CHCDRO c1c(C[NH+]2C[C@H]3CCC[C@@H]3C2)cc2c3c1CCCN3CCC2 ZINC001141074554 1132004882 /nfs/dbraw/zinc/00/48/82/1132004882.db2.gz LXQBBLCVTIKGDU-RTBURBONSA-N 1 0 296.458 3.617 20 10 CHCDRO c1c(C[NH+]2C3CCC2CC3)cc2c3c1CCCN3CCC2 ZINC001141076021 1132005310 /nfs/dbraw/zinc/00/53/10/1132005310.db2.gz JPQNWCXPMYQIDQ-UHFFFAOYSA-N 1 0 282.431 3.512 20 10 CHCDRO CCCC1CC[NH+](Cc2ccc3c(c2)OCCN3C)CC1 ZINC001141143037 1132028039 /nfs/dbraw/zinc/02/80/39/1132028039.db2.gz KKVGJZSZDBLHSG-UHFFFAOYSA-N 1 0 288.435 3.527 20 10 CHCDRO CC(=O)c1cc(Cl)cc(C[N@H+]2CCCC[C@@H]2C)c1O ZINC000037322574 1132028975 /nfs/dbraw/zinc/02/89/75/1132028975.db2.gz VJVQQHMAHDJXAC-JTQLQIEISA-N 1 0 281.783 3.623 20 10 CHCDRO CC[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc2c(c1)CCO2 ZINC000037363325 1132029869 /nfs/dbraw/zinc/02/98/69/1132029869.db2.gz KQMFJXMIXSBONM-GDBMZVCRSA-N 1 0 259.393 3.680 20 10 CHCDRO Oc1ccc(O)c(C[N@@H+]2CCC[C@@H]2c2ccccc2F)c1 ZINC001141159331 1132031384 /nfs/dbraw/zinc/03/13/84/1132031384.db2.gz FDBLPQSCKXJMKL-MRXNPFEDSA-N 1 0 287.334 3.574 20 10 CHCDRO CCc1ccccc1C[N@@H+]1CCCc2cc(O)c(O)cc2C1 ZINC001141228787 1132050315 /nfs/dbraw/zinc/05/03/15/1132050315.db2.gz HRVFIPUYWOHFFM-UHFFFAOYSA-N 1 0 297.398 3.609 20 10 CHCDRO CCc1ccccc1C[N@H+](CC)Cc1ccccc1O ZINC001141227802 1132050927 /nfs/dbraw/zinc/05/09/27/1132050927.db2.gz KATGUZKZINUKKY-UHFFFAOYSA-N 1 0 269.388 3.977 20 10 CHCDRO CC[C@@H](C)OCC[C@@H](C)[NH2+][C@H](C)c1ccccc1O ZINC001172343476 1132177521 /nfs/dbraw/zinc/17/75/21/1132177521.db2.gz QFMXGXDHTJRTLG-MGPQQGTHSA-N 1 0 265.397 3.637 20 10 CHCDRO CC[C@@H](C)OCC[C@@H](C)[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001172349565 1132181314 /nfs/dbraw/zinc/18/13/14/1132181314.db2.gz VKCSJVVPXLNKQT-HZPDHXFCSA-N 1 0 292.467 3.778 20 10 CHCDRO CC(C)O[C@H]1C[C@@H]([NH2+]Cc2ccc3ccccc3c2O)C1 ZINC000839147494 1132184914 /nfs/dbraw/zinc/18/49/14/1132184914.db2.gz KNFIEPCYKPOKHY-IYBDPMFKSA-N 1 0 285.387 3.591 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H](C)CCCc2cccnc2)c1 ZINC000839150531 1132185690 /nfs/dbraw/zinc/18/56/90/1132185690.db2.gz LIOFMNKPVUTRFH-HNNXBMFYSA-N 1 0 284.403 3.597 20 10 CHCDRO CCOCc1cc(C[NH2+][C@H]2CCC[C@@H]3C[C@@H]32)ccc1OC ZINC000839186890 1132188134 /nfs/dbraw/zinc/18/81/34/1132188134.db2.gz RTLDVGMGTUWXQV-PVAVHDDUSA-N 1 0 289.419 3.510 20 10 CHCDRO CCCC[N@H+](CCc1cncs1)Cc1ccccc1O ZINC000839593961 1132225234 /nfs/dbraw/zinc/22/52/34/1132225234.db2.gz NMNPVUGNNBURFC-UHFFFAOYSA-N 1 0 290.432 3.694 20 10 CHCDRO CO[C@@H]1CC[N@H+](Cc2cc(C(C)C)c(C)cc2O)C[C@H]1C ZINC000840127119 1132247746 /nfs/dbraw/zinc/24/77/46/1132247746.db2.gz RLPJDUTWEWZWHZ-RDTXWAMCSA-N 1 0 291.435 3.681 20 10 CHCDRO Oc1ccc(C[NH2+][C@H]2CC[C@@H](c3ccccc3)C2)c(O)c1 ZINC001172554538 1132264948 /nfs/dbraw/zinc/26/49/48/1132264948.db2.gz WZHOBFGCARANBL-ZBFHGGJFSA-N 1 0 283.371 3.524 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cnc(C)o1)c1cc(Cl)ccc1O ZINC000840795150 1132287666 /nfs/dbraw/zinc/28/76/66/1132287666.db2.gz USRHWIVKONDFSX-CYBMUJFWSA-N 1 0 280.755 3.583 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]C1CCC(C(F)F)CC1)CC2 ZINC000840806553 1132289115 /nfs/dbraw/zinc/28/91/15/1132289115.db2.gz INXGRIRVCFFFCF-WXRRBKDZSA-N 1 0 281.346 3.793 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)c(O)c1C ZINC000840820098 1132290428 /nfs/dbraw/zinc/29/04/28/1132290428.db2.gz JVKKDWBLASAHCS-LQKXBSAESA-N 1 0 259.393 3.848 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1Cc2ccccc2[C@@H]1OC)c1ccccc1O ZINC000840845488 1132293491 /nfs/dbraw/zinc/29/34/91/1132293491.db2.gz ATCSTBKDOZAYIU-LMMKCTJWSA-N 1 0 297.398 3.745 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CS[C@H](C)C1)c1cc2c(cc1O)CCCC2 ZINC000840858955 1132296390 /nfs/dbraw/zinc/29/63/90/1132296390.db2.gz FASPFGFTMBFYGK-LALPHHSUSA-N 1 0 291.460 3.816 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@H]2CS[C@@H](C)C2)c(O)c1 ZINC000840858940 1132296624 /nfs/dbraw/zinc/29/66/24/1132296624.db2.gz DSXNMTCLDIKMOH-RWMBFGLXSA-N 1 0 265.422 3.554 20 10 CHCDRO CC[C@@H]([NH2+]CC(C)(C)OCC1CC1)c1ccccc1O ZINC000840876424 1132299212 /nfs/dbraw/zinc/29/92/12/1132299212.db2.gz MOPNNQVXRRCIBE-OAHLLOKOSA-N 1 0 277.408 3.638 20 10 CHCDRO COC1([C@H](C)[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)CCC1 ZINC000840882710 1132303481 /nfs/dbraw/zinc/30/34/81/1132303481.db2.gz ACNGYGJQJAAFHN-MDZLAQPJSA-N 1 0 293.382 3.627 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H](C)c1cccnc1 ZINC000840893531 1132306146 /nfs/dbraw/zinc/30/61/46/1132306146.db2.gz KNMJDJODZZJUAY-JKSUJKDBSA-N 1 0 297.446 3.738 20 10 CHCDRO CCC1(O)CCC([NH2+]Cc2c(O)cc(C)cc2Cl)CC1 ZINC000840908827 1132307285 /nfs/dbraw/zinc/30/72/85/1132307285.db2.gz YKCWVPBWGKQNBQ-UHFFFAOYSA-N 1 0 297.826 3.527 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@H](C)c2nccs2)c(Cl)c1 ZINC000840938922 1132309418 /nfs/dbraw/zinc/30/94/18/1132309418.db2.gz IMMJKKKAWLGGPX-JTQLQIEISA-N 1 0 296.823 3.704 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+](C)[C@H](C)c1ccccn1 ZINC000840936893 1132309502 /nfs/dbraw/zinc/30/95/02/1132309502.db2.gz NNWZHLYSSVZJNS-OAHLLOKOSA-N 1 0 283.419 3.649 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CCC[C@@H]2CCCCO2)c(Cl)c1 ZINC000840938722 1132310254 /nfs/dbraw/zinc/31/02/54/1132310254.db2.gz FYANWLFNRPBFJI-ZDUSSCGKSA-N 1 0 297.826 3.793 20 10 CHCDRO COCC(C)(C)CCC[NH2+]Cc1c(O)cc(C)cc1Cl ZINC000840945330 1132312204 /nfs/dbraw/zinc/31/22/04/1132312204.db2.gz JJRQBIHJNSLAOX-UHFFFAOYSA-N 1 0 299.842 3.896 20 10 CHCDRO COCC[C@H]1CCCC[N@@H+]1Cc1c(O)ccc2ccccc21 ZINC001231588120 1132317802 /nfs/dbraw/zinc/31/78/02/1132317802.db2.gz IQJCLAKTGSTGEW-MRXNPFEDSA-N 1 0 299.414 3.936 20 10 CHCDRO C[N@H+](Cc1ccccn1)Cc1c(O)ccc2ccccc21 ZINC001231588010 1132318576 /nfs/dbraw/zinc/31/85/76/1132318576.db2.gz LIVZCFMRGNRSAS-UHFFFAOYSA-N 1 0 278.355 3.572 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CCC2(CC2)C1 ZINC001231587294 1132319341 /nfs/dbraw/zinc/31/93/41/1132319341.db2.gz TWBGELYLSCYBSP-UHFFFAOYSA-N 1 0 253.345 3.531 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2c(O)ccc3ccccc32)C2(CC2)C1 ZINC001231591251 1132320773 /nfs/dbraw/zinc/32/07/73/1132320773.db2.gz ZOXNHLOJIUJGHI-ZDUSSCGKSA-N 1 0 267.372 3.920 20 10 CHCDRO CCCc1cccc(C[NH2+]CCc2ccc(N)cc2)c1 ZINC000841035175 1132320992 /nfs/dbraw/zinc/32/09/92/1132320992.db2.gz LBXBMVQDSUOCJG-UHFFFAOYSA-N 1 0 268.404 3.554 20 10 CHCDRO C[C@@H](CCc1cccc(F)c1)[NH2+]CCc1ccc(N)cc1 ZINC000841035270 1132321236 /nfs/dbraw/zinc/32/12/36/1132321236.db2.gz LYCMFNVJJRFSHQ-AWEZNQCLSA-N 1 0 286.394 3.561 20 10 CHCDRO Cc1cc(Cl)ccc1C[NH2+]CCc1ccc(N)cc1 ZINC000841033808 1132321369 /nfs/dbraw/zinc/32/13/69/1132321369.db2.gz BKONTAMOEWEZQM-UHFFFAOYSA-N 1 0 274.795 3.563 20 10 CHCDRO Cc1cccc(CC[C@@H](C)[NH2+]CCc2ccc(N)cc2)c1 ZINC000841036971 1132321628 /nfs/dbraw/zinc/32/16/28/1132321628.db2.gz XJVYHVRNABLFIS-MRXNPFEDSA-N 1 0 282.431 3.731 20 10 CHCDRO Cc1cccc(C[NH+]2CCC3(CC[C@H](F)C3)CC2)c1O ZINC001231592132 1132321663 /nfs/dbraw/zinc/32/16/63/1132321663.db2.gz CTUKFSAIKUJPOS-HNNXBMFYSA-N 1 0 277.383 3.805 20 10 CHCDRO Cc1cc(Cl)cc(CNc2ccc([C@H](C)[NH3+])cc2)c1O ZINC000841027356 1132321806 /nfs/dbraw/zinc/32/18/06/1132321806.db2.gz ABMZYBOOMJUWBP-NSHDSACASA-N 1 0 290.794 3.986 20 10 CHCDRO C[C@H]1[C@H](c2ccccc2)C[C@@H]1[NH2+]CCc1ccc(N)cc1 ZINC000841037139 1132323589 /nfs/dbraw/zinc/32/35/89/1132323589.db2.gz YLUYCNXIGDYYIB-KYNGSXCRSA-N 1 0 280.415 3.593 20 10 CHCDRO C[N@H+](Cc1ccccc1)CC(C)(C)CNc1ccc(N)cc1 ZINC000841040346 1132323679 /nfs/dbraw/zinc/32/36/79/1132323679.db2.gz PKWBASCSGGVGPN-UHFFFAOYSA-N 1 0 297.446 3.839 20 10 CHCDRO Cc1ccc2c(c1)C[C@H]([NH2+][C@@H](C)c1ccccc1O)CC2 ZINC001172835654 1132327011 /nfs/dbraw/zinc/32/70/11/1132327011.db2.gz ONGDMDLTXDGTHJ-WMLDXEAASA-N 1 0 281.399 3.909 20 10 CHCDRO CSc1ccccc1C[N@@H+]1CCc2cccc(O)c2C1 ZINC001231785845 1132361923 /nfs/dbraw/zinc/36/19/23/1132361923.db2.gz JNIJYYIZHPQVGK-UHFFFAOYSA-N 1 0 285.412 3.672 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCCC(F)(F)[C@@H](F)C2)c(O)c1 ZINC001231843359 1132375701 /nfs/dbraw/zinc/37/57/01/1132375701.db2.gz WTBVHAVZCHMFMN-AWEZNQCLSA-N 1 0 287.325 3.578 20 10 CHCDRO Cc1cc(C)c(C[N@H+]2CCC[C@H](C)[C@@H](C)C2)c(O)c1 ZINC001231842457 1132376852 /nfs/dbraw/zinc/37/68/52/1132376852.db2.gz MKDSJJPWFXFLNU-ZFWWWQNUSA-N 1 0 261.409 3.877 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCCC3(CCC3)C2)c(O)c1 ZINC001231850892 1132378546 /nfs/dbraw/zinc/37/85/46/1132378546.db2.gz VZTNXHQOIKEUGH-UHFFFAOYSA-N 1 0 259.393 3.775 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCC[C@@H]2Cc2ccccn2)c(O)c1 ZINC001231847348 1132379047 /nfs/dbraw/zinc/37/90/47/1132379047.db2.gz XPZHCDGTSIZMBF-QGZVFWFLSA-N 1 0 296.414 3.611 20 10 CHCDRO COC(C)(C)[C@@H]1CCC[N@@H+]1Cc1cc(Cl)c(C)cc1O ZINC001231870934 1132383041 /nfs/dbraw/zinc/38/30/41/1132383041.db2.gz WOBUVZUACIRTFA-HNNXBMFYSA-N 1 0 297.826 3.743 20 10 CHCDRO CCCOC1CCC([NH2+]Cc2cccc(C)c2O)CC1 ZINC001173094647 1132385410 /nfs/dbraw/zinc/38/54/10/1132385410.db2.gz QSKDZNWFDYBRNR-UHFFFAOYSA-N 1 0 277.408 3.528 20 10 CHCDRO Cc1ncc(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)s1 ZINC000841747001 1132389062 /nfs/dbraw/zinc/38/90/62/1132389062.db2.gz MPYWLFHWVWMELM-QMMMGPOBSA-N 1 0 282.796 3.661 20 10 CHCDRO Cc1nc(C[NH2+][C@H](C)c2ccc(Cl)cc2O)cs1 ZINC000841746086 1132389260 /nfs/dbraw/zinc/38/92/60/1132389260.db2.gz VLPYERKGVDEMDD-MRVPVSSYSA-N 1 0 282.796 3.661 20 10 CHCDRO Cc1nc(C)c(C[NH2+][C@H](C)c2ccc(Cl)cc2O)s1 ZINC000841748528 1132389707 /nfs/dbraw/zinc/38/97/07/1132389707.db2.gz ALQBZWBOZCZLKP-MRVPVSSYSA-N 1 0 296.823 3.970 20 10 CHCDRO C[C@@H](C[NH2+][C@@H](C)c1ccc(Cl)cc1O)c1nccs1 ZINC000841751602 1132389853 /nfs/dbraw/zinc/38/98/53/1132389853.db2.gz IFJHOUFAEYDTQL-UWVGGRQHSA-N 1 0 296.823 3.956 20 10 CHCDRO C[C@@]1(CF)CC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC001231879667 1132390967 /nfs/dbraw/zinc/39/09/67/1132390967.db2.gz MZSVACGCKVMYGW-KRWDZBQOSA-N 1 0 273.351 3.727 20 10 CHCDRO C[C@H]1C[N@H+](Cc2ccc3ccccc3c2O)CCC[C@]1(C)O ZINC001231879576 1132391482 /nfs/dbraw/zinc/39/14/82/1132391482.db2.gz IZCXNJXCKWVHOW-LIRRHRJNSA-N 1 0 299.414 3.528 20 10 CHCDRO CO[C@H]1CC[N@H+](Cc2ccc3ccccc3c2O)[C@H](C)C1 ZINC001231884011 1132391550 /nfs/dbraw/zinc/39/15/50/1132391550.db2.gz UGSCSKHXFNDNBV-CJNGLKHVSA-N 1 0 285.387 3.545 20 10 CHCDRO CC1(C)C[N@H+](Cc2ccc3ccccc3c2O)[C@](C)(CO)C1 ZINC001231879999 1132391649 /nfs/dbraw/zinc/39/16/49/1132391649.db2.gz ZXIRGXWVVDDZDW-IBGZPJMESA-N 1 0 299.414 3.528 20 10 CHCDRO Oc1c(C[NH+]2CCC3(CCCO3)CC2)ccc2ccccc21 ZINC001231881912 1132391764 /nfs/dbraw/zinc/39/17/64/1132391764.db2.gz LECHFACUJXDZHT-UHFFFAOYSA-N 1 0 297.398 3.690 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H]2COCc3ccccc32)c(O)c1 ZINC000841759841 1132394384 /nfs/dbraw/zinc/39/43/84/1132394384.db2.gz IUVMASVQXHQDOB-DYVFJYSZSA-N 1 0 283.371 3.623 20 10 CHCDRO CC(C)(C)c1cc(C[N@@H+]2CCc3cccc(O)c3C2)ccn1 ZINC001232220202 1132438931 /nfs/dbraw/zinc/43/89/31/1132438931.db2.gz GWDRWYSYDXPQCK-UHFFFAOYSA-N 1 0 296.414 3.643 20 10 CHCDRO CCSC[C@@H](C)[NH2+]Cc1cc2ccccc2cc1O ZINC001173293986 1132443180 /nfs/dbraw/zinc/44/31/80/1132443180.db2.gz BJYMIFYPBCKPGR-GFCCVEGCSA-N 1 0 275.417 3.777 20 10 CHCDRO C[N@H+](Cc1cccc(F)c1)Cc1cc(Cl)c(O)cc1O ZINC001232260429 1132445280 /nfs/dbraw/zinc/44/52/80/1132445280.db2.gz QBBDUSAVZNTRIV-UHFFFAOYSA-N 1 0 295.741 3.522 20 10 CHCDRO CCOc1ccc(C[NH2+]C2(c3ccccc3C)CC2)c(O)c1 ZINC000842732562 1132455658 /nfs/dbraw/zinc/45/56/58/1132455658.db2.gz MGBHKJVABBLTPZ-UHFFFAOYSA-N 1 0 297.398 3.878 20 10 CHCDRO COc1ccc(C[NH2+]C2(c3ccccc3OC)CC2)cc1C ZINC000842739065 1132456449 /nfs/dbraw/zinc/45/64/49/1132456449.db2.gz HRWKWCBHYOMQSJ-UHFFFAOYSA-N 1 0 297.398 3.791 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]CC1CCC(F)CC1 ZINC000842774692 1132461175 /nfs/dbraw/zinc/46/11/75/1132461175.db2.gz KIHLKRBESIZJTP-UHFFFAOYSA-N 1 0 271.763 3.664 20 10 CHCDRO CC[C@H](C)C[C@@H](CO)[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000842915916 1132475715 /nfs/dbraw/zinc/47/57/15/1132475715.db2.gz HWKSZKIMKSSULO-NOLJZWGESA-N 1 0 279.424 3.538 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+][C@@H]2CCS[C@H]2C)c2c1c(F)ccc2O ZINC000842929955 1132477924 /nfs/dbraw/zinc/47/79/24/1132477924.db2.gz RAWMUMAXUZVUIW-DMWPJOQESA-N 1 0 281.396 3.563 20 10 CHCDRO CC(C)(C)c1cccc(C[N@@H+]2CC[C@](C)(F)[C@@H](F)C2)c1O ZINC001143104541 1132502026 /nfs/dbraw/zinc/50/20/26/1132502026.db2.gz UXSAGVYWKWBGDZ-YOEHRIQHSA-N 1 0 297.389 3.962 20 10 CHCDRO CC(C)(C)c1cccc(C[N@@H+]2C[C@@H]3C[C@H]2C[C@H]3F)c1O ZINC001143110386 1132503862 /nfs/dbraw/zinc/50/38/62/1132503862.db2.gz FFZXVQRXZIJDIT-KCQAQPDRSA-N 1 0 277.383 3.622 20 10 CHCDRO CC(C)O[C@H]1CC[N@H+](Cc2cccc(C(C)(C)C)c2O)C1 ZINC001143111386 1132504561 /nfs/dbraw/zinc/50/45/61/1132504561.db2.gz BMEBYMIMDIGOEE-HNNXBMFYSA-N 1 0 291.435 3.689 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2ccc(N(C)C)cc2O)Cc2ccccc21 ZINC001232833628 1132528582 /nfs/dbraw/zinc/52/85/82/1132528582.db2.gz BIZFAJXHPNXHLT-CQSZACIVSA-N 1 0 296.414 3.578 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+]C[C@H](C)CC(F)F)c1O ZINC000843419577 1132530114 /nfs/dbraw/zinc/53/01/14/1132530114.db2.gz ZBGBDOUOIJSFKV-MRVPVSSYSA-N 1 0 277.742 3.735 20 10 CHCDRO C[C@@H](C[NH2+]Cc1ccc2ccccc2c1O)CC(F)F ZINC000843418307 1132531130 /nfs/dbraw/zinc/53/11/30/1132531130.db2.gz BCJBQXSRWCCZAH-LLVKDONJSA-N 1 0 279.330 3.926 20 10 CHCDRO CC(C)(C)c1ccc(O)c(C[NH+]2CC3(CCC3)C2)c1 ZINC001233284168 1132594256 /nfs/dbraw/zinc/59/42/56/1132594256.db2.gz KTLROJZJHHZFAY-UHFFFAOYSA-N 1 0 259.393 3.676 20 10 CHCDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CCC[C@H](F)C2)c1 ZINC001233285886 1132594652 /nfs/dbraw/zinc/59/46/52/1132594652.db2.gz WTJXFMKUOOAYTK-AWEZNQCLSA-N 1 0 265.372 3.624 20 10 CHCDRO CC(C)[C@H]1COCC[N@@H+]1Cc1cc(C(C)(C)C)ccc1O ZINC001233286027 1132595679 /nfs/dbraw/zinc/59/56/79/1132595679.db2.gz BKGGODSSHGYRPZ-MRXNPFEDSA-N 1 0 291.435 3.547 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CC[C@H]3CCC[C@@H]3C2)c1O ZINC001233288005 1132597225 /nfs/dbraw/zinc/59/72/25/1132597225.db2.gz RARWCJXRHNXHJH-VXGBXAGGSA-N 1 0 295.810 3.676 20 10 CHCDRO Oc1cc(C(F)(F)F)ccc1C[N@@H+]1CCC[C@H](F)CC1 ZINC001233452522 1132624728 /nfs/dbraw/zinc/62/47/28/1132624728.db2.gz ZOVVPCXGVKSIEM-LBPRGKRZSA-N 1 0 291.288 3.735 20 10 CHCDRO C[C@H]1CCC[N@H+](Cc2ccc(C(F)(F)F)cc2O)C1 ZINC001233451399 1132625092 /nfs/dbraw/zinc/62/50/92/1132625092.db2.gz JDOSTEYDPKKMJW-JTQLQIEISA-N 1 0 273.298 3.643 20 10 CHCDRO Oc1cc(C(F)(F)F)ccc1C[N@@H+]1CCCC[C@@H](F)C1 ZINC001233452518 1132625265 /nfs/dbraw/zinc/62/52/65/1132625265.db2.gz ZLNCXKCVUHBERY-GFCCVEGCSA-N 1 0 291.288 3.735 20 10 CHCDRO CSCC[C@H](C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000134874265 1132626688 /nfs/dbraw/zinc/62/66/88/1132626688.db2.gz UTDJPLGCJBGFRQ-AWEZNQCLSA-N 1 0 278.465 3.518 20 10 CHCDRO c1cc(Nc2ccc(C3CC[NH2+]CC3)cc2)cc2c1NCC2 ZINC001159522939 1132857390 /nfs/dbraw/zinc/85/73/90/1132857390.db2.gz QLIUXPZRUGAFKD-UHFFFAOYSA-N 1 0 293.414 3.865 20 10 CHCDRO Cc1ccc(NC2=CC[NH2+]CC2)c(C(=O)c2ccccc2)c1 ZINC001159900468 1132920665 /nfs/dbraw/zinc/92/06/65/1132920665.db2.gz QDSXUENRWLVPDK-UHFFFAOYSA-N 1 0 292.382 3.515 20 10 CHCDRO Nc1ccc(Nc2ccc(CC3CC[NH2+]CC3)cc2)cc1 ZINC001160014547 1132935858 /nfs/dbraw/zinc/93/58/58/1132935858.db2.gz ADIVMBQZJXKFSQ-UHFFFAOYSA-N 1 0 281.403 3.555 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)C[C@H]2C[C@H]2c2ccccc2)cc1 ZINC001204146074 1132952740 /nfs/dbraw/zinc/95/27/40/1132952740.db2.gz RRUOZWZVGDKTRE-QUCCMNQESA-N 1 0 294.442 3.988 20 10 CHCDRO Cc1cccc(C[C@@H](C)[NH2+]Cc2cc(C)ccc2O)c1 ZINC001206714672 1133264066 /nfs/dbraw/zinc/26/40/66/1133264066.db2.gz JVOZOSXAWLQCAD-OAHLLOKOSA-N 1 0 269.388 3.730 20 10 CHCDRO CCOCc1cc(C[NH2+]CCCC2CCC2)ccc1OC ZINC001203169155 1133304520 /nfs/dbraw/zinc/30/45/20/1133304520.db2.gz UAOHBNSRYPFWDI-UHFFFAOYSA-N 1 0 291.435 3.902 20 10 CHCDRO Oc1ccccc1C[NH+]1CCC2(CCc3ccccc32)CC1 ZINC001203550187 1133339442 /nfs/dbraw/zinc/33/94/42/1133339442.db2.gz KVCRBPHNYYIAHZ-UHFFFAOYSA-N 1 0 293.410 3.872 20 10 CHCDRO CC[N@H+](Cc1cccc(F)c1)Cc1ccccc1O ZINC001203558328 1133340436 /nfs/dbraw/zinc/34/04/36/1133340436.db2.gz FIXYVGNJRROYBV-UHFFFAOYSA-N 1 0 259.324 3.553 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCC[C@@H](OCc2ccccc2)C1 ZINC001203558722 1133340766 /nfs/dbraw/zinc/34/07/66/1133340766.db2.gz YKPMCUUIKAJGED-GOSISDBHSA-N 1 0 297.398 3.573 20 10 CHCDRO CCC[N@H+](Cc1cccc(OCC)c1O)[C@H](C)CC ZINC001203602141 1133343641 /nfs/dbraw/zinc/34/36/41/1133343641.db2.gz DHCNELQVDBIOTL-CYBMUJFWSA-N 1 0 265.397 3.801 20 10 CHCDRO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1ccc(OC)cc1O ZINC001203628996 1133345769 /nfs/dbraw/zinc/34/57/69/1133345769.db2.gz NANWTROLILLUOX-GOSISDBHSA-N 1 0 297.398 3.910 20 10 CHCDRO COc1ccc(C[N@@H+]2CCC[C@@H](c3ccccc3)C2)c(O)c1 ZINC001203630379 1133346772 /nfs/dbraw/zinc/34/67/72/1133346772.db2.gz RFKVANYZUFUVKU-MRXNPFEDSA-N 1 0 297.398 3.780 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CC[C@H](F)C(F)(F)CC1 ZINC001203648338 1133347882 /nfs/dbraw/zinc/34/78/82/1133347882.db2.gz JTYPXPCSKZDDKL-LBPRGKRZSA-N 1 0 293.716 3.615 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CC[C@@H](F)C(F)(F)CC1 ZINC001203648335 1133348399 /nfs/dbraw/zinc/34/83/99/1133348399.db2.gz JTYPXPCSKZDDKL-GFCCVEGCSA-N 1 0 293.716 3.615 20 10 CHCDRO Nc1ccc(Nc2ccc(C[NH+]3CCCC3)cc2)cc1 ZINC001203816978 1133374840 /nfs/dbraw/zinc/37/48/40/1133374840.db2.gz SQLOSGWUGWDSKP-UHFFFAOYSA-N 1 0 267.376 3.608 20 10 CHCDRO COc1ccc(C[NH2+]CC[C@@H]2CCC(C)(C)CO2)cc1C ZINC001203865491 1133376408 /nfs/dbraw/zinc/37/64/08/1133376408.db2.gz XEKHIAQNFBTXRV-INIZCTEOSA-N 1 0 291.435 3.689 20 10 CHCDRO Oc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)cc1O ZINC001203875558 1133377993 /nfs/dbraw/zinc/37/79/93/1133377993.db2.gz PVTUVOSCZUGPRM-OAHLLOKOSA-N 1 0 287.334 3.574 20 10 CHCDRO CC[C@@H]1CCC[N@@H+]1Cc1ccc(N(CC)CC)cc1 ZINC001203939813 1133386342 /nfs/dbraw/zinc/38/63/42/1133386342.db2.gz VZJOSTLQYSALHZ-MRXNPFEDSA-N 1 0 260.425 3.907 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCCC[C@H](F)C2)cc1 ZINC001203936274 1133386779 /nfs/dbraw/zinc/38/67/79/1133386779.db2.gz LJECGTOZEBJCRJ-INIZCTEOSA-N 1 0 278.415 3.857 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@H]3C[C@H]32)cc1 ZINC001203943912 1133387068 /nfs/dbraw/zinc/38/70/68/1133387068.db2.gz INLQUTHQQSLJNO-DOTOQJQBSA-N 1 0 258.409 3.517 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CC[C@H](OC(C)C)C2)cc1 ZINC001203941595 1133388898 /nfs/dbraw/zinc/38/88/98/1133388898.db2.gz CLQARDGRHHCTEI-SFHVURJKSA-N 1 0 290.451 3.532 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H]3C[C@@H]32)c2ccccc21 ZINC001204240573 1133424065 /nfs/dbraw/zinc/42/40/65/1133424065.db2.gz YYLYFGNHHDDLEX-KUHUBIRLSA-N 1 0 280.415 3.890 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H](F)C2)c2ccccc21 ZINC001204240697 1133424089 /nfs/dbraw/zinc/42/40/89/1133424089.db2.gz BLIKQGIKILTOHC-OAHLLOKOSA-N 1 0 286.394 3.840 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[NH+]1CCCCCC1 ZINC001204325600 1133438136 /nfs/dbraw/zinc/43/81/36/1133438136.db2.gz RFYDWSPXZYQEAI-UHFFFAOYSA-N 1 0 258.409 3.663 20 10 CHCDRO CC[C@@H](C)[C@H]1CCCC[N@@H+]1Cc1cc(OC)ccc1O ZINC001204690693 1133476399 /nfs/dbraw/zinc/47/63/99/1133476399.db2.gz XKLNVBRAKLMMFC-CZUORRHYSA-N 1 0 277.408 3.801 20 10 CHCDRO CN(C)c1ccc(C[NH+]2CCCCC2)c(C(F)(F)F)c1 ZINC001204707049 1133477570 /nfs/dbraw/zinc/47/75/70/1133477570.db2.gz SWJCXMZOYKUVFV-UHFFFAOYSA-N 1 0 286.341 3.757 20 10 CHCDRO Nc1ccc(C[N@@H+]2CCCC[C@@H]2c2ccccc2)cc1 ZINC001205171682 1133540263 /nfs/dbraw/zinc/54/02/63/1133540263.db2.gz VSKWNOAEBIZKIY-GOSISDBHSA-N 1 0 266.388 3.996 20 10 CHCDRO CC(C)c1ccc(O)c(C[NH2+][C@H](CO)CCC(C)(C)C)c1 ZINC001205530943 1133585926 /nfs/dbraw/zinc/58/59/26/1133585926.db2.gz SNOYEJWCHQPJEY-INIZCTEOSA-N 1 0 293.451 3.792 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H]1CC[C@H](C)C1 ZINC001206321140 1133688779 /nfs/dbraw/zinc/68/87/79/1133688779.db2.gz PROKIQJTGGHKDX-JLJPHGGASA-N 1 0 274.452 3.770 20 10 CHCDRO Oc1c(Cl)cccc1CNc1ccc2c([nH+]1)CCCC2 ZINC001207449296 1133802139 /nfs/dbraw/zinc/80/21/39/1133802139.db2.gz VMNKBVKIJYNLQD-UHFFFAOYSA-N 1 0 288.778 3.932 20 10 CHCDRO CC[N@H+](CCCc1cccc(OC)c1)Cc1ccccc1O ZINC001207573043 1133820274 /nfs/dbraw/zinc/82/02/74/1133820274.db2.gz QVXFGQWHQFKUQP-UHFFFAOYSA-N 1 0 299.414 3.856 20 10 CHCDRO CCCC[C@H](C)[NH2+]C[C@H](c1ccc(N(C)C)cc1)N(C)C ZINC001207748300 1133845034 /nfs/dbraw/zinc/84/50/34/1133845034.db2.gz IKMQNYJVPMIUKV-MAUKXSAKSA-N 1 0 291.483 3.524 20 10 CHCDRO C[C@@H](C[N@@H+]1CCCc2cc(O)c(O)cc2C1)c1ccccc1 ZINC001207911503 1133860525 /nfs/dbraw/zinc/86/05/25/1133860525.db2.gz CBDHQOZKJMTQCC-AWEZNQCLSA-N 1 0 297.398 3.650 20 10 CHCDRO Cc1ccc([C@@H](C)CC[N@H+](C)Cc2ccccc2O)o1 ZINC001208169756 1133894381 /nfs/dbraw/zinc/89/43/81/1133894381.db2.gz VDSUCJRIKIEFQH-ZDUSSCGKSA-N 1 0 273.376 3.919 20 10 CHCDRO CC[N@@H+](Cc1ccc(N(C)C)cc1)C[C@@H](C)C(F)(F)F ZINC001208902357 1133960164 /nfs/dbraw/zinc/96/01/64/1133960164.db2.gz RDKOEBBICHVWDB-GFCCVEGCSA-N 1 0 288.357 3.773 20 10 CHCDRO CC(C)(C)c1cc(Nc2cccc(O)c2O)cc[nH+]1 ZINC001213166645 1134433280 /nfs/dbraw/zinc/43/32/80/1134433280.db2.gz HTOKTAZRIFHDBN-UHFFFAOYSA-N 1 0 258.321 3.534 20 10 CHCDRO COc1cccc([C@@H]2CCC[N@@H+]2Cc2ccccc2O)c1 ZINC000179555284 1134549244 /nfs/dbraw/zinc/54/92/44/1134549244.db2.gz ZLVHYTJMEOQIIC-KRWDZBQOSA-N 1 0 283.371 3.738 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CCC[C@H]3CCCC[C@H]32)c1 ZINC000180306393 1134568273 /nfs/dbraw/zinc/56/82/73/1134568273.db2.gz JOULYICOAYOROI-CZUORRHYSA-N 1 0 275.392 3.555 20 10 CHCDRO COc1ccc(O)c(C[N@H+]2CC=C(c3ccccc3)CC2)c1 ZINC000183503163 1134660663 /nfs/dbraw/zinc/66/06/63/1134660663.db2.gz YHXDHQXQVDMKAS-UHFFFAOYSA-N 1 0 295.382 3.690 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CC[C@@H]2C[C@@H]2C1)c1ccc(N(C)C)cc1 ZINC000403375537 1134765294 /nfs/dbraw/zinc/76/52/94/1134765294.db2.gz NLSPAUHQUPRKTH-LCGIIJARSA-N 1 0 258.409 3.592 20 10 CHCDRO CC(C)O[C@@H]1CCC[N@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000404593850 1134948119 /nfs/dbraw/zinc/94/81/19/1134948119.db2.gz ZHOCXHRHMXBAQA-MRXNPFEDSA-N 1 0 299.414 3.935 20 10 CHCDRO C[C@H]1CC[N@H+](Cc2ccccc2)C[C@H]1Oc1ccc(N)cc1 ZINC001217967699 1135032522 /nfs/dbraw/zinc/03/25/22/1135032522.db2.gz UAGDOVWEJLHWBR-HNAYVOBHSA-N 1 0 296.414 3.558 20 10 CHCDRO CCC[C@@H](C)[C@@H](CC)Oc1ccc(N2CC[NH2+]CC2)cc1 ZINC001218439340 1135106307 /nfs/dbraw/zinc/10/63/07/1135106307.db2.gz SPFJDIQXZPLFJI-CRAIPNDOSA-N 1 0 290.451 3.690 20 10 CHCDRO COCC1(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)CCC1 ZINC000313857913 1135140988 /nfs/dbraw/zinc/14/09/88/1135140988.db2.gz IXFSHKGRWJRASN-UONOGXRCSA-N 1 0 289.419 3.655 20 10 CHCDRO C[C@H]([NH2+]CCc1ccncc1)c1ccc2ccccc2c1O ZINC000315211064 1135151593 /nfs/dbraw/zinc/15/15/93/1135151593.db2.gz SFEPKCALTJZPLE-AWEZNQCLSA-N 1 0 292.382 3.834 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1ccccn1)c1ccccc1O ZINC000020123560 171005150 /nfs/dbraw/zinc/00/51/50/171005150.db2.gz ZJASMSCGSHPGGK-OCCSQVGLSA-N 1 0 256.349 3.589 20 10 CHCDRO C[C@H]([NH2+]Cc1cccnc1)c1ccc2ccccc2c1O ZINC000020140788 171027719 /nfs/dbraw/zinc/02/77/19/171027719.db2.gz YJAVGXYYXPCKBV-ZDUSSCGKSA-N 1 0 278.355 3.791 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccccc1O ZINC000020146101 171032032 /nfs/dbraw/zinc/03/20/32/171032032.db2.gz MCUIQRQVXSEZEA-KRWDZBQOSA-N 1 0 284.403 3.699 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2CCCc3occc32)cc1 ZINC000020203831 171068197 /nfs/dbraw/zinc/06/81/97/171068197.db2.gz RKJNMSPELJCSSY-MRXNPFEDSA-N 1 0 270.376 3.513 20 10 CHCDRO Cc1cc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2)c(C)o1 ZINC000020439196 171202803 /nfs/dbraw/zinc/20/28/03/171202803.db2.gz FIVLISAVWLKNCV-CYBMUJFWSA-N 1 0 272.392 3.813 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)Cc2cccs2)cc1C ZINC000035254059 172083586 /nfs/dbraw/zinc/08/35/86/172083586.db2.gz PQKTYIKHFSDJTM-ZDUSSCGKSA-N 1 0 275.417 3.786 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2cccc(F)c2)c1 ZINC000035628987 172308987 /nfs/dbraw/zinc/30/89/87/172308987.db2.gz NNPZKPAEJLTURX-GFCCVEGCSA-N 1 0 259.324 3.691 20 10 CHCDRO C[C@@H]([NH2+]CC1CCC1)c1ccc2ccccc2c1O ZINC000037180092 173013113 /nfs/dbraw/zinc/01/31/13/173013113.db2.gz TURCJEWSAQXDKR-GFCCVEGCSA-N 1 0 255.361 3.996 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2CCC[C@H](C)C2)c1 ZINC000037254117 173065511 /nfs/dbraw/zinc/06/55/11/173065511.db2.gz NRIDADHARZCPOW-AVGNSLFASA-N 1 0 263.381 3.630 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCCOC1)c1ccc2ccccc2c1O ZINC000038044033 174051527 /nfs/dbraw/zinc/05/15/27/174051527.db2.gz DCWDXJCFMJODSX-ZIAGYGMSSA-N 1 0 285.387 3.623 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2cccc(O)c2)cc1 ZINC000154404877 261091262 /nfs/dbraw/zinc/09/12/62/261091262.db2.gz AWWXITNQTGOBHA-CQSZACIVSA-N 1 0 284.403 3.699 20 10 CHCDRO CC[C@H]([NH2+][C@H](COC)c1ccc(C)o1)c1ccccc1O ZINC000156179841 261116114 /nfs/dbraw/zinc/11/61/14/261116114.db2.gz VMVLJNJKIDYHSP-LSDHHAIUSA-N 1 0 289.375 3.722 20 10 CHCDRO CC[C@@H]([NH2+]CCC[C@H]1CCCCO1)c1ccccc1O ZINC000158115349 261158476 /nfs/dbraw/zinc/15/84/76/261158476.db2.gz AWYNCXORBDEHBF-GDBMZVCRSA-N 1 0 277.408 3.782 20 10 CHCDRO CCOCCCC[NH2+][C@H](CC)c1ccc(N(C)C)cc1 ZINC000165118332 261365386 /nfs/dbraw/zinc/36/53/86/261365386.db2.gz CBHTYLJZJKGUPG-QGZVFWFLSA-N 1 0 278.440 3.610 20 10 CHCDRO CC(=O)c1cc(F)cc(C[NH2+][C@H](C)c2cccs2)c1O ZINC000182552264 261943394 /nfs/dbraw/zinc/94/33/94/261943394.db2.gz VGRDXGGLJOWBIO-SECBINFHSA-N 1 0 293.363 3.646 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2[C@@H]3CCCO[C@@H]3C2(C)C)c1 ZINC000363849316 261965949 /nfs/dbraw/zinc/96/59/49/261965949.db2.gz GOQFMZOESMMNEM-CLROSIBMSA-N 1 0 289.419 3.555 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)c1cc(Cl)ccc1O)c1ccccn1 ZINC000184845508 262030443 /nfs/dbraw/zinc/03/04/43/262030443.db2.gz JSOIYQYCKJDTOH-QWRGUYRKSA-N 1 0 276.767 3.852 20 10 CHCDRO Cc1cc(C[NH2+][C@@H](C)c2cc(F)ccc2O)ccc1F ZINC000184911839 262033005 /nfs/dbraw/zinc/03/30/05/262033005.db2.gz OELIEMKXZJRRAK-NSHDSACASA-N 1 0 277.314 3.830 20 10 CHCDRO CCOc1ccccc1C[NH2+][C@H](C)c1ccc(C)cc1O ZINC000185103632 262041003 /nfs/dbraw/zinc/04/10/03/262041003.db2.gz PAHOPAYQEOSXKO-CQSZACIVSA-N 1 0 285.387 3.950 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc([C@H](C)O)cc2)c(O)c1 ZINC000185120302 262042866 /nfs/dbraw/zinc/04/28/66/262042866.db2.gz SLPVOQZRELCGNB-KBPBESRZSA-N 1 0 285.387 3.605 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC2(CCO)CCCCC2)c(O)c1 ZINC000185669515 262065494 /nfs/dbraw/zinc/06/54/94/262065494.db2.gz GUXYZPLHQJKTMA-HNNXBMFYSA-N 1 0 291.435 3.684 20 10 CHCDRO COC[C@H]([NH2+][C@H](C)c1cc(C)ccc1O)c1ccccc1 ZINC000186034338 262075984 /nfs/dbraw/zinc/07/59/84/262075984.db2.gz SMMQCZZMVQXTAN-PBHICJAKSA-N 1 0 285.387 3.739 20 10 CHCDRO COC[C@@H]([NH2+][C@@H](C)c1cc(C)ccc1O)c1ccccc1 ZINC000186034397 262076344 /nfs/dbraw/zinc/07/63/44/262076344.db2.gz SMMQCZZMVQXTAN-WMLDXEAASA-N 1 0 285.387 3.739 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](CCO)c1ccccc1)c1ccccc1O ZINC000186207805 262084423 /nfs/dbraw/zinc/08/44/23/262084423.db2.gz HSXDEFPATSDSEA-SJLPKXTDSA-N 1 0 299.414 3.599 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+][C@@H]1CCCc2sccc21 ZINC000185643097 262305114 /nfs/dbraw/zinc/30/51/14/262305114.db2.gz FSRJVTUPCVWPJF-CYBMUJFWSA-N 1 0 277.364 3.760 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCC(F)(F)C1)c1ccccc1O ZINC000281226266 263067424 /nfs/dbraw/zinc/06/74/24/263067424.db2.gz VJKPEQXCRUXUHS-AAEUAGOBSA-N 1 0 269.335 3.868 20 10 CHCDRO CC(C)([NH2+]Cc1cc(F)ccc1O)c1ccccc1F ZINC000292715480 263134349 /nfs/dbraw/zinc/13/43/49/263134349.db2.gz DPZDTMTWIIBVNW-UHFFFAOYSA-N 1 0 277.314 3.695 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@@H]1CCc3c1cccc3F)CC2 ZINC000297946388 263212756 /nfs/dbraw/zinc/21/27/56/263212756.db2.gz YJACGXTVUACNFI-HZPDHXFCSA-N 1 0 283.346 3.796 20 10 CHCDRO CC[C@@H]([NH2+]CC1(c2ccccn2)CCC1)c1ccccc1O ZINC000367604279 267104761 /nfs/dbraw/zinc/10/47/61/267104761.db2.gz ALOLYOGARFBMQF-MRXNPFEDSA-N 1 0 296.414 3.950 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC2(c3ccccn3)CCC2)c(O)c1 ZINC000367712811 267112160 /nfs/dbraw/zinc/11/21/60/267112160.db2.gz NRHOEKBSGLISME-HNNXBMFYSA-N 1 0 296.414 3.868 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1COc2ccc(C)cc21)c1ccccc1O ZINC000368369947 267166347 /nfs/dbraw/zinc/16/63/47/267166347.db2.gz IUIYJQSUVODHQF-CVEARBPZSA-N 1 0 283.371 3.875 20 10 CHCDRO CC[C@H]([NH2+][C@H]1COc2ccc(C)cc21)c1ccccc1O ZINC000368369948 267166373 /nfs/dbraw/zinc/16/63/73/267166373.db2.gz IUIYJQSUVODHQF-HOTGVXAUSA-N 1 0 283.371 3.875 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1COc2ccc(C)cc21)c1ccccc1O ZINC000368369950 267166461 /nfs/dbraw/zinc/16/64/61/267166461.db2.gz IUIYJQSUVODHQF-JKSUJKDBSA-N 1 0 283.371 3.875 20 10 CHCDRO COC[C@@H]([NH2+][C@@H](C)c1ccc(C)cc1O)c1ccc(C)o1 ZINC000185630849 327841652 /nfs/dbraw/zinc/84/16/52/327841652.db2.gz SLOMKYBQJJBJIL-DZGCQCFKSA-N 1 0 289.375 3.640 20 10 CHCDRO COCCC1(C[NH2+][C@H](C)c2ccc(C)cc2O)CCCC1 ZINC000185747994 327844200 /nfs/dbraw/zinc/84/42/00/327844200.db2.gz MMTSHVHZEWBART-OAHLLOKOSA-N 1 0 291.435 3.948 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CC3(CCC3)[C@@H]2C2CC2)c1O ZINC000291532405 328264785 /nfs/dbraw/zinc/26/47/85/328264785.db2.gz KJJKKWYCYXRZPQ-KRWDZBQOSA-N 1 0 287.403 3.555 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C)[C@@]1(C)CCCO1 ZINC000559901748 327270065 /nfs/dbraw/zinc/27/00/65/327270065.db2.gz FIAMFJRWTBPPMG-KBXCAEBGSA-N 1 0 286.419 3.534 20 10 CHCDRO C[C@@H]1Oc2ccccc2[C@H]1[NH2+]Cc1cc(Cl)ccc1O ZINC000377408002 329014339 /nfs/dbraw/zinc/01/43/39/329014339.db2.gz OHDFMOXIBNRVPJ-QFYYESIMSA-N 1 0 289.762 3.657 20 10 CHCDRO CC[C@H](c1ccccc1O)[NH+]1CCC(CCOC)CC1 ZINC000527936806 330298107 /nfs/dbraw/zinc/29/81/07/330298107.db2.gz RZQJKXBJAZDSLQ-MRXNPFEDSA-N 1 0 277.408 3.592 20 10 CHCDRO C[C@H]([NH2+][C@H]1[C@@H](C)[C@@H](C)O[C@H]1C)c1cc(Cl)ccc1O ZINC000528003895 330300326 /nfs/dbraw/zinc/30/03/26/330300326.db2.gz PBUSEUASCXHYLF-AOVQSLKQSA-N 1 0 283.799 3.508 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@@H](c1ccccn1)C1CCC1)CC2 ZINC000527969289 330301486 /nfs/dbraw/zinc/30/14/86/330301486.db2.gz SWOFYKQFMCQTNX-HNAYVOBHSA-N 1 0 294.398 3.906 20 10 CHCDRO CC[C@H]([NH2+][C@H]1[C@@H](C)[C@@H](C)O[C@H]1C)c1ccc(C)cc1O ZINC000528008985 330303697 /nfs/dbraw/zinc/30/36/97/330303697.db2.gz UWXLVSPUGDMGAA-OLFUQESBSA-N 1 0 277.408 3.553 20 10 CHCDRO CCCC[C@@H](COC)[NH2+]Cc1c(C)c2ccccc2n1C ZINC000475198955 331617589 /nfs/dbraw/zinc/61/75/89/331617589.db2.gz RYWOXUSTOLWAGU-HNNXBMFYSA-N 1 0 288.435 3.782 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(F)ccc1O)c1ccc(OC)cc1 ZINC000226582078 333265233 /nfs/dbraw/zinc/26/52/33/333265233.db2.gz RXJWVKPXUXFGOY-INIZCTEOSA-N 1 0 289.350 3.781 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1CCC[C@H]2C[C@H]21 ZINC000576651343 335231471 /nfs/dbraw/zinc/23/14/71/335231471.db2.gz ZZKUJACODRZETN-NUEKZKHPSA-N 1 0 268.404 3.765 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CC2(C)CCOCC2)cc1 ZINC000271563640 520287612 /nfs/dbraw/zinc/28/76/12/520287612.db2.gz YALMFPZYRLPZDW-HNNXBMFYSA-N 1 0 290.451 3.610 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2occc2C)cc1 ZINC000293694302 520289763 /nfs/dbraw/zinc/28/97/63/520289763.db2.gz NYIGJANEQUZDPO-AWEZNQCLSA-N 1 0 272.392 3.895 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]Cc2ccco2)cc1F ZINC000066906407 520908008 /nfs/dbraw/zinc/90/80/08/520908008.db2.gz PGXFCEHCPORUBI-UHFFFAOYSA-N 1 0 276.355 3.555 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H](C)Cc2cccs2)c1O ZINC000036992956 521369949 /nfs/dbraw/zinc/36/99/49/521369949.db2.gz LJLJLNGFWDISSI-LBPRGKRZSA-N 1 0 291.416 3.573 20 10 CHCDRO CCc1nc(C)c(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)o1 ZINC000291910815 522206576 /nfs/dbraw/zinc/20/65/76/522206576.db2.gz MUFVZHAWZXWDGA-VIFPVBQESA-N 1 0 294.782 3.755 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc2c(c1)OCO2)c1ccc(C)cc1O ZINC000280022063 522651722 /nfs/dbraw/zinc/65/17/22/522651722.db2.gz HLWMDDWYULWFRD-HNNXBMFYSA-N 1 0 299.370 3.670 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1[C@@H]2CCCO[C@H]2C1(C)C)c1ccccc1O ZINC000364363107 522728271 /nfs/dbraw/zinc/72/82/71/522728271.db2.gz NFNXGWYUKADYFJ-XJNFMUPTSA-N 1 0 289.419 3.637 20 10 CHCDRO CC[C@H]([NH2+][C@H](CCOC)c1ccco1)c1ccccc1O ZINC000274741734 522748566 /nfs/dbraw/zinc/74/85/66/522748566.db2.gz FLXBZCYUGZSUGU-LSDHHAIUSA-N 1 0 289.375 3.804 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCO[C@H](C(C)C)C1)c1ccccc1O ZINC000274930812 522756852 /nfs/dbraw/zinc/75/68/52/522756852.db2.gz QUTGWAOXVKXKTI-QRTARXTBSA-N 1 0 277.408 3.637 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CCOC(C)(C)C1)c1ccc(N(C)C)cc1 ZINC000119315116 522952557 /nfs/dbraw/zinc/95/25/57/522952557.db2.gz BGVVATZJULIKMS-DOTOQJQBSA-N 1 0 290.451 3.751 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@@H](c2ccccc2)C2CC2)c1 ZINC000037075041 524752274 /nfs/dbraw/zinc/75/22/74/524752274.db2.gz BORBHRIXPAEASO-SFHVURJKSA-N 1 0 283.371 3.642 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@H](c2ccccc2)C(C)C)c1 ZINC000036967209 524754471 /nfs/dbraw/zinc/75/44/71/524754471.db2.gz CEENPOVZVGOFHF-SFHVURJKSA-N 1 0 285.387 3.888 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@H](C)c2cc(C)sc2C)c1 ZINC000037122790 524756395 /nfs/dbraw/zinc/75/63/95/524756395.db2.gz KXVRSURSVHCOKB-LLVKDONJSA-N 1 0 291.416 3.930 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2ccsc2)c1 ZINC000061360737 524767654 /nfs/dbraw/zinc/76/76/54/524767654.db2.gz IVIFEZNDICHTPX-WDEREUQCSA-N 1 0 277.389 3.874 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2ccccc2OC(F)F)c1 ZINC000071406496 525351162 /nfs/dbraw/zinc/35/11/62/525351162.db2.gz MBVKKIAQEZDRIN-UHFFFAOYSA-N 1 0 293.313 3.592 20 10 CHCDRO C[C@@H]([NH2+]C1CC(F)(F)C1)c1ccc2ccccc2c1O ZINC000277018995 525394521 /nfs/dbraw/zinc/39/45/21/525394521.db2.gz CXWUDLHASLGBOO-SNVBAGLBSA-N 1 0 277.314 3.994 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCC(F)(F)C1)c1ccc(N(C)C)cc1 ZINC000281207776 525499292 /nfs/dbraw/zinc/49/92/92/525499292.db2.gz UBIGTTOLGCUXSO-OLZOCXBDSA-N 1 0 282.378 3.839 20 10 CHCDRO Cc1cc([C@H](C)[NH2+]Cc2ccccc2O)c(C)s1 ZINC000037122876 525523041 /nfs/dbraw/zinc/52/30/41/525523041.db2.gz UDZRITWHXBZYNQ-NSHDSACASA-N 1 0 261.390 3.921 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccco1 ZINC000037260260 525526607 /nfs/dbraw/zinc/52/66/07/525526607.db2.gz DFPUUASHODMLOD-CQSZACIVSA-N 1 0 270.376 3.731 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)c1cc(F)ccc1O)c1ccccc1 ZINC000094616545 525528199 /nfs/dbraw/zinc/52/81/99/525528199.db2.gz CYAKLAOOEDQXMZ-RYUDHWBXSA-N 1 0 259.324 3.943 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCCc2occc21)c1cc(F)ccc1O ZINC000094617007 525615176 /nfs/dbraw/zinc/61/51/76/525615176.db2.gz SOIPIERAOFOPDQ-HZMBPMFUSA-N 1 0 275.323 3.853 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2cc(C)ccc2O)cc1 ZINC000071408064 525730610 /nfs/dbraw/zinc/73/06/10/525730610.db2.gz OHDCUWRXUGFTHL-CQSZACIVSA-N 1 0 255.361 3.860 20 10 CHCDRO Cc1ccsc1C[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000094875243 525859065 /nfs/dbraw/zinc/85/90/65/525859065.db2.gz KDXIJHZRZQIPGX-JTQLQIEISA-N 1 0 265.353 3.752 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2COc3ccccc32)c(O)c1C ZINC000290334262 525922888 /nfs/dbraw/zinc/92/28/88/525922888.db2.gz OZYDGFKVKWKZBU-LSDHHAIUSA-N 1 0 297.398 3.836 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCC(F)(F)C2)c(O)c1 ZINC000281074184 525924161 /nfs/dbraw/zinc/92/41/61/525924161.db2.gz IOIMNMCHAAOMLS-RYUDHWBXSA-N 1 0 269.335 3.787 20 10 CHCDRO COc1cccc(C[NH2+][C@@H](c2ccccc2)C2CC2)c1O ZINC000037075288 526030974 /nfs/dbraw/zinc/03/09/74/526030974.db2.gz TZILYMBYOGNSKD-KRWDZBQOSA-N 1 0 283.371 3.642 20 10 CHCDRO C[C@H](c1ccco1)[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC000131021658 526144292 /nfs/dbraw/zinc/14/42/92/526144292.db2.gz HMKBFDVYAXKGPK-CYBMUJFWSA-N 1 0 258.365 3.539 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+][C@H]1CCc2ccccc21 ZINC000083551630 526365931 /nfs/dbraw/zinc/36/59/31/526365931.db2.gz URTDFRUKSAIXHN-HNNXBMFYSA-N 1 0 273.763 3.823 20 10 CHCDRO Oc1ccccc1C[NH2+][C@H]1CCSc2ccc(F)cc21 ZINC000036968442 526374848 /nfs/dbraw/zinc/37/48/48/526374848.db2.gz NEORMOCJWRMCGI-AWEZNQCLSA-N 1 0 289.375 3.858 20 10 CHCDRO CCC(CC)(C[NH2+][C@@H](C)c1ccccc1O)SC ZINC000228794981 1117791265 /nfs/dbraw/zinc/79/12/65/1117791265.db2.gz VMQMVZYEJHXQMN-LBPRGKRZSA-N 1 0 267.438 3.965 20 10 CHCDRO C[C@H]1CCCCC[N@@H+]1Cc1c(O)cccc1Cl ZINC000211443540 1118047824 /nfs/dbraw/zinc/04/78/24/1118047824.db2.gz UBYWENFTWGWBIV-NSHDSACASA-N 1 0 253.773 3.810 20 10 CHCDRO CSCCC[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000185490583 1120378248 /nfs/dbraw/zinc/37/82/48/1120378248.db2.gz JYOSWSYLELKRPY-GFCCVEGCSA-N 1 0 279.449 3.675 20 10 CHCDRO CC[C@H]([NH2+]CCCOC(C)(C)C)c1ccc(C)cc1O ZINC000850527474 1123282498 /nfs/dbraw/zinc/28/24/98/1123282498.db2.gz XTSOTUGXDSEFJB-HNNXBMFYSA-N 1 0 279.424 3.947 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCN1C(C)(C)C)c1cc(Cl)ccc1O ZINC000850480746 1123273438 /nfs/dbraw/zinc/27/34/38/1123273438.db2.gz DDFARENKMXIHQD-YPMHNXCESA-N 1 0 296.842 3.569 20 10 CHCDRO CC[C@H]([NH2+]C[C@]1(C)CC1(F)F)c1ccc(C)cc1O ZINC000850535729 1123286821 /nfs/dbraw/zinc/28/68/21/1123286821.db2.gz AFBAEYWOHQXQPY-JSGCOSHPSA-N 1 0 269.335 3.787 20 10 CHCDRO CCSC1(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)CC1 ZINC000850553477 1123290303 /nfs/dbraw/zinc/29/03/03/1123290303.db2.gz XBMXNOWVWUWEAT-CYBMUJFWSA-N 1 0 279.449 3.945 20 10 CHCDRO CC(C)C1CCC([NH2+]CCc2ccc(N)cc2)CC1 ZINC000841036508 1124111416 /nfs/dbraw/zinc/11/14/16/1124111416.db2.gz UAUGUSRIGYMGRE-UHFFFAOYSA-N 1 0 260.425 3.616 20 10 CHCDRO Cc1ccc(C[NH2+]C[C@@H]2CCCCC2(F)F)c(O)c1 ZINC000877555967 1125044053 /nfs/dbraw/zinc/04/40/53/1125044053.db2.gz HZUOVXWNPWMJCG-ZDUSSCGKSA-N 1 0 269.335 3.616 20 10 CHCDRO c1csc(SCCC[NH2+][C@H](C2CC2)C2CCC2)n1 ZINC000834592895 1131685837 /nfs/dbraw/zinc/68/58/37/1131685837.db2.gz FSBGUUYSYHNHFJ-ZDUSSCGKSA-N 1 0 282.478 3.794 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]Cc2cscc2C)c1O ZINC000846167214 1131692662 /nfs/dbraw/zinc/69/26/62/1131692662.db2.gz UKAKBCDJOGBQIL-LLVKDONJSA-N 1 0 277.389 3.622 20 10 CHCDRO COC1(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)CCCC1 ZINC000834814967 1131707601 /nfs/dbraw/zinc/70/76/01/1131707601.db2.gz RAJUXKPEDPZMJG-CQSZACIVSA-N 1 0 277.408 3.619 20 10 CHCDRO C[C@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)C1CCC1 ZINC000835042173 1131763029 /nfs/dbraw/zinc/76/30/29/1131763029.db2.gz RVSOKHDGFWDUST-GXMNPTEKSA-N 1 0 258.409 3.544 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CC=CCC1)c1ccc(N(C)C)cc1 ZINC000773001098 1131914447 /nfs/dbraw/zinc/91/44/47/1131914447.db2.gz NDOCELIJPDXPPV-WBVHZDCISA-N 1 0 258.409 3.902 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]C1CCC(C(F)F)CC1 ZINC000839179276 1132188771 /nfs/dbraw/zinc/18/87/71/1132188771.db2.gz IRVXFUQZFFJJPH-UHFFFAOYSA-N 1 0 289.753 3.959 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH+]1CC2CCC(CC2)C1 ZINC001203664818 1133351005 /nfs/dbraw/zinc/35/10/05/1133351005.db2.gz XEUSISFKEOSXSQ-UHFFFAOYSA-N 1 0 265.784 3.668 20 10 CHCDRO Oc1ccccc1C[NH2+]CCCCc1ccccc1 ZINC000134225812 1125544555 /nfs/dbraw/zinc/54/45/55/1125544555.db2.gz DXIUXPBHIUHRRG-UHFFFAOYSA-N 1 0 255.361 3.505 20 10 CHCDRO CC[C@H](C)[NH2+][C@H](C)c1ccc(Br)cc1O ZINC000134907022 1125569927 /nfs/dbraw/zinc/56/99/27/1125569927.db2.gz LNKNZSJWWUEJPU-DTWKUNHWSA-N 1 0 272.186 3.604 20 10 CHCDRO CCCc1ncc(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)o1 ZINC000841753372 1125583361 /nfs/dbraw/zinc/58/33/61/1125583361.db2.gz HHUOOUVXSGXCRJ-JTQLQIEISA-N 1 0 294.782 3.837 20 10 CHCDRO C[C@H]1CC[C@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC000135147741 1125580193 /nfs/dbraw/zinc/58/01/93/1125580193.db2.gz NPAIESKTJBLRKC-HOCLYGCPSA-N 1 0 258.409 3.565 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCCSC2)cc1 ZINC000135699298 1125595282 /nfs/dbraw/zinc/59/52/82/1125595282.db2.gz AXXSJNKOFXMRNT-OAHLLOKOSA-N 1 0 278.465 3.518 20 10 CHCDRO CC[C@@H]1CCCCC[N@@H+]1Cc1cc(OC)ccc1O ZINC000135749518 1125596621 /nfs/dbraw/zinc/59/66/21/1125596621.db2.gz ZHYNOVLRPHTAEQ-CQSZACIVSA-N 1 0 263.381 3.555 20 10 CHCDRO C[C@@H]([NH2+]CCC1(O)CCC1)c1ccc2ccccc2c1O ZINC000284287187 1125691356 /nfs/dbraw/zinc/69/13/56/1125691356.db2.gz HXQGEJGHMHSROS-CYBMUJFWSA-N 1 0 285.387 3.501 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CCCCCOC)cc1 ZINC000122652982 1125789017 /nfs/dbraw/zinc/78/90/17/1125789017.db2.gz WTMZWFICGCKCEL-HNNXBMFYSA-N 1 0 278.440 3.610 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCSC[C@@H]2C)cc1C(C)C ZINC000738284019 1129391960 /nfs/dbraw/zinc/39/19/60/1129391960.db2.gz IMKKLVQPILPYGC-ZDUSSCGKSA-N 1 0 279.449 3.761 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H](C)CCSC)cc1F ZINC000740007499 1129408656 /nfs/dbraw/zinc/40/86/56/1129408656.db2.gz SVXNRDCCEAAEAM-CYBMUJFWSA-N 1 0 298.471 3.903 20 10 CHCDRO CC[N@@H+](Cc1cc2c(cc1O)CCCC2)CC1CC1 ZINC000768444398 1129857678 /nfs/dbraw/zinc/85/76/78/1129857678.db2.gz ATWZVBWPTRQNFM-UHFFFAOYSA-N 1 0 259.393 3.503 20 10 CHCDRO CC[C@@H]([NH2+]CC[C@@H]1CCCC[C@@H]1O)c1ccc(C)cc1O ZINC000903261983 1126799264 /nfs/dbraw/zinc/79/92/64/1126799264.db2.gz AKSNFOZJVZJDSN-UAGQMJEPSA-N 1 0 291.435 3.683 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)c2ccccc2O)cc1Cl ZINC000179889352 1126836117 /nfs/dbraw/zinc/83/61/17/1126836117.db2.gz QBOAQYLTYKYSJF-LLVKDONJSA-N 1 0 291.778 3.905 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCc2cc(F)ccc21)c1ccccc1O ZINC000183466075 1126887395 /nfs/dbraw/zinc/88/73/95/1126887395.db2.gz LDOXOMPBHXQCNG-BDJLRTHQSA-N 1 0 271.335 3.869 20 10 CHCDRO C[C@H]([NH2+]CCCc1nc2ccccc2[nH]1)c1ccccc1O ZINC000183450528 1126888059 /nfs/dbraw/zinc/88/80/59/1126888059.db2.gz GDBCAHGDHAVDEY-ZDUSSCGKSA-N 1 0 295.386 3.552 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](C)[C@@H](C)c2ccncc2)cc1C ZINC000183705524 1126890877 /nfs/dbraw/zinc/89/08/77/1126890877.db2.gz NIDKJNXLXNNGLX-AWEZNQCLSA-N 1 0 270.376 3.597 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1ccc(C)cc1O)c1ccncc1 ZINC000185541519 1126900659 /nfs/dbraw/zinc/90/06/59/1126900659.db2.gz FRVODIXBXOMUFR-XJKSGUPXSA-N 1 0 270.376 3.898 20 10 CHCDRO COc1ccc(F)cc1C[NH2+][C@H](C)c1ccc(C)cc1O ZINC000187596924 1126911873 /nfs/dbraw/zinc/91/18/73/1126911873.db2.gz BIQNXPJNHNYTAJ-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO CCOC(C)(C)C[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000188686570 1126925493 /nfs/dbraw/zinc/92/54/93/1126925493.db2.gz NFONEUHNJJMOBV-SNVBAGLBSA-N 1 0 271.788 3.511 20 10 CHCDRO Oc1ccccc1C[NH+]1CCC(OC2CCCCC2)CC1 ZINC000271259959 1127074386 /nfs/dbraw/zinc/07/43/86/1127074386.db2.gz IEKYPSRBOOPWJO-UHFFFAOYSA-N 1 0 289.419 3.706 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](OC)C1CC1)c1cc(Cl)ccc1O ZINC000815651268 1131017941 /nfs/dbraw/zinc/01/79/41/1131017941.db2.gz OVSYPNZUPXOXHW-HIFRSBDPSA-N 1 0 283.799 3.511 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H]2CCO[C@@H](C)C2)cc1 ZINC000271639874 1127095626 /nfs/dbraw/zinc/09/56/26/1127095626.db2.gz ZOFJTRWQCGCUMC-HRCADAONSA-N 1 0 290.451 3.608 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCc2c1cccc2F)c1ccccc1O ZINC000271669742 1127096570 /nfs/dbraw/zinc/09/65/70/1127096570.db2.gz MYOAYXJYXLVLKM-ZBEGNZNMSA-N 1 0 271.335 3.869 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCc2c1cccc2F)c1ccccc1O ZINC000271669733 1127096756 /nfs/dbraw/zinc/09/67/56/1127096756.db2.gz MYOAYXJYXLVLKM-BDJLRTHQSA-N 1 0 271.335 3.869 20 10 CHCDRO Cc1cc(O)c(C[NH+]2C3CCC2CC3)cc1C(C)C ZINC000912786820 1127111992 /nfs/dbraw/zinc/11/19/92/1127111992.db2.gz SHDMABWTFOXCOX-UHFFFAOYSA-N 1 0 259.393 3.951 20 10 CHCDRO C[N@@H+](Cc1cc2c(cc1O)CCC2)CC1CCCCC1 ZINC000912787320 1127112870 /nfs/dbraw/zinc/11/28/70/1127112870.db2.gz GAAOOBYDSZMRBO-UHFFFAOYSA-N 1 0 273.420 3.893 20 10 CHCDRO Oc1ccc(F)c(Cl)c1C[NH+]1CC2(C1)CCCCC2 ZINC001237127584 1131053987 /nfs/dbraw/zinc/05/39/87/1131053987.db2.gz DGKURNBQIHQLAG-UHFFFAOYSA-N 1 0 283.774 3.951 20 10 CHCDRO c1csc(S[C@H]2CC[N@@H+](Cc3ccccc3)C2)n1 ZINC000283109458 1127122584 /nfs/dbraw/zinc/12/25/84/1127122584.db2.gz RTULAASIFJEUJK-ZDUSSCGKSA-N 1 0 276.430 3.510 20 10 CHCDRO CC[N@H+](Cc1cc(C(F)(F)F)ccc1O)C(C)C ZINC001237134843 1131056993 /nfs/dbraw/zinc/05/69/93/1131056993.db2.gz DHYZCGQVUKBMNZ-UHFFFAOYSA-N 1 0 261.287 3.641 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H](CC)CC(F)(F)F)c1O ZINC000760651142 1127144837 /nfs/dbraw/zinc/14/48/37/1127144837.db2.gz BCUXVLXLRAXZST-NSHDSACASA-N 1 0 291.313 3.612 20 10 CHCDRO CC[C@H](CC(F)(F)F)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000760659627 1127153082 /nfs/dbraw/zinc/15/30/82/1127153082.db2.gz MXPSYAUDDWHYDX-GFCCVEGCSA-N 1 0 274.330 3.573 20 10 CHCDRO CC[C@H](CC(F)(F)F)[NH2+]Cc1cc(C)ccc1O ZINC000760658430 1127151179 /nfs/dbraw/zinc/15/11/79/1127151179.db2.gz LREDNBVXHITEPJ-LLVKDONJSA-N 1 0 261.287 3.521 20 10 CHCDRO Cc1cc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCO3)c(C)o1 ZINC000044729991 1127159111 /nfs/dbraw/zinc/15/91/11/1127159111.db2.gz ANKSIFLCQQAFFZ-GFCCVEGCSA-N 1 0 271.360 3.682 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](C)Oc1ccccc1)c1ccccc1O ZINC000156588301 1127160112 /nfs/dbraw/zinc/16/01/12/1127160112.db2.gz RSSOXHWJIAWPHC-PBHICJAKSA-N 1 0 285.387 3.900 20 10 CHCDRO C[C@H]1C[N@H+](Cc2ccc(OCc3ccccc3)cc2O)[C@H]1C ZINC000816648270 1131119119 /nfs/dbraw/zinc/11/91/19/1131119119.db2.gz HZDLMLRHTGBFIL-GJZGRUSLSA-N 1 0 297.398 3.811 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CC[C@H]2CCCCO2)c(O)c1 ZINC000285400524 1127225973 /nfs/dbraw/zinc/22/59/73/1127225973.db2.gz XCWSSHWPMHQOIJ-LSDHHAIUSA-N 1 0 277.408 3.619 20 10 CHCDRO CC[C@H]1CC[C@H]1[NH2+]Cc1c(C)c2ccccc2n1C ZINC000572790621 1127227217 /nfs/dbraw/zinc/22/72/17/1127227217.db2.gz GSMAOXKOUAESRK-DZGCQCFKSA-N 1 0 256.393 3.765 20 10 CHCDRO Cc1cc(F)cc(C[NH+]2[C@@H](C)CCC[C@@H]2C)c1O ZINC001238059041 1131164900 /nfs/dbraw/zinc/16/49/00/1131164900.db2.gz ZCPRGHWEVAKWQB-RYUDHWBXSA-N 1 0 251.345 3.603 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CC=CCC1)c1ccc(N(C)C)cc1 ZINC000045629132 1127260701 /nfs/dbraw/zinc/26/07/01/1127260701.db2.gz SUFXUJIXKODHGF-LSDHHAIUSA-N 1 0 258.409 3.760 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCCSC1)c1cc(Cl)ccc1O ZINC000287045596 1127283782 /nfs/dbraw/zinc/28/37/82/1127283782.db2.gz MOIVBBDHGDMGQQ-WDEREUQCSA-N 1 0 285.840 3.839 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCCSC1)c1cc(Cl)ccc1O ZINC000287045585 1127283960 /nfs/dbraw/zinc/28/39/60/1127283960.db2.gz MOIVBBDHGDMGQQ-GHMZBOCLSA-N 1 0 285.840 3.839 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCOC[C@H]1C)c1ccc2ccccc2c1O ZINC000287373503 1127302203 /nfs/dbraw/zinc/30/22/03/1127302203.db2.gz HYDATGNFFWOVES-YCPHGPKFSA-N 1 0 299.414 3.869 20 10 CHCDRO CC(C)[C@@H]1CCCC[C@H]1[NH2+]CCc1ccc(N)cc1 ZINC000817955988 1131190178 /nfs/dbraw/zinc/19/01/78/1131190178.db2.gz MYZWCXYMBYBJJR-DLBZAZTESA-N 1 0 260.425 3.616 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)CCOc2ccccc2)cc1C ZINC000058592863 1127362441 /nfs/dbraw/zinc/36/24/41/1127362441.db2.gz FSHICZHVFISOBT-UHFFFAOYSA-N 1 0 285.387 3.520 20 10 CHCDRO CC1(C)C[C@@H]1C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000226257291 1127387494 /nfs/dbraw/zinc/38/74/94/1127387494.db2.gz PHRTYEQLLMKVDW-MRXNPFEDSA-N 1 0 272.436 3.813 20 10 CHCDRO CC[C@H]1CCCCC[N@@H+]1Cc1cc(F)ccc1O ZINC000226565440 1127411506 /nfs/dbraw/zinc/41/15/06/1127411506.db2.gz JHVBRHNUDHHQGY-AWEZNQCLSA-N 1 0 251.345 3.686 20 10 CHCDRO CC(C)(C[NH2+]Cc1cc(F)ccc1O)c1cccs1 ZINC000226609339 1127412249 /nfs/dbraw/zinc/41/22/49/1127412249.db2.gz IHKJQCGFFUAYKW-UHFFFAOYSA-N 1 0 279.380 3.660 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@H]1CCCc3occc31)CC2 ZINC000295901238 1129219559 /nfs/dbraw/zinc/21/95/59/1129219559.db2.gz IRFGTYZUKNYTPM-UONOGXRCSA-N 1 0 269.344 3.640 20 10 CHCDRO CC[C@H]([NH2+]Cc1cccc(C)c1O)c1ccccc1OC ZINC000158102300 1127436776 /nfs/dbraw/zinc/43/67/76/1127436776.db2.gz KDBQHLSURXOBGJ-INIZCTEOSA-N 1 0 285.387 3.950 20 10 CHCDRO CCOc1cccc(C[NH2+]C[C@@H]2CCC[C@H](C)C2)c1O ZINC000227439790 1127478180 /nfs/dbraw/zinc/47/81/80/1127478180.db2.gz LAXUEEANEQXDLN-UONOGXRCSA-N 1 0 277.408 3.707 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CC[C@H](C)[C@@H](C)C2)c1O ZINC000169084356 1127482793 /nfs/dbraw/zinc/48/27/93/1127482793.db2.gz KUUJYUUAPIHUAC-QWRGUYRKSA-N 1 0 283.799 3.532 20 10 CHCDRO CC[C@H]([NH2+]CC1CC(F)(F)C1)c1ccc(C)cc1O ZINC000293632522 1127509989 /nfs/dbraw/zinc/50/99/89/1127509989.db2.gz KFUXOBJENMNPPI-ZDUSSCGKSA-N 1 0 269.335 3.787 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccc(C)nc2)c(O)c1 ZINC000293804440 1127522061 /nfs/dbraw/zinc/52/20/61/1127522061.db2.gz RGPZJVBPAWYNGR-CQSZACIVSA-N 1 0 270.376 3.563 20 10 CHCDRO Cc1ncc(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)s1 ZINC000293882831 1127530154 /nfs/dbraw/zinc/53/01/54/1127530154.db2.gz VMEYWMUGFXSSFH-LLVKDONJSA-N 1 0 276.405 3.625 20 10 CHCDRO CC[C@@H]([NH2+]CCC1(COC)CCC1)c1ccc(C)cc1O ZINC000293848059 1127525513 /nfs/dbraw/zinc/52/55/13/1127525513.db2.gz YEGCHPZRDXGLTH-MRXNPFEDSA-N 1 0 291.435 3.948 20 10 CHCDRO CC[C@H](CC(F)(F)F)[NH2+]Cc1cccc(Cl)c1[O-] ZINC000761228187 1127553222 /nfs/dbraw/zinc/55/32/22/1127553222.db2.gz JDUZUMMXWLOPBW-SECBINFHSA-N 1 0 281.705 3.866 20 10 CHCDRO CC[C@@H]([NH2+]CCc1cc(F)cc(F)c1)c1ccccc1O ZINC000060717525 1127565257 /nfs/dbraw/zinc/56/52/57/1127565257.db2.gz XBPUVTAEWATJOQ-MRXNPFEDSA-N 1 0 291.341 3.954 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CCO[C@H](C3CC3)C2)c(O)c1 ZINC000294343926 1127566208 /nfs/dbraw/zinc/56/62/08/1127566208.db2.gz PNRDBDTZMOZXHN-LXZKKBNFSA-N 1 0 289.419 3.617 20 10 CHCDRO COc1cc(Cl)cc(C[NH+]2C[C@H](C)C[C@@H](C)C2)c1O ZINC000228561336 1127567308 /nfs/dbraw/zinc/56/73/08/1127567308.db2.gz FKUFGNCZJQGVPD-GHMZBOCLSA-N 1 0 283.799 3.532 20 10 CHCDRO COc1cc(Cl)cc(C[N@H+]2C[C@H](C)C[C@H](C)C2)c1O ZINC000228561328 1127567721 /nfs/dbraw/zinc/56/77/21/1127567721.db2.gz FKUFGNCZJQGVPD-PHIMTYICSA-N 1 0 283.799 3.532 20 10 CHCDRO C[C@@H]1C[C@@H]([NH2+]Cc2cc(F)ccc2O)c2ccccc2O1 ZINC000295098735 1127620612 /nfs/dbraw/zinc/62/06/12/1127620612.db2.gz SMCDEDMZCYJPKR-IAQYHMDHSA-N 1 0 287.334 3.533 20 10 CHCDRO CC(C)Oc1ccccc1C[NH2+][C@H]1CCc2cccc(O)c21 ZINC000296028846 1127661165 /nfs/dbraw/zinc/66/11/65/1127661165.db2.gz PZRSEYNYGHPIBP-INIZCTEOSA-N 1 0 297.398 3.957 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1C[C@@H](C)Oc2ccccc21)c1ccccc1O ZINC000296262057 1127667041 /nfs/dbraw/zinc/66/70/41/1127667041.db2.gz DHWCZCIGFIDKBN-XJKCOSOUSA-N 1 0 283.371 3.955 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]CCc1ccc3[nH]ccc3c1)CC2 ZINC000296351346 1127669476 /nfs/dbraw/zinc/66/94/76/1127669476.db2.gz HMFWPBWVKXXXFX-QGZVFWFLSA-N 1 0 292.382 3.693 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]Cc1ccc(Cl)cc1F)CC2 ZINC000296409353 1127670854 /nfs/dbraw/zinc/67/08/54/1127670854.db2.gz KVFRRFHFSFVPCZ-CQSZACIVSA-N 1 0 291.753 3.962 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CCc2ncccc2C)c(O)c1 ZINC000296575529 1127676807 /nfs/dbraw/zinc/67/68/07/1127676807.db2.gz TZFWMKZBJUTQAA-OAHLLOKOSA-N 1 0 284.403 3.606 20 10 CHCDRO C[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3cccc(O)c32)c2ccccc2O1 ZINC000296658041 1127681056 /nfs/dbraw/zinc/68/10/56/1127681056.db2.gz ZMMHMXLNFWCFPT-DAXOMENPSA-N 1 0 295.382 3.881 20 10 CHCDRO COCCC1(C[NH2+][C@H]2CCc3cccc(O)c32)CCCC1 ZINC000296854389 1127683972 /nfs/dbraw/zinc/68/39/72/1127683972.db2.gz NIBPONKBOZWBER-HNNXBMFYSA-N 1 0 289.419 3.566 20 10 CHCDRO CC[C@H]([NH2+]CCc1ncccc1C)c1ccc(C)cc1O ZINC000296628749 1127679464 /nfs/dbraw/zinc/67/94/64/1127679464.db2.gz XHFUPWGIMCJCMQ-INIZCTEOSA-N 1 0 284.403 3.687 20 10 CHCDRO CC(C)(C)[C@@H]1C[C@@H]([NH2+][C@H]2CCc3cccc(O)c32)CCO1 ZINC000296890496 1127685227 /nfs/dbraw/zinc/68/52/27/1127685227.db2.gz ONXJFQXHHGPLMG-DZKIICNBSA-N 1 0 289.419 3.563 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1ccccc1[N+](=O)[O-] ZINC000296920024 1127685756 /nfs/dbraw/zinc/68/57/56/1127685756.db2.gz PPSSNAVVXYVWCS-SMDDNHRTSA-N 1 0 298.342 3.639 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)c1ccccc1O)c1ccc([N+](=O)[O-])cc1 ZINC000297311838 1127693404 /nfs/dbraw/zinc/69/34/04/1127693404.db2.gz MXZNIKJCZRXNCR-RYUDHWBXSA-N 1 0 286.331 3.712 20 10 CHCDRO COc1ccc(C[NH2+]CCCCCSC)cc1C ZINC000229518746 1127693864 /nfs/dbraw/zinc/69/38/64/1127693864.db2.gz ULBZWTIPKZAMME-UHFFFAOYSA-N 1 0 267.438 3.627 20 10 CHCDRO CC[C@@H]([NH2+]CCC(C)(F)F)c1ccc(C)cc1O ZINC000297422883 1127695882 /nfs/dbraw/zinc/69/58/82/1127695882.db2.gz UVMAEXZICVCYED-GFCCVEGCSA-N 1 0 257.324 3.787 20 10 CHCDRO C[N@H+](Cc1nc2ccccc2s1)Cc1ccccc1O ZINC000171925916 1127734303 /nfs/dbraw/zinc/73/43/03/1127734303.db2.gz TXTRAZXVELBMKQ-UHFFFAOYSA-N 1 0 284.384 3.634 20 10 CHCDRO CCC(CC)(C[NH2+][C@@H](C)c1cc(OC)ccc1O)SC ZINC000230664761 1127771901 /nfs/dbraw/zinc/77/19/01/1127771901.db2.gz NHHAMZVJGQKXSI-LBPRGKRZSA-N 1 0 297.464 3.973 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2OCCc3ccccc32)c(O)c1 ZINC000371869988 1127782372 /nfs/dbraw/zinc/78/23/72/1127782372.db2.gz MCBKKAJLNJRQMK-AUUYWEPGSA-N 1 0 297.398 3.665 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]CC2CCC(C)CC2)c1 ZINC000063144406 1127798649 /nfs/dbraw/zinc/79/86/49/1127798649.db2.gz IHNIIGUQMYWVDE-ROKHWSDSSA-N 1 0 277.408 3.878 20 10 CHCDRO Cc1ccc2c(c1)[C@@H]([NH2+][C@H](C)c1cc(C)ccc1O)CO2 ZINC000373265106 1127830938 /nfs/dbraw/zinc/83/09/38/1127830938.db2.gz IDFLYKXCPCBUSJ-CJNGLKHVSA-N 1 0 283.371 3.793 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@]2(C)CCO[C@H]2C2CC2)c1 ZINC000373344497 1127835483 /nfs/dbraw/zinc/83/54/83/1127835483.db2.gz BAABVPALLSJTMR-DOPJRALCSA-N 1 0 289.419 3.556 20 10 CHCDRO C[C@@H](CC(F)(F)F)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000231790914 1127854057 /nfs/dbraw/zinc/85/40/57/1127854057.db2.gz LDRSGJIHBGMWLK-QWRGUYRKSA-N 1 0 274.330 3.744 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCS[C@H](c2ccccc2)C1 ZINC000374260488 1127881999 /nfs/dbraw/zinc/88/19/99/1127881999.db2.gz WGKCUTYBZHCLFV-KRWDZBQOSA-N 1 0 285.412 3.682 20 10 CHCDRO CC[C@@H]([NH2+]CC1(COC)CCC1)c1ccc(C)cc1O ZINC000800493194 1127900516 /nfs/dbraw/zinc/90/05/16/1127900516.db2.gz JGKZCECBYUXASS-OAHLLOKOSA-N 1 0 277.408 3.558 20 10 CHCDRO CCC[C@@H](CCO)C[NH2+][C@H](CC)c1ccc(N(C)C)cc1 ZINC000152473979 1128127471 /nfs/dbraw/zinc/12/74/71/1128127471.db2.gz TYKWSQWODQCOLV-MAUKXSAKSA-N 1 0 292.467 3.592 20 10 CHCDRO CC[C@](C)(CCO)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000761973248 1128257894 /nfs/dbraw/zinc/25/78/94/1128257894.db2.gz KPFZCJHQFILTRK-LJQANCHMSA-N 1 0 299.414 3.700 20 10 CHCDRO CC[C@H]([NH2+]C[C@]12CCC[C@H]1OCC2)c1ccc(C)cc1O ZINC000926917220 1128202693 /nfs/dbraw/zinc/20/26/93/1128202693.db2.gz YTTHSCXIEPWPLU-CGTJXYLNSA-N 1 0 289.419 3.701 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CC(C)(C)OC2(C)C)c(O)c1 ZINC000927101530 1128217308 /nfs/dbraw/zinc/21/73/08/1128217308.db2.gz NSYKZECQUGWPRC-KGLIPLIRSA-N 1 0 291.435 3.945 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC[C@H]2CCC3(CCC3)O2)c(O)c1 ZINC000927128865 1128220765 /nfs/dbraw/zinc/22/07/65/1128220765.db2.gz MZUZQGZIZDTFIB-LSDHHAIUSA-N 1 0 289.419 3.843 20 10 CHCDRO C[C@@H](Cc1cccc(F)c1)[N@H+](C)Cc1ccccc1O ZINC000777824872 1128288407 /nfs/dbraw/zinc/28/84/07/1128288407.db2.gz JMIXBSZHKDOZAM-ZDUSSCGKSA-N 1 0 273.351 3.594 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCOC[C@@H]1C)c1cc(Cl)ccc1O ZINC000762650714 1128312939 /nfs/dbraw/zinc/31/29/39/1128312939.db2.gz RJKYXXXICACUCT-BPNCWPANSA-N 1 0 283.799 3.511 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCOC[C@@H]1C)c1cc(Cl)ccc1O ZINC000762650720 1128313228 /nfs/dbraw/zinc/31/32/28/1128313228.db2.gz RJKYXXXICACUCT-LEWSCRJBSA-N 1 0 283.799 3.511 20 10 CHCDRO Cc1ccccc1CC[NH2+]Cc1cc(Cl)ccc1O ZINC000112016827 1128442885 /nfs/dbraw/zinc/44/28/85/1128442885.db2.gz HVMIKSRWGSVGDA-UHFFFAOYSA-N 1 0 275.779 3.686 20 10 CHCDRO c1ccc(C2(C[NH2+]Cc3ccc4c(c3)CCO4)CCC2)cc1 ZINC000917394170 1128497225 /nfs/dbraw/zinc/49/72/25/1128497225.db2.gz UVDQJIRXKVWZEZ-UHFFFAOYSA-N 1 0 293.410 3.833 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccccc1OC)c1ccccc1O ZINC000154878112 1128586403 /nfs/dbraw/zinc/58/64/03/1128586403.db2.gz KAAQRVPQTXCHOG-MRXNPFEDSA-N 1 0 285.387 3.684 20 10 CHCDRO Cc1cccc(OCC[NH2+][C@@H](C)c2cc(C)ccc2O)c1 ZINC000042895920 1128589101 /nfs/dbraw/zinc/58/91/01/1128589101.db2.gz HZDMIDPIQLPVIK-HNNXBMFYSA-N 1 0 285.387 3.739 20 10 CHCDRO CC[C@H]([NH2+]CCOc1ccccc1)c1ccccc1O ZINC000042895504 1128589388 /nfs/dbraw/zinc/58/93/88/1128589388.db2.gz ZRFYWCGCCQFETD-INIZCTEOSA-N 1 0 271.360 3.512 20 10 CHCDRO Cc1cccc(OCC[NH2+][C@@H](C)c2ccc(C)cc2O)c1 ZINC000042895944 1128589407 /nfs/dbraw/zinc/58/94/07/1128589407.db2.gz ZZUOHQVNPOOOBM-HNNXBMFYSA-N 1 0 285.387 3.739 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCc2ccccc2O)cc1 ZINC000154932678 1128598203 /nfs/dbraw/zinc/59/82/03/1128598203.db2.gz DOCXBESCVNUBRG-OAHLLOKOSA-N 1 0 298.430 3.742 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccccc1O)c1ccc(N(C)C)cc1 ZINC000154961512 1128605200 /nfs/dbraw/zinc/60/52/00/1128605200.db2.gz ZPZOSJKXCROUMZ-SFHVURJKSA-N 1 0 298.430 3.742 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)cc1C ZINC000155396976 1128605414 /nfs/dbraw/zinc/60/54/14/1128605414.db2.gz YPRWRWQAXBLTHD-HNNXBMFYSA-N 1 0 298.430 3.920 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)Cc1ccc(O)cc1)c1ccccc1O ZINC000155668821 1128610609 /nfs/dbraw/zinc/61/06/09/1128610609.db2.gz GVXNRXFZMBCYGZ-CXAGYDPISA-N 1 0 285.387 3.770 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CC[C@H](Cc2ccccc2)C1 ZINC000778995543 1128674777 /nfs/dbraw/zinc/67/47/77/1128674777.db2.gz BIVYPFZXWZREFX-OAHLLOKOSA-N 1 0 285.362 3.596 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)[C@H]2CCc3ccccc32)cc1 ZINC000920258685 1128674988 /nfs/dbraw/zinc/67/49/88/1128674988.db2.gz VRMCTBUSPGCPMP-IBGZPJMESA-N 1 0 280.415 3.872 20 10 CHCDRO CC(C)CC[N@H+](Cc1cc(F)ccc1O)C1CC1 ZINC000778996059 1128675487 /nfs/dbraw/zinc/67/54/87/1128675487.db2.gz LGUUEZKAGKXUOU-UHFFFAOYSA-N 1 0 251.345 3.542 20 10 CHCDRO CC[N@H+](Cc1ccccc1C)Cc1cc(F)ccc1O ZINC000778996364 1128675539 /nfs/dbraw/zinc/67/55/39/1128675539.db2.gz MLERKTQCCRBLAR-UHFFFAOYSA-N 1 0 273.351 3.862 20 10 CHCDRO Cc1cc(Br)cc([C@H](C)[NH2+]C[C@H]2C[C@@H]2C)c1O ZINC000779008555 1128676724 /nfs/dbraw/zinc/67/67/24/1128676724.db2.gz RIEOPKAHLLHLJL-INTQDDNPSA-N 1 0 298.224 3.770 20 10 CHCDRO CC(C)(C)[C@H]1CCC[N@@H+]1Cc1cc(F)ccc1O ZINC000779010361 1128676884 /nfs/dbraw/zinc/67/68/84/1128676884.db2.gz ULETZOWZSBQRCV-CQSZACIVSA-N 1 0 251.345 3.542 20 10 CHCDRO C[C@H](C[N@H+](C)Cc1cc(F)ccc1O)c1ccccc1 ZINC000779009926 1128677135 /nfs/dbraw/zinc/67/71/35/1128677135.db2.gz QSWZWOCNPONDEY-CYBMUJFWSA-N 1 0 273.351 3.767 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CC[C@H](c2ccccc2F)C1 ZINC000779017804 1128680445 /nfs/dbraw/zinc/68/04/45/1128680445.db2.gz XRPZIUQFVIMCCS-LBPRGKRZSA-N 1 0 289.325 3.660 20 10 CHCDRO CC(C)[C@H](Cc1ccccc1)[NH2+]Cc1ccccc1O ZINC000779016989 1128681709 /nfs/dbraw/zinc/68/17/09/1128681709.db2.gz JCKIEHVRICUXET-KRWDZBQOSA-N 1 0 269.388 3.749 20 10 CHCDRO COc1ccc(C2CC[NH+](Cc3ccccc3O)CC2)cc1 ZINC000779016824 1128681860 /nfs/dbraw/zinc/68/18/60/1128681860.db2.gz UDWOVQQNNUADAW-UHFFFAOYSA-N 1 0 297.398 3.780 20 10 CHCDRO C[C@@H]1[C@@H](Cc2ccccc2)CC[N@@H+]1Cc1ccccc1O ZINC000779023635 1128685787 /nfs/dbraw/zinc/68/57/87/1128685787.db2.gz VBNDPCGKZVPGRG-NVXWUHKLSA-N 1 0 281.399 3.845 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CCCC12CCCCC2 ZINC000779023449 1128686336 /nfs/dbraw/zinc/68/63/36/1128686336.db2.gz SEUSURGVYURNKL-UHFFFAOYSA-N 1 0 263.356 3.830 20 10 CHCDRO Oc1ccccc1C[NH2+][C@H]1CCSc2c(F)cccc21 ZINC000134226424 1128705809 /nfs/dbraw/zinc/70/58/09/1128705809.db2.gz HSRIQNVMMCTUKQ-AWEZNQCLSA-N 1 0 289.375 3.858 20 10 CHCDRO COc1ccc(CN[C@H](C)c2ncc(C)s2)cc1C ZINC000134905646 1128712703 /nfs/dbraw/zinc/71/27/03/1128712703.db2.gz UGHBJNFDDFCKFA-GFCCVEGCSA-N 1 0 276.405 3.619 20 10 CHCDRO C[C@@H](Cc1ccsc1)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000048557311 1128717285 /nfs/dbraw/zinc/71/72/85/1128717285.db2.gz VRCWIUMNVRHHNH-ZDUSSCGKSA-N 1 0 274.433 3.535 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCC[C@H]1CCO)c1cc(Cl)ccc1O ZINC000779089656 1128726629 /nfs/dbraw/zinc/72/66/29/1128726629.db2.gz VDXZVYGFVZWRIV-TUKIKUTGSA-N 1 0 297.826 3.637 20 10 CHCDRO CCCC[N@H+](Cc1cc(OC)c(OC)cc1O)[C@H](C)CC ZINC000159820981 1128730263 /nfs/dbraw/zinc/73/02/63/1128730263.db2.gz FBTIIMHIHHNMLJ-CYBMUJFWSA-N 1 0 295.423 3.810 20 10 CHCDRO COc1ccc(CCC[NH2+][C@@H](C)c2cc(C)ccc2O)cc1 ZINC000185094982 1117761204 /nfs/dbraw/zinc/76/12/04/1117761204.db2.gz NXYNNZVDKSZIDO-HNNXBMFYSA-N 1 0 299.414 3.993 20 10 CHCDRO FC(F)c1ccc(C[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC000185186584 1117781917 /nfs/dbraw/zinc/78/19/17/1117781917.db2.gz JHGNDUXLKHUBPI-UHFFFAOYSA-N 1 0 289.325 3.849 20 10 CHCDRO C[C@H]([NH2+][C@H](CC[NH+](C)C)C(C)(C)C)c1ccc(F)cc1[O-] ZINC000185471840 1117828768 /nfs/dbraw/zinc/82/87/68/1117828768.db2.gz MIRSFLJMVLYVLM-BLLLJJGKSA-N 1 0 296.430 3.548 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CCCC[C@@H]1OC)c1ccc(C)cc1O ZINC000799729180 1117842447 /nfs/dbraw/zinc/84/24/47/1117842447.db2.gz INVNABVUUOAAHR-VYDXJSESSA-N 1 0 277.408 3.699 20 10 CHCDRO CCO[C@@H](CC[NH2+][C@@H](C)c1cc(C)ccc1O)C(C)C ZINC000185625353 1117859205 /nfs/dbraw/zinc/85/92/05/1117859205.db2.gz HUDZKSGRNGRCIO-YOEHRIQHSA-N 1 0 279.424 3.802 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](CCO)C2CCCCC2)c1 ZINC000185828692 1117914381 /nfs/dbraw/zinc/91/43/81/1117914381.db2.gz WIVUMVGZKUPAQN-PBHICJAKSA-N 1 0 291.435 3.683 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCC(C)(C)CO1)c1ccc(N(C)C)cc1 ZINC001307695766 1117935327 /nfs/dbraw/zinc/93/53/27/1117935327.db2.gz PCKBIXMJNYPABP-RHSMWYFYSA-N 1 0 290.451 3.608 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H](C)Oc2ccccc2)c1 ZINC000186040760 1117974810 /nfs/dbraw/zinc/97/48/10/1117974810.db2.gz MEHZLGYVBGWSBL-LSDHHAIUSA-N 1 0 285.387 3.819 20 10 CHCDRO COc1ccc(O)c(C[N@H+](C)[C@H](C)c2ccc(F)cc2)c1 ZINC000179630848 1128750580 /nfs/dbraw/zinc/75/05/80/1128750580.db2.gz XPJOLFOGAWLFEE-GFCCVEGCSA-N 1 0 289.350 3.733 20 10 CHCDRO C[C@H]1CSCC[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000179661659 1128753582 /nfs/dbraw/zinc/75/35/82/1128753582.db2.gz MPKIKNMGENUVIZ-HNNXBMFYSA-N 1 0 290.476 3.614 20 10 CHCDRO COc1cc(C[N@H+](C)Cc2ccc(C)s2)c(O)cc1C ZINC000160124654 1128754554 /nfs/dbraw/zinc/75/45/54/1128754554.db2.gz BVCLNYOBTLRNQO-UHFFFAOYSA-N 1 0 291.416 3.711 20 10 CHCDRO Cc1cc(O)c(C[NH+]2C[C@@H]3CCCC[C@H]3C2)cc1C ZINC000749977868 1118090418 /nfs/dbraw/zinc/09/04/18/1118090418.db2.gz ROYKLJLNJXCUBR-GJZGRUSLSA-N 1 0 259.393 3.631 20 10 CHCDRO COCCC1(C[NH2+]Cc2cc(F)ccc2O)CCCCC1 ZINC000187697334 1128756698 /nfs/dbraw/zinc/75/66/98/1128756698.db2.gz NADZQOCXPXRZOX-UHFFFAOYSA-N 1 0 295.398 3.608 20 10 CHCDRO C[C@@H]([NH2+]CCN(C)c1ccccc1)c1ccc(N(C)C)cc1 ZINC000764787985 1118116765 /nfs/dbraw/zinc/11/67/65/1118116765.db2.gz HVKYPVBAKYAPOZ-MRXNPFEDSA-N 1 0 297.446 3.540 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]CCCn2ccc3ccccc32)c1 ZINC000237759957 1128757805 /nfs/dbraw/zinc/75/78/05/1128757805.db2.gz SJBOIIVGUZBKQL-UHFFFAOYSA-N 1 0 294.398 3.835 20 10 CHCDRO CO[C@@H](C)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000188127899 1128759892 /nfs/dbraw/zinc/75/98/92/1128759892.db2.gz YGLUGWNKOJFBIY-KBPBESRZSA-N 1 0 294.414 3.502 20 10 CHCDRO C[C@@H]1CCCC[C@@H]1C[NH2+]Cc1c(O)cccc1Cl ZINC000083552194 1118168415 /nfs/dbraw/zinc/16/84/15/1118168415.db2.gz XDXZQYVVDZSAKX-VXGBXAGGSA-N 1 0 267.800 3.962 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@](C)(O)C2CCCCC2)c1 ZINC000188671557 1128764465 /nfs/dbraw/zinc/76/44/65/1128764465.db2.gz VAWVTJWZDUUJKS-KDOFPFPSSA-N 1 0 291.435 3.683 20 10 CHCDRO Cc1cc([C@@H]2CCC[N@@H+]2Cc2c(C)ccc(C)c2O)no1 ZINC001140178201 1118241482 /nfs/dbraw/zinc/24/14/82/1118241482.db2.gz CFTQQQGVAHFQBP-INIZCTEOSA-N 1 0 286.375 3.643 20 10 CHCDRO CC[C@H](C)C[NH2+][C@H](C)Cc1ccc(N(C)C)cc1C ZINC001651228323 1118265602 /nfs/dbraw/zinc/26/56/02/1118265602.db2.gz VAXNMZWUVIHICM-DZGCQCFKSA-N 1 0 262.441 3.628 20 10 CHCDRO Cc1cc([C@H](C)[NH2+]Cc2cc(C)ccc2O)c(C)o1 ZINC000071408678 1118278033 /nfs/dbraw/zinc/27/80/33/1118278033.db2.gz IWSJEDCDABAPLH-LBPRGKRZSA-N 1 0 259.349 3.761 20 10 CHCDRO C[C@@H](c1ccccc1F)[N@H+](C)Cc1cc(F)ccc1O ZINC000179923900 1128767605 /nfs/dbraw/zinc/76/76/05/1128767605.db2.gz PMDIKLARWABSRG-NSHDSACASA-N 1 0 277.314 3.863 20 10 CHCDRO CCC[N@@H+](Cc1ccccc1O)C[C@@H](O)c1ccc(C)cc1 ZINC000076074015 1128768769 /nfs/dbraw/zinc/76/87/69/1128768769.db2.gz CGQCRPWOUJZLOZ-LJQANCHMSA-N 1 0 299.414 3.646 20 10 CHCDRO CCOc1cccc(C[NH2+]C2CCC(C)(C)CC2)c1O ZINC000079676742 1118309664 /nfs/dbraw/zinc/30/96/64/1118309664.db2.gz XRWORZSLYZRYOD-UHFFFAOYSA-N 1 0 277.408 3.849 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)CN(CC)CC)c1ccc(N(C)C)cc1 ZINC000765770359 1118322565 /nfs/dbraw/zinc/32/25/65/1118322565.db2.gz WRPBHXRJVVSCTO-CRAIPNDOSA-N 1 0 291.483 3.524 20 10 CHCDRO CC(C)C1(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)CC1 ZINC000222223328 1118363054 /nfs/dbraw/zinc/36/30/54/1118363054.db2.gz RANQXSDSFISJEY-AWEZNQCLSA-N 1 0 260.425 3.839 20 10 CHCDRO CC(C)=CCC[NH2+]Cc1c(C)c2ccccc2n1C ZINC000397898958 1118387382 /nfs/dbraw/zinc/38/73/82/1118387382.db2.gz WSOWOZKANLMSAQ-UHFFFAOYSA-N 1 0 256.393 3.933 20 10 CHCDRO CC[C@@H]([NH2+]CCOCc1ccccc1)c1ccccc1O ZINC000186231707 1118395776 /nfs/dbraw/zinc/39/57/76/1118395776.db2.gz GTWLFPYQKLWFSU-QGZVFWFLSA-N 1 0 285.387 3.650 20 10 CHCDRO CN1CCCc2cc(C[NH2+]C3CCCCCC3)ccc21 ZINC000050266786 1118470196 /nfs/dbraw/zinc/47/01/96/1118470196.db2.gz WWVZUBAMJUUBEX-UHFFFAOYSA-N 1 0 272.436 3.881 20 10 CHCDRO Cc1ccccc1C[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000050266803 1118470219 /nfs/dbraw/zinc/47/02/19/1118470219.db2.gz XMAUYTLMWCLOAZ-UHFFFAOYSA-N 1 0 280.415 3.667 20 10 CHCDRO C[C@@H]1CC([NH2+]Cc2ccc3c(c2)CCCN3C)C[C@@H](C)C1 ZINC000084972212 1118477809 /nfs/dbraw/zinc/47/78/09/1118477809.db2.gz OJAVSFSPQRRJHZ-GJZGRUSLSA-N 1 0 286.463 3.983 20 10 CHCDRO CCC1(CC)C[NH+](Cc2ccc(Cl)cc2O)C1 ZINC001659403167 1118480167 /nfs/dbraw/zinc/48/01/67/1118480167.db2.gz ADDVZNVERRKUOG-UHFFFAOYSA-N 1 0 253.773 3.668 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](C)Cc2ccccc2F)c1 ZINC000160730841 1118532955 /nfs/dbraw/zinc/53/29/55/1118532955.db2.gz NTWQYYHLQHIBCJ-UHFFFAOYSA-N 1 0 289.350 3.562 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)CCCCO)c1cc(Cl)ccc1O ZINC000834877173 1118605618 /nfs/dbraw/zinc/60/56/18/1118605618.db2.gz HCQUJFHAHJZINH-SMDDNHRTSA-N 1 0 285.815 3.637 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)[C@H](OC)C1CC1)c1ccc(N(C)C)cc1 ZINC000834904928 1118623197 /nfs/dbraw/zinc/62/31/97/1118623197.db2.gz QZXXHRZHPKDHIA-BVGQSLNGSA-N 1 0 290.451 3.607 20 10 CHCDRO C[C@@H]1[C@H](C)C[N@H+](Cc2c(O)cccc2Br)[C@H]1C ZINC000707138836 1118642792 /nfs/dbraw/zinc/64/27/92/1118642792.db2.gz IDDACCIGBWYJTL-MXWKQRLJSA-N 1 0 298.224 3.631 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@@H+]2CCC[C@@H]2C2CCC2)c1 ZINC000754727440 1118646501 /nfs/dbraw/zinc/64/65/01/1118646501.db2.gz VTEOQAGEYZIZLC-MRXNPFEDSA-N 1 0 259.393 3.774 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCCCOC(C)C)cc1 ZINC000180461195 1128793094 /nfs/dbraw/zinc/79/30/94/1128793094.db2.gz VXTXQTRGUSCRMP-MRXNPFEDSA-N 1 0 292.467 3.999 20 10 CHCDRO Oc1cc(Cl)ccc1C[NH+]1CC2(C1)CCCCC2 ZINC001140465685 1118742770 /nfs/dbraw/zinc/74/27/70/1118742770.db2.gz REYIUAXYCCYCTA-UHFFFAOYSA-N 1 0 265.784 3.812 20 10 CHCDRO COc1ccc(O)c(C[N@H+](C)C[C@H](C)C(C)(C)C)c1 ZINC000399577599 1118950042 /nfs/dbraw/zinc/95/00/42/1118950042.db2.gz BTCKGTFBLOCSGH-LBPRGKRZSA-N 1 0 265.397 3.515 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C2(c3ccccc3)CC2)cc1 ZINC000068979990 1128814443 /nfs/dbraw/zinc/81/44/43/1128814443.db2.gz ANHWNCIDOGFLHF-UHFFFAOYSA-N 1 0 266.388 3.532 20 10 CHCDRO C[C@H]1CC[N@H+](Cc2cccc(Cl)c2[O-])[C@@H](C)C1 ZINC000224468530 1119003668 /nfs/dbraw/zinc/00/36/68/1119003668.db2.gz DYEPTGJAWCQUAM-QWRGUYRKSA-N 1 0 253.773 3.666 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CCc2ccccc2C1)c1ccccc1O ZINC000051630630 1119059629 /nfs/dbraw/zinc/05/96/29/1119059629.db2.gz PDUOEDIFTXLFGN-SJLPKXTDSA-N 1 0 281.399 3.990 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCc3ccccc3C2)c(O)c1 ZINC000051630743 1119061782 /nfs/dbraw/zinc/06/17/82/1119061782.db2.gz IRQWBDUFNAHYGW-YOEHRIQHSA-N 1 0 281.399 3.909 20 10 CHCDRO c1cc(N2CCCCC2)ccc1C[N@@H+]1C[C@H]2CC[C@@H]1C2 ZINC000092119351 1119088192 /nfs/dbraw/zinc/08/81/92/1119088192.db2.gz BJIPQTNATWAZBH-FUHWJXTLSA-N 1 0 270.420 3.661 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2ccc3c(c2)CCCN3C)cc1 ZINC000050266806 1119163589 /nfs/dbraw/zinc/16/35/89/1119163589.db2.gz IEMNQYFUVRZKEZ-UHFFFAOYSA-N 1 0 280.415 3.667 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCOC(C)(C)C1)c1ccc(N(C)C)cc1 ZINC000119314958 1119209431 /nfs/dbraw/zinc/20/94/31/1119209431.db2.gz BGVVATZJULIKMS-RDJZCZTQSA-N 1 0 290.451 3.751 20 10 CHCDRO Cc1cnc(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)s1 ZINC000230664064 1119413590 /nfs/dbraw/zinc/41/35/90/1119413590.db2.gz VEOXKQXTQDYYJK-ZYHUDNBSSA-N 1 0 288.416 3.804 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@H]1CCCSC1 ZINC000252806156 1119445328 /nfs/dbraw/zinc/44/53/28/1119445328.db2.gz GSEQTXFDZZPBCO-FRRDWIJNSA-N 1 0 277.433 3.734 20 10 CHCDRO CC[C@H](C)C[C@H](C)[NH2+]Cc1cc(F)cc(F)c1[O-] ZINC000708445610 1119467025 /nfs/dbraw/zinc/46/70/25/1119467025.db2.gz VGKSUFSGOKCUEZ-UWVGGRQHSA-N 1 0 257.324 3.585 20 10 CHCDRO CC[C@@H](C)C[C@H](C)[NH2+]Cc1cc(F)cc(F)c1[O-] ZINC000708445615 1119467206 /nfs/dbraw/zinc/46/72/06/1119467206.db2.gz VGKSUFSGOKCUEZ-ZJUUUORDSA-N 1 0 257.324 3.585 20 10 CHCDRO C[C@@H]1CC[C@@H]([NH2+]Cc2cccc(Cl)c2[O-])[C@H](C)C1 ZINC000158771834 1119468598 /nfs/dbraw/zinc/46/85/98/1119468598.db2.gz OXZXYIDFHGRRSX-JTNHKYCSSA-N 1 0 267.800 3.960 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCC(C)(C)C2)c1 ZINC000168861217 1119482078 /nfs/dbraw/zinc/48/20/78/1119482078.db2.gz NZVYJAIOFIVFDC-VXGBXAGGSA-N 1 0 263.381 3.630 20 10 CHCDRO CCCCOCCC[NH2+][C@H](CC)c1ccc(F)cc1[O-] ZINC000796663785 1119675849 /nfs/dbraw/zinc/67/58/49/1119675849.db2.gz QCRQEODTJBAHPF-OAHLLOKOSA-N 1 0 283.387 3.779 20 10 CHCDRO COc1cccc(C[N@H+](C)[C@H](C)c2ccccc2)c1O ZINC000179701877 1119758044 /nfs/dbraw/zinc/75/80/44/1119758044.db2.gz NFENIQKITYFOOZ-CYBMUJFWSA-N 1 0 271.360 3.594 20 10 CHCDRO CC[C@H]([NH2+]CCCOc1ccccc1)c1ccccc1O ZINC000052091975 1119781571 /nfs/dbraw/zinc/78/15/71/1119781571.db2.gz GVYUIXKFXVDJKI-KRWDZBQOSA-N 1 0 285.387 3.902 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CC[C@H](C2CCCCC2)C1 ZINC000708767198 1119808324 /nfs/dbraw/zinc/80/83/24/1119808324.db2.gz SGTSXNAEVPBVGR-AWEZNQCLSA-N 1 0 277.383 3.934 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCCC2(C)C)c(Cl)c1 ZINC001140921821 1120094994 /nfs/dbraw/zinc/09/49/94/1120094994.db2.gz RCOBLXRTPLYGRA-UHFFFAOYSA-N 1 0 266.816 3.780 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+][C@@H]1CCCC(F)(F)C1 ZINC000695095224 1120105328 /nfs/dbraw/zinc/10/53/28/1120105328.db2.gz FDIMKTNXBOTFRD-SECBINFHSA-N 1 0 275.726 3.713 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@H]1CCCC(F)(F)C1)CC2 ZINC000695117519 1120108852 /nfs/dbraw/zinc/10/88/52/1120108852.db2.gz ANERKMCNSUYCJC-NWDGAFQWSA-N 1 0 267.319 3.547 20 10 CHCDRO C[C@H]1CCC[N@H+](Cc2cc(Cl)c(Cl)cc2[O-])C1 ZINC001236792148 1128891162 /nfs/dbraw/zinc/89/11/62/1128891162.db2.gz CHDJGYXIHZQHGK-VIFPVBQESA-N 1 0 274.191 3.931 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]CC1CCC(F)(F)CC1)CC2 ZINC000693388351 1120143218 /nfs/dbraw/zinc/14/32/18/1120143218.db2.gz RRPVAICRHIIONH-CYBMUJFWSA-N 1 0 281.346 3.795 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@@H]1CCOC(C)(C)C1 ZINC000215890975 1120145946 /nfs/dbraw/zinc/14/59/46/1120145946.db2.gz SZLSQCGZKQYAAW-MGPQQGTHSA-N 1 0 289.419 3.796 20 10 CHCDRO Cc1ccc(C[N@@H+](C)[C@@H]2CCc3ccccc32)c(O)c1 ZINC001140955094 1120146892 /nfs/dbraw/zinc/14/68/92/1120146892.db2.gz QUHSCIOKWYQLKN-QGZVFWFLSA-N 1 0 267.372 3.820 20 10 CHCDRO CCC1([NH2+]Cc2cc(Cl)ccc2O)CCCC1 ZINC000394555351 1120149636 /nfs/dbraw/zinc/14/96/36/1120149636.db2.gz DUXGQKFJEUAPIX-UHFFFAOYSA-N 1 0 253.773 3.858 20 10 CHCDRO Oc1ccccc1C[NH2+][C@@H]1CC[C@H](Cc2ccccc2)C1 ZINC000780520393 1120159265 /nfs/dbraw/zinc/15/92/65/1120159265.db2.gz OMVJJOBLOXKYJU-SJLPKXTDSA-N 1 0 281.399 3.893 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCCOC(C)(C)C)c1 ZINC000695279076 1120182623 /nfs/dbraw/zinc/18/26/23/1120182623.db2.gz GSJLDUPNEPNZID-CYBMUJFWSA-N 1 0 265.397 3.556 20 10 CHCDRO COc1ccc(O)c(C[NH2+]CC(C)(C)C2=CCCC2)c1 ZINC000308772021 1120201022 /nfs/dbraw/zinc/20/10/22/1120201022.db2.gz YNPBAPVMHHRBKV-UHFFFAOYSA-N 1 0 275.392 3.627 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@H]1CCc3ccccc3C1)CC2 ZINC000314450180 1120210370 /nfs/dbraw/zinc/21/03/70/1120210370.db2.gz DOEXVVPKXARMAS-IRXDYDNUSA-N 1 0 279.383 3.527 20 10 CHCDRO Cc1nc2c(s1)[C@@H]([N@H+](C)Cc1ccccc1O)CCC2 ZINC000179574693 1120250913 /nfs/dbraw/zinc/25/09/13/1120250913.db2.gz WRSRCOMWIWJMIS-AWEZNQCLSA-N 1 0 288.416 3.667 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCN(C(C)C)C(C)C)c(O)c1C ZINC000756374125 1120275934 /nfs/dbraw/zinc/27/59/34/1120275934.db2.gz XXPSMGQDHDQHGD-MRXNPFEDSA-N 1 0 292.467 3.778 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCS[C@H]2C)cc1 ZINC000312089296 1120293220 /nfs/dbraw/zinc/29/32/20/1120293220.db2.gz PADPFUFABFCFAK-XJKSGUPXSA-N 1 0 278.465 3.516 20 10 CHCDRO Cc1ccc([C@@H](C[NH2+][C@@H](C)c2ccccc2O)N(C)C)cc1 ZINC000183467972 1120343154 /nfs/dbraw/zinc/34/31/54/1120343154.db2.gz AVRFXKXFWHGBBT-MAUKXSAKSA-N 1 0 298.430 3.654 20 10 CHCDRO CCOc1cccc(CC[NH2+][C@@H](C)c2ccccc2O)c1 ZINC000183622759 1120344261 /nfs/dbraw/zinc/34/42/61/1120344261.db2.gz RBOBCUBZSVWVPY-AWEZNQCLSA-N 1 0 285.387 3.684 20 10 CHCDRO C[C@@H]([NH2+]CCCOC1CCCC1)c1cc(F)ccc1O ZINC000185240782 1120372671 /nfs/dbraw/zinc/37/26/71/1120372671.db2.gz GVHARTCCQBDECV-GFCCVEGCSA-N 1 0 281.371 3.531 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2cccc(C#N)c2)c1 ZINC000185610673 1120380384 /nfs/dbraw/zinc/38/03/84/1120380384.db2.gz NUUNQYCIQTVZBF-QWHCGFSZSA-N 1 0 296.370 3.684 20 10 CHCDRO Cc1csc([C@@H](C)C[NH2+][C@H](C)c2ccccc2O)n1 ZINC000186569622 1120401847 /nfs/dbraw/zinc/40/18/47/1120401847.db2.gz SAEBBPBEDXZSEW-CMPLNLGQSA-N 1 0 276.405 3.611 20 10 CHCDRO C[C@@H]([NH2+]C1CCC2(CC2)CC1)c1cc(F)ccc1O ZINC000695731137 1120415457 /nfs/dbraw/zinc/41/54/57/1120415457.db2.gz QVBZTRXTXTYGEP-LLVKDONJSA-N 1 0 263.356 3.905 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](C)c1ccccn1)c1ccccc1O ZINC000692692679 1120488286 /nfs/dbraw/zinc/48/82/86/1120488286.db2.gz VFRACNDNDPZGNR-DZGCQCFKSA-N 1 0 270.376 3.632 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccc(F)c(F)c1)c1cc(F)ccc1O ZINC000191516191 1120523057 /nfs/dbraw/zinc/52/30/57/1120523057.db2.gz YGERUIRLFJDSDW-SNVBAGLBSA-N 1 0 295.304 3.703 20 10 CHCDRO Cc1cccc(C[N@H+]2CC[C@@]3(CC[C@@H](C)C3)C2)c1O ZINC000781928993 1120580733 /nfs/dbraw/zinc/58/07/33/1120580733.db2.gz OLUABMXWDQCXJK-CXAGYDPISA-N 1 0 259.393 3.713 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)CCC2CC2)c1 ZINC000398202932 1120591612 /nfs/dbraw/zinc/59/16/12/1120591612.db2.gz GFLMXQXBRXFNPQ-RYUDHWBXSA-N 1 0 263.381 3.630 20 10 CHCDRO CCO[C@H](C[NH2+]Cc1cc(C)c(C)cc1O)c1ccccc1 ZINC000194466780 1120599828 /nfs/dbraw/zinc/59/98/28/1120599828.db2.gz FDMUKEQTMAYKFE-LJQANCHMSA-N 1 0 299.414 3.876 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+][C@H]1CCCc2cccnc21 ZINC000922880128 1120617276 /nfs/dbraw/zinc/61/72/76/1120617276.db2.gz GAGKMHDGYGUTIU-AWEZNQCLSA-N 1 0 288.778 3.608 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]CCSc1ccccc1)CC2 ZINC000312888307 1120653766 /nfs/dbraw/zinc/65/37/66/1120653766.db2.gz WGSWRWBDWIMRKB-OAHLLOKOSA-N 1 0 285.412 3.761 20 10 CHCDRO Cc1ccc(C[C@H](C)[NH2+][C@@H]2CCc3cccc(O)c32)s1 ZINC000312900073 1120654568 /nfs/dbraw/zinc/65/45/68/1120654568.db2.gz YHMZMHKQRMXBBR-XHDPSFHLSA-N 1 0 287.428 3.970 20 10 CHCDRO Cc1ccc(C[C@@H](C)[NH2+][C@@H]2CCc3cccc(O)c32)s1 ZINC000312900062 1120654622 /nfs/dbraw/zinc/65/46/22/1120654622.db2.gz YHMZMHKQRMXBBR-IAQYHMDHSA-N 1 0 287.428 3.970 20 10 CHCDRO Cc1ccc(C[C@H](C)[NH2+][C@H]2CCc3cccc(O)c32)s1 ZINC000312900067 1120654873 /nfs/dbraw/zinc/65/48/73/1120654873.db2.gz YHMZMHKQRMXBBR-NHYWBVRUSA-N 1 0 287.428 3.970 20 10 CHCDRO CSCCCCC[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000186777209 1120666388 /nfs/dbraw/zinc/66/63/88/1120666388.db2.gz KDPGDCSRMDAUIH-ZDUSSCGKSA-N 1 0 267.438 3.885 20 10 CHCDRO CO[C@H](C)C[N@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000248410935 1120706912 /nfs/dbraw/zinc/70/69/12/1120706912.db2.gz DLCOCQXCHGSMHW-HZPDHXFCSA-N 1 0 299.414 3.990 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2cncc(C)c2)cc1 ZINC000181843572 1120904213 /nfs/dbraw/zinc/90/42/13/1120904213.db2.gz PMGMXGDQKJVJDO-OAHLLOKOSA-N 1 0 283.419 3.697 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(C)c(C)n2)c(O)c1 ZINC000314309313 1120927153 /nfs/dbraw/zinc/92/71/53/1120927153.db2.gz QSDUFJFINWECAO-CQSZACIVSA-N 1 0 270.376 3.563 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]CCCCCSC)c1 ZINC000186781621 1120935002 /nfs/dbraw/zinc/93/50/02/1120935002.db2.gz QGEOICSCNJGYDS-GFCCVEGCSA-N 1 0 283.437 3.585 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCC3(C2)CCCCC3)c1O ZINC000314620344 1120968403 /nfs/dbraw/zinc/96/84/03/1120968403.db2.gz UHZNIXOLDYETTJ-UHFFFAOYSA-N 1 0 289.419 3.947 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CCc2cccs2)cc1 ZINC000022150140 1120978533 /nfs/dbraw/zinc/97/85/33/1120978533.db2.gz BHKCWYDTOPLGAN-UHFFFAOYSA-N 1 0 288.460 3.927 20 10 CHCDRO COc1ccccc1C[C@@H](C)[N@H+](C)Cc1cc(C)ccc1O ZINC000317455760 1121011508 /nfs/dbraw/zinc/01/15/08/1121011508.db2.gz WXKABYFSNNYJAE-OAHLLOKOSA-N 1 0 299.414 3.772 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](O)CC(C)(C)C)c1ccc(N(C)C)cc1 ZINC000766057788 1121062978 /nfs/dbraw/zinc/06/29/78/1121062978.db2.gz AYCXQINJIPNBLK-IRXDYDNUSA-N 1 0 292.467 3.590 20 10 CHCDRO CCc1cnccc1[C@H](C)[NH2+]Cc1cc(Cl)ccc1O ZINC000773425724 1121090592 /nfs/dbraw/zinc/09/05/92/1121090592.db2.gz BMDYHNXHBVIGAY-NSHDSACASA-N 1 0 290.794 3.854 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(Cl)o1)c1cc(F)ccc1O ZINC000700570089 1121107872 /nfs/dbraw/zinc/10/78/72/1121107872.db2.gz VCXNPKBDAIDAME-QMMMGPOBSA-N 1 0 269.703 3.629 20 10 CHCDRO C[C@H]([NH2+]CCCSc1nccs1)[C@@H]1CC1(C)C ZINC000785473301 1121157712 /nfs/dbraw/zinc/15/77/12/1121157712.db2.gz MDNXTXOIWOGIJW-QWRGUYRKSA-N 1 0 270.467 3.650 20 10 CHCDRO COc1cccc(C[NH2+]CC[C@H](C)c2ccccc2)c1O ZINC000060942196 1121173569 /nfs/dbraw/zinc/17/35/69/1121173569.db2.gz OFENLNDKYXZHBP-AWEZNQCLSA-N 1 0 285.387 3.684 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCC2(F)CCC2)c1 ZINC000702431225 1121199196 /nfs/dbraw/zinc/19/91/96/1121199196.db2.gz DWTWUTMDQDCUEH-GFCCVEGCSA-N 1 0 251.345 3.634 20 10 CHCDRO C[C@@H](F)CC[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000702625090 1121206137 /nfs/dbraw/zinc/20/61/37/1121206137.db2.gz XEGXMCDWRDVZBQ-CQSZACIVSA-N 1 0 264.388 3.515 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H]2C[C@H](OC(C)C)C2(C)C)cc1C ZINC000766087916 1121206402 /nfs/dbraw/zinc/20/64/02/1121206402.db2.gz HEZVBSYEAIIBFY-SJORKVTESA-N 1 0 291.435 3.691 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2cccc(C)c2O)cc1 ZINC000124716200 1121316260 /nfs/dbraw/zinc/31/62/60/1121316260.db2.gz LXBYVXCERUISHN-CQSZACIVSA-N 1 0 255.361 3.860 20 10 CHCDRO CCC[C@@H](C[NH2+][C@@H](C)c1ccc(C)cc1O)OCC ZINC000705319223 1121397022 /nfs/dbraw/zinc/39/70/22/1121397022.db2.gz XMMMDEOIACUOOH-KBPBESRZSA-N 1 0 265.397 3.556 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H]2CC[C@@H]2SC)cc1 ZINC000706504230 1121431699 /nfs/dbraw/zinc/43/16/99/1121431699.db2.gz GSXUUHAABIQGKK-HOTGVXAUSA-N 1 0 278.465 3.516 20 10 CHCDRO C[N@H+](Cc1c(O)cccc1Br)C1CCCC1 ZINC000707134825 1121450590 /nfs/dbraw/zinc/45/05/90/1121450590.db2.gz KPZUFJHDBLVMOX-UHFFFAOYSA-N 1 0 284.197 3.529 20 10 CHCDRO CCOc1cccc(C[NH+]2C3CCCC2CCC3)c1O ZINC000707161380 1121451629 /nfs/dbraw/zinc/45/16/29/1121451629.db2.gz WXIHGSMUUAUPCS-UHFFFAOYSA-N 1 0 275.392 3.698 20 10 CHCDRO CCc1cccc(C[NH2+][C@@H]2CCCc3occc32)c1O ZINC000709455295 1121470757 /nfs/dbraw/zinc/47/07/57/1121470757.db2.gz NTNBVANDXGWRON-OAHLLOKOSA-N 1 0 271.360 3.715 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@]2(C)CCOc3ccccc32)cc1C ZINC000923023493 1121514001 /nfs/dbraw/zinc/51/40/01/1121514001.db2.gz BMRRTNOJGNBEDO-IBGZPJMESA-N 1 0 297.398 3.797 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]CC(C)(C)c2ccccc2)c1 ZINC000237034845 1121648081 /nfs/dbraw/zinc/64/80/81/1121648081.db2.gz QZLGZPLNGTYZHW-UHFFFAOYSA-N 1 0 299.414 3.858 20 10 CHCDRO C[C@@H]1CCC[C@H]([NH2+]Cc2ccc3c(c2)CCCO3)[C@H]1C ZINC001177092318 1121711714 /nfs/dbraw/zinc/71/17/14/1121711714.db2.gz BWSYJJCIJGCLJY-KEYYUXOJSA-N 1 0 273.420 3.926 20 10 CHCDRO COc1cc(C[NH2+]C(C)(C)C2CC2)c(O)c(C(C)(C)C)c1 ZINC001178218784 1121773411 /nfs/dbraw/zinc/77/34/11/1121773411.db2.gz YQQXUUSFYUWUKP-UHFFFAOYSA-N 1 0 291.435 3.977 20 10 CHCDRO CCN(C)c1ccc(C[N@H+](C)[C@@H](C)c2ccco2)cc1 ZINC000773746622 1121790610 /nfs/dbraw/zinc/79/06/10/1121790610.db2.gz NBMDDLYBJOLQKP-AWEZNQCLSA-N 1 0 272.392 3.929 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CC[C@H](c3ccco3)C2)cc1 ZINC000773757263 1121799952 /nfs/dbraw/zinc/79/99/52/1121799952.db2.gz NVTMZDUTBSWYFA-INIZCTEOSA-N 1 0 284.403 3.725 20 10 CHCDRO Cc1ccc(C[N@H+](C)Cc2ccccc2O)c(Cl)c1 ZINC000773770035 1121815814 /nfs/dbraw/zinc/81/58/14/1121815814.db2.gz BYIWNYIRDIWBHJ-UHFFFAOYSA-N 1 0 275.779 3.986 20 10 CHCDRO CCC(O)(CC)C(C)(C)C[NH2+]Cc1c(O)cccc1Cl ZINC001179135105 1121852467 /nfs/dbraw/zinc/85/24/67/1121852467.db2.gz DVWHQAGYHPYPRE-UHFFFAOYSA-N 1 0 299.842 3.713 20 10 CHCDRO Cc1cc(C)cc(C[NH2+]Cc2ccc3c(c2)CCCO3)c1 ZINC001179222668 1121859121 /nfs/dbraw/zinc/85/91/21/1121859121.db2.gz MVFSOEQKQHVPER-UHFFFAOYSA-N 1 0 281.399 3.918 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CCC[C@H]2c2ccncc2)cc1 ZINC000773815188 1121882099 /nfs/dbraw/zinc/88/20/99/1121882099.db2.gz YLRIRSPKVPMPOQ-IBGZPJMESA-N 1 0 295.430 3.875 20 10 CHCDRO COc1ccc(C[NH2+]CC2CCC=CCC2)cc1C ZINC001179650686 1121895417 /nfs/dbraw/zinc/89/54/17/1121895417.db2.gz FYYFXPUKXWAAIY-UHFFFAOYSA-N 1 0 259.393 3.840 20 10 CHCDRO CC[C@H]1C[N@H+](Cc2cc(C(C)C)c(C)cc2O)C[C@H](C)O1 ZINC000732184551 1121910889 /nfs/dbraw/zinc/91/08/89/1121910889.db2.gz CLZUIKMRSMHBPQ-HOCLYGCPSA-N 1 0 291.435 3.823 20 10 CHCDRO C[N@H+](CCc1c(F)cccc1Cl)Cc1ccccc1O ZINC000732203182 1121911811 /nfs/dbraw/zinc/91/18/11/1121911811.db2.gz OBLUKUJYLQKEJV-UHFFFAOYSA-N 1 0 293.769 3.859 20 10 CHCDRO CN(C)c1cc(F)c(C[N@H+](C)CC(C)(C)C)cc1F ZINC001179966494 1121937853 /nfs/dbraw/zinc/93/78/53/1121937853.db2.gz NCPUSBHUOOFKKX-UHFFFAOYSA-N 1 0 270.367 3.509 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)c2cnn(C(C)C)c2)cc1C ZINC000732820733 1121940492 /nfs/dbraw/zinc/94/04/92/1121940492.db2.gz NQKCPAHJKQSUFP-AWEZNQCLSA-N 1 0 287.407 3.632 20 10 CHCDRO CC[N@H+](CCC(F)(F)F)Cc1ccc(Cl)cc1O ZINC001180064337 1121945943 /nfs/dbraw/zinc/94/59/43/1121945943.db2.gz DZYPDDOANJFPFE-UHFFFAOYSA-N 1 0 281.705 3.820 20 10 CHCDRO CC(C)c1ccc(O)c(C[N@@H+]2CC[C@@H]3OCCC[C@H]3C2)c1 ZINC001180203732 1121963586 /nfs/dbraw/zinc/96/35/86/1121963586.db2.gz YJCBLTKYXIITKB-YJBOKZPZSA-N 1 0 289.419 3.517 20 10 CHCDRO CCC[N@@H+](Cc1ccccc1O)C[C@H](OC)[C@@H](C)CC ZINC001180194737 1121965720 /nfs/dbraw/zinc/96/57/20/1121965720.db2.gz MAEQHOWKZHSHKO-YOEHRIQHSA-N 1 0 279.424 3.665 20 10 CHCDRO CCC1(C)CC[NH+](Cc2c(C)cc(OC)cc2O)CC1 ZINC001180284218 1121976643 /nfs/dbraw/zinc/97/66/43/1121976643.db2.gz DAVVVUFIQUXAQW-UHFFFAOYSA-N 1 0 277.408 3.721 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CC[C@H]3CCCC[C@@H]3C2)c(O)c1 ZINC001181196045 1122041286 /nfs/dbraw/zinc/04/12/86/1122041286.db2.gz HOLQTONBTLUGAH-IIAWOOMASA-N 1 0 289.419 3.849 20 10 CHCDRO COc1ccc(O)c(C[NH2+]C[C@@H]2CCC[C@@H](C)[C@H]2C)c1 ZINC001181234592 1122045014 /nfs/dbraw/zinc/04/50/14/1122045014.db2.gz MMYUIUUSCMXIHT-MCIONIFRSA-N 1 0 277.408 3.563 20 10 CHCDRO CCCN(CC1(C(C)C)CC1)c1ccc(C[NH3+])cc1 ZINC001181458030 1122055227 /nfs/dbraw/zinc/05/52/27/1122055227.db2.gz SVZMOYHXJOEYNY-UHFFFAOYSA-N 1 0 260.425 3.798 20 10 CHCDRO CCC1(C[NH2+]Cc2cc(C(C)C)ccc2O)CCOCC1 ZINC001181808551 1122080285 /nfs/dbraw/zinc/08/02/85/1122080285.db2.gz NQCVBLVUQVANEF-UHFFFAOYSA-N 1 0 291.435 3.812 20 10 CHCDRO COc1cc(C)cc(C[N@@H+]2CC3(CCC3)[C@@H]2C(C)C)c1O ZINC001182087041 1122107849 /nfs/dbraw/zinc/10/78/49/1122107849.db2.gz OTHWEOFHYLNVPO-KRWDZBQOSA-N 1 0 289.419 3.720 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2ccc3c(c2)OCO3)c1 ZINC000192751131 1129033641 /nfs/dbraw/zinc/03/36/41/1129033641.db2.gz OQRNDLBTGKRUQS-STQMWFEESA-N 1 0 299.370 3.841 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2C[C@H](C)[C@@H](C)[C@@H]2C)c(Cl)c1 ZINC001182453752 1122162886 /nfs/dbraw/zinc/16/28/86/1122162886.db2.gz VREIVDASYNLTSK-TUAOUCFPSA-N 1 0 267.800 3.830 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+][C@H]2CCO[C@H](C(C)C)C2)c1O ZINC000271812885 1122176327 /nfs/dbraw/zinc/17/63/27/1122176327.db2.gz LHXVBRCWJOUQGU-GJZGRUSLSA-N 1 0 297.826 3.647 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]C[C@@H]1CCCC12CC2 ZINC001183196727 1122210334 /nfs/dbraw/zinc/21/03/34/1122210334.db2.gz HPODEAPCRDMLEF-INIZCTEOSA-N 1 0 272.436 3.731 20 10 CHCDRO Cc1csc(C2([NH2+][C@@H](C)c3ccccc3O)CCC2)n1 ZINC000272793865 1122212700 /nfs/dbraw/zinc/21/27/00/1122212700.db2.gz AEVIZUYHDUTZFZ-LBPRGKRZSA-N 1 0 288.416 3.887 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCOC2(CCCCC2)C1)c1ccccc1O ZINC000272815055 1122213542 /nfs/dbraw/zinc/21/35/42/1122213542.db2.gz DWQNSLDNMFTGDS-HUUCEWRRSA-N 1 0 289.419 3.925 20 10 CHCDRO COc1cccc2c1CC[C@@H]([NH2+][C@H](C)c1ccccc1O)C2 ZINC001183355722 1122217985 /nfs/dbraw/zinc/21/79/85/1122217985.db2.gz RYJXTUAELIBQFI-UKRRQHHQSA-N 1 0 297.398 3.609 20 10 CHCDRO Cc1cnc([C@@H](C)C[NH2+]Cc2c(O)cccc2Cl)s1 ZINC000273340434 1122228662 /nfs/dbraw/zinc/22/86/62/1122228662.db2.gz AGRMTRHYFCLFBV-VIFPVBQESA-N 1 0 296.823 3.704 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CC[C@@H]2CCO[C@H](C)C2)c1 ZINC000273410689 1122231418 /nfs/dbraw/zinc/23/14/18/1122231418.db2.gz HRYBFYOSQJAXSE-QLFBSQMISA-N 1 0 277.408 3.556 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCO[C@H](CC(C)C)C2)c(O)c1 ZINC000273451663 1122233817 /nfs/dbraw/zinc/23/38/17/1122233817.db2.gz GCMYUMHOZRULDP-HRCADAONSA-N 1 0 291.435 3.945 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCCc2nccs2)c(O)c1C ZINC000273503530 1122236448 /nfs/dbraw/zinc/23/64/48/1122236448.db2.gz QOENEIMWJRDCLK-ZDUSSCGKSA-N 1 0 290.432 3.749 20 10 CHCDRO CC(C)C[C@@H]1C[C@@H]([NH2+][C@@H](C)c2cc(F)ccc2O)CCO1 ZINC000273533186 1122237607 /nfs/dbraw/zinc/23/76/07/1122237607.db2.gz WTPRZZZGXVITOS-AEGPPILISA-N 1 0 295.398 3.776 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCO[C@@H](CC(C)C)C2)c1 ZINC000273519295 1122237791 /nfs/dbraw/zinc/23/77/91/1122237791.db2.gz TYOZEFMOIOMJOZ-XHSDSOJGSA-N 1 0 291.435 3.945 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CSCCS2)c(O)c1C ZINC000273617369 1122241202 /nfs/dbraw/zinc/24/12/02/1122241202.db2.gz XUFRELHLLGIYSI-OLZOCXBDSA-N 1 0 297.489 3.508 20 10 CHCDRO CC[C@@H](C)C[C@@H](CC)[NH2+]Cc1c([O-])cccc1F ZINC001183920009 1122248590 /nfs/dbraw/zinc/24/85/90/1122248590.db2.gz SKOPYHSGBAIYLS-VXGBXAGGSA-N 1 0 253.361 3.836 20 10 CHCDRO [O-]c1cccc(F)c1C[NH2+]C/C=C/c1ccc(F)cc1F ZINC001183920029 1122248698 /nfs/dbraw/zinc/24/86/98/1122248698.db2.gz SUSHULIAHGAMRU-NSCUHMNNSA-N 1 0 293.288 3.613 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]C(C(C)C)C(C)C)c1O ZINC001184336909 1122272007 /nfs/dbraw/zinc/27/20/07/1122272007.db2.gz COBLOCKOGPYJKF-UHFFFAOYSA-N 1 0 285.815 3.824 20 10 CHCDRO CCO[C@@H](C[NH2+]Cc1ccc(OC)c(C)c1)c1ccccc1 ZINC000775029280 1122396030 /nfs/dbraw/zinc/39/60/30/1122396030.db2.gz ZPUCEODOLQWMMU-IBGZPJMESA-N 1 0 299.414 3.871 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CC[C@H]2CCC[C@@H]2C1 ZINC001203650913 1122415197 /nfs/dbraw/zinc/41/51/97/1122415197.db2.gz GEFWCXJNLALZRC-VXGBXAGGSA-N 1 0 265.784 3.668 20 10 CHCDRO CCCN(Cc1ccc(C)s1)c1ccc(C[NH3+])cc1 ZINC000775140300 1122439207 /nfs/dbraw/zinc/43/92/07/1122439207.db2.gz LKGQRYUHVBPYHU-UHFFFAOYSA-N 1 0 274.433 3.932 20 10 CHCDRO CCCN(Cc1ccccc1N(C)C)c1ccc(C[NH3+])cc1 ZINC000775139612 1122439323 /nfs/dbraw/zinc/43/93/23/1122439323.db2.gz DJTZTGMXVLUDBU-UHFFFAOYSA-N 1 0 297.446 3.628 20 10 CHCDRO C[C@@H](C[NH2+][C@@H](C)c1ccccc1O)COCc1ccccc1 ZINC000183459110 1129055618 /nfs/dbraw/zinc/05/56/18/1129055618.db2.gz VVXXUDUNAKKOMP-HOTGVXAUSA-N 1 0 299.414 3.896 20 10 CHCDRO Cc1ccc(OCCC[NH2+][C@@H](C)c2ccccc2O)cc1 ZINC000183478556 1129057771 /nfs/dbraw/zinc/05/77/71/1129057771.db2.gz XYKLMEGFXFKNIO-HNNXBMFYSA-N 1 0 285.387 3.820 20 10 CHCDRO COc1ccsc1C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000775363303 1122527998 /nfs/dbraw/zinc/52/79/98/1122527998.db2.gz MLNTZQPZSBZILO-LBPRGKRZSA-N 1 0 290.432 3.674 20 10 CHCDRO CC[C@@H]1C[C@H](C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)CCO1 ZINC000775366102 1122529167 /nfs/dbraw/zinc/52/91/67/1122529167.db2.gz ZXDOUGKMLGPWFX-HDMKZQKVSA-N 1 0 290.451 3.608 20 10 CHCDRO CCN(C)c1ccc(C[N@H+]([C@@H](C)C2CC2)C2CC2)cc1 ZINC001190674159 1122551792 /nfs/dbraw/zinc/55/17/92/1122551792.db2.gz PVOZYLXAUZUVFE-AWEZNQCLSA-N 1 0 272.436 3.906 20 10 CHCDRO COc1ccc([C@@H](C)[NH2+]Cc2cc(C)ccc2O)cc1F ZINC000071407670 1129062295 /nfs/dbraw/zinc/06/22/95/1129062295.db2.gz NLUVTXJZIYCIFV-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCC[C@@H]1OC)c1ccc(N(C)C)cc1 ZINC000775417159 1122557374 /nfs/dbraw/zinc/55/73/74/1122557374.db2.gz LTTBKMJKGULNQI-NJAFHUGGSA-N 1 0 290.451 3.608 20 10 CHCDRO CC[C@H]([NH2+]CCOc1ccc(F)cc1)c1ccccc1O ZINC000775415629 1122557697 /nfs/dbraw/zinc/55/76/97/1122557697.db2.gz UAYOITSAZFHWOZ-INIZCTEOSA-N 1 0 289.350 3.651 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H](C)Cc2ccc(F)cc2)c1 ZINC000071409356 1129062707 /nfs/dbraw/zinc/06/27/07/1129062707.db2.gz MFGBVQXBTLGRDX-CYBMUJFWSA-N 1 0 273.351 3.561 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1cnn(C(C)C)c1)c1ccccc1O ZINC000775503425 1122631363 /nfs/dbraw/zinc/63/13/63/1122631363.db2.gz IGQHUXGUUJAFGR-XJKSGUPXSA-N 1 0 287.407 3.972 20 10 CHCDRO C[C@@H](CCCC(F)(F)F)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000775502775 1122631617 /nfs/dbraw/zinc/63/16/17/1122631617.db2.gz ZARGBKHWYQYISL-NSHDSACASA-N 1 0 287.325 3.832 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CC[C@H](CO)CC1)c1cc(Cl)ccc1O ZINC000775511861 1122633194 /nfs/dbraw/zinc/63/31/94/1122633194.db2.gz DOUDYVVVFQQAEA-UXIGCNINSA-N 1 0 297.826 3.637 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)C1CCOCC1)c1cc(Cl)ccc1O ZINC000775514390 1122635711 /nfs/dbraw/zinc/63/57/11/1122635711.db2.gz USSYYNJNVLJBQC-ABAIWWIYSA-N 1 0 297.826 3.901 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cnn(CC)c1)c1cc(Cl)ccc1O ZINC000775524428 1122642560 /nfs/dbraw/zinc/64/25/60/1122642560.db2.gz PZJCDCFSJNHCRG-CQSZACIVSA-N 1 0 293.798 3.503 20 10 CHCDRO CC[C@@H]([NH2+][C@H](c1cccnc1)C1CC1)c1ccccc1O ZINC000775526624 1122643815 /nfs/dbraw/zinc/64/38/15/1122643815.db2.gz SKBALXZFDJCXLX-AEFFLSMTSA-N 1 0 282.387 3.979 20 10 CHCDRO CC[C@H]1CCC[C@@H]1[NH2+]Cc1ccc(N(C)C)c(C)c1 ZINC001193402161 1122688793 /nfs/dbraw/zinc/68/87/93/1122688793.db2.gz QSAGDEJYOSLROK-HOTGVXAUSA-N 1 0 260.425 3.729 20 10 CHCDRO COc1ccc(C[C@H](C)C[NH2+][C@H](C)c2ccccc2O)cc1 ZINC000183631331 1129072396 /nfs/dbraw/zinc/07/23/96/1129072396.db2.gz ZHPGZDHWTOAVKW-LSDHHAIUSA-N 1 0 299.414 3.930 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CCCC(C)(F)F)cc1C ZINC000296213317 1122765658 /nfs/dbraw/zinc/76/56/58/1122765658.db2.gz ZUOSPMZAMNLXLR-UHFFFAOYSA-N 1 0 257.324 3.534 20 10 CHCDRO C[N@H+](Cc1cccc(F)c1)Cc1cc(Cl)cc(F)c1[O-] ZINC000775641747 1122850022 /nfs/dbraw/zinc/85/00/22/1122850022.db2.gz DMJQFOLPKBBLKG-UHFFFAOYSA-N 1 0 297.732 3.956 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCC[C@@H]2Cc2ccccc2)c1O ZINC000775649075 1122863260 /nfs/dbraw/zinc/86/32/60/1122863260.db2.gz ZREYGZZCTQOPBT-GOSISDBHSA-N 1 0 281.399 3.908 20 10 CHCDRO Cc1cccc(C[N@@H+]2CC[C@@H](Cc3ccccc3)C2)c1O ZINC000775651857 1122866686 /nfs/dbraw/zinc/86/66/86/1122866686.db2.gz RCLNXTIVMKMFSV-KRWDZBQOSA-N 1 0 281.399 3.765 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCOc3ccccc3[C@H]2C)c1O ZINC000775657549 1122871391 /nfs/dbraw/zinc/87/13/91/1122871391.db2.gz CVAVDQRQQDIJQQ-CQSZACIVSA-N 1 0 283.371 3.656 20 10 CHCDRO COCC[N@H+](Cc1cc(Cl)cc(C)c1O)C1CCCC1 ZINC000775656928 1122871788 /nfs/dbraw/zinc/87/17/88/1122871788.db2.gz QCXATMZUNUPSEK-UHFFFAOYSA-N 1 0 297.826 3.745 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CC[C@@H](c3ccccc3C)C2)c1 ZINC000775670890 1122888157 /nfs/dbraw/zinc/88/81/57/1122888157.db2.gz SKKWMBYEJDXAFE-OAHLLOKOSA-N 1 0 297.398 3.699 20 10 CHCDRO Cc1noc(C)c1C(C)(C)[NH2+]Cc1ccc(Cl)cc1O ZINC001205728824 1122892626 /nfs/dbraw/zinc/89/26/26/1122892626.db2.gz MVUHYJJZVDXKBD-UHFFFAOYSA-N 1 0 294.782 3.675 20 10 CHCDRO COc1ccc(O)c(C[N@H+]2CC=C(C(C)(C)C)CC2)c1 ZINC000775745415 1122935168 /nfs/dbraw/zinc/93/51/68/1122935168.db2.gz UVNGKPNZEUAFAT-UHFFFAOYSA-N 1 0 275.392 3.579 20 10 CHCDRO Cc1cc(Br)cc(C[N@H+]2CC[C@@H]2C(C)C)c1O ZINC000775763093 1122948402 /nfs/dbraw/zinc/94/84/02/1122948402.db2.gz DITVITDCIOMIGG-CYBMUJFWSA-N 1 0 298.224 3.693 20 10 CHCDRO c1ccc(CCC[NH2+]Cc2ccc3c(c2)CCCO3)cc1 ZINC001198980587 1123017900 /nfs/dbraw/zinc/01/79/00/1123017900.db2.gz IQPWORURDRBNAF-UHFFFAOYSA-N 1 0 281.399 3.734 20 10 CHCDRO COc1ccccc1[C@@H](C)[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001203936570 1123032734 /nfs/dbraw/zinc/03/27/34/1123032734.db2.gz GJNLREZXQOVYBY-OAHLLOKOSA-N 1 0 298.430 3.954 20 10 CHCDRO Cc1ccc(O)c(C[N@H+]2CCC[C@@H](C(F)(F)F)[C@@H]2C)c1 ZINC000776013694 1123036441 /nfs/dbraw/zinc/03/64/41/1123036441.db2.gz NLMAAOJOKCYSSO-WCQYABFASA-N 1 0 287.325 3.863 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]C2CC(c3ccccc3)C2)c1 ZINC000105492420 1123054022 /nfs/dbraw/zinc/05/40/22/1123054022.db2.gz UOGKYUATJYWOLQ-UHFFFAOYSA-N 1 0 297.398 3.827 20 10 CHCDRO COc1ccccc1CC(C)(C)[NH2+]Cc1cccc(C)c1O ZINC000776174116 1123102665 /nfs/dbraw/zinc/10/26/65/1123102665.db2.gz ABXKNXCWNWADBP-UHFFFAOYSA-N 1 0 299.414 3.820 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccccc1[N+](=O)[O-] ZINC000268724440 1129099568 /nfs/dbraw/zinc/09/95/68/1129099568.db2.gz KCYKEZFEQVTELT-ZDUSSCGKSA-N 1 0 299.374 3.512 20 10 CHCDRO CC[N@H+](CCCc1ccccc1)Cc1ccccc1O ZINC001201671915 1123133364 /nfs/dbraw/zinc/13/33/64/1123133364.db2.gz OPTFNNYVPWHFLL-UHFFFAOYSA-N 1 0 269.388 3.847 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1cccs1 ZINC001202018583 1123166255 /nfs/dbraw/zinc/16/62/55/1123166255.db2.gz QTHPGHMSISXEFM-NSHDSACASA-N 1 0 278.396 3.804 20 10 CHCDRO CC[C@](C)([NH2+]Cc1cc2c(cc1O)OCO2)c1ccccc1 ZINC000107717952 1123226658 /nfs/dbraw/zinc/22/66/58/1123226658.db2.gz PEDJQBJTQJWCGS-SFHVURJKSA-N 1 0 299.370 3.536 20 10 CHCDRO CC[C@@H](Cc1ccc(F)cc1)[NH2+]Cc1ccccc1O ZINC000850342524 1123255002 /nfs/dbraw/zinc/25/50/02/1123255002.db2.gz MJBVZDDCWKPDEA-INIZCTEOSA-N 1 0 273.351 3.642 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CCCOC(C)(C)C)c(Cl)c1 ZINC000850368307 1123257249 /nfs/dbraw/zinc/25/72/49/1123257249.db2.gz BQCHXNAPZKDUJV-UHFFFAOYSA-N 1 0 285.815 3.649 20 10 CHCDRO CC[C@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)C1CC1 ZINC000850382626 1123261377 /nfs/dbraw/zinc/26/13/77/1123261377.db2.gz ZGXNFPPPGGEYDH-RTRPANQVSA-N 1 0 258.409 3.544 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]C[C@H]2C(C)(C)C2(F)F)cc1 ZINC000850394245 1123261735 /nfs/dbraw/zinc/26/17/35/1123261735.db2.gz NVDLJDMKBDLWDV-NFAHFFEMSA-N 1 0 294.389 3.647 20 10 CHCDRO CC(C)(C)O[C@H]1C[C@@H]([NH2+]Cc2ccccc2O)C12CCC2 ZINC000850388240 1123262048 /nfs/dbraw/zinc/26/20/48/1123262048.db2.gz KDEZOSHSZHXXNP-CVEARBPZSA-N 1 0 289.419 3.608 20 10 CHCDRO CC(C)(C)O[C@H]1C[C@H]([NH2+]Cc2ccccc2O)C12CCC2 ZINC000850388241 1123262219 /nfs/dbraw/zinc/26/22/19/1123262219.db2.gz KDEZOSHSZHXXNP-HOTGVXAUSA-N 1 0 289.419 3.608 20 10 CHCDRO c1coc(CCC[NH2+]Cc2ccc(N3CCCCC3)cc2)c1 ZINC000850407320 1123263694 /nfs/dbraw/zinc/26/36/94/1123263694.db2.gz DGIUEUFOZOTJTP-UHFFFAOYSA-N 1 0 298.430 3.992 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]C2CC(C)(C)C2)cc1 ZINC000850416699 1123264749 /nfs/dbraw/zinc/26/47/49/1123264749.db2.gz OLWDNEULQHZEBM-WAYWQWQTSA-N 1 0 258.409 3.544 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C2CC(CF)(CF)C2)cc1 ZINC000850424402 1123265679 /nfs/dbraw/zinc/26/56/79/1123265679.db2.gz JTOUSKLTPAXFGQ-UHFFFAOYSA-N 1 0 296.405 3.710 20 10 CHCDRO c1csc(SCCC[NH2+][C@H]2CCCC23CC3)n1 ZINC000850438658 1123267087 /nfs/dbraw/zinc/26/70/87/1123267087.db2.gz YNYAHCAGTGFKFM-NSHDSACASA-N 1 0 268.451 3.548 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCN2C(C)(C)C)c(O)c1C ZINC000850480538 1123273109 /nfs/dbraw/zinc/27/31/09/1123273109.db2.gz BXCNYDXUWSLXBF-CABCVRRESA-N 1 0 290.451 3.532 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H](C)c2ccccn2)c(O)c1 ZINC000850480642 1123273719 /nfs/dbraw/zinc/27/37/19/1123273719.db2.gz BAPLGDIQAGWADC-CABCVRRESA-N 1 0 284.403 3.858 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@H]2CCN(C(C)(C)C)C2)c(O)c1 ZINC000850492638 1123274507 /nfs/dbraw/zinc/27/45/07/1123274507.db2.gz FOBSZEIAABTOSJ-GJZGRUSLSA-N 1 0 290.451 3.532 20 10 CHCDRO CCC(O)(CC)C(C)(C)C[NH2+][C@H]1CCc2cccc(O)c21 ZINC000850501185 1123274985 /nfs/dbraw/zinc/27/49/85/1123274985.db2.gz KJZCQWYUZLWDHV-AWEZNQCLSA-N 1 0 291.435 3.546 20 10 CHCDRO CCC(O)(CC)C(C)(C)C[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000850500902 1123275097 /nfs/dbraw/zinc/27/50/97/1123275097.db2.gz IGKGQBHHRHUENY-AWEZNQCLSA-N 1 0 293.451 3.929 20 10 CHCDRO CC[C@@H](COCC1CC1)[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000850493134 1123275210 /nfs/dbraw/zinc/27/52/10/1123275210.db2.gz HKMUSJDGMZWZOX-RDJZCZTQSA-N 1 0 291.435 3.947 20 10 CHCDRO CCC(O)(CC)C(C)(C)C[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000850501186 1123275354 /nfs/dbraw/zinc/27/53/54/1123275354.db2.gz KJZCQWYUZLWDHV-CQSZACIVSA-N 1 0 291.435 3.546 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCN(C(C)(C)C)C2)c(O)c1C ZINC000850495021 1123275409 /nfs/dbraw/zinc/27/54/09/1123275409.db2.gz VBWSRKVSTDHZAW-LSDHHAIUSA-N 1 0 290.451 3.532 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CCc2cnccc2C)c(O)c1 ZINC000850504761 1123276295 /nfs/dbraw/zinc/27/62/95/1123276295.db2.gz DRDFIKHBSGMJFR-OAHLLOKOSA-N 1 0 284.403 3.606 20 10 CHCDRO CSCC1(CC[NH2+][C@@H](C)c2ccc(N(C)C)cc2)CC1 ZINC000850506303 1123276382 /nfs/dbraw/zinc/27/63/82/1123276382.db2.gz IIXHTHHEWUNKID-AWEZNQCLSA-N 1 0 292.492 3.937 20 10 CHCDRO C[C@H]1C[C@H]([NH2+]CCc2ccoc2)c2c1c(F)ccc2O ZINC000850531526 1123284784 /nfs/dbraw/zinc/28/47/84/1123284784.db2.gz LGESARSSHVHUPV-GWCFXTLKSA-N 1 0 275.323 3.505 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CCC(C)(C)F)c(O)c1 ZINC000850531313 1123284906 /nfs/dbraw/zinc/28/49/06/1123284906.db2.gz IYHUJNJQYAYXPR-LBPRGKRZSA-N 1 0 253.361 3.798 20 10 CHCDRO CC[C@H]([NH2+]Cc1c(C2CC2)cnn1C)c1ccc(C)cc1O ZINC000850535588 1123286785 /nfs/dbraw/zinc/28/67/85/1123286785.db2.gz XLUSFVQQVGWBJK-INIZCTEOSA-N 1 0 299.418 3.552 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+]C[C@H]2CCC[C@@H](C)O2)c2c1c(F)ccc2O ZINC000850535688 1123286894 /nfs/dbraw/zinc/28/68/94/1123286894.db2.gz ZHMZGIAWAPVMPB-BYNQJWBRSA-N 1 0 293.382 3.627 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@]1(C)CC1(F)F)c1ccc(N(C)C)cc1 ZINC000850535283 1123286927 /nfs/dbraw/zinc/28/69/27/1123286927.db2.gz UFHKSEZRDFXCPY-HUUCEWRRSA-N 1 0 282.378 3.839 20 10 CHCDRO CC[C@H]([NH2+]CC[C@]1(C)CC1(F)F)c1ccccc1O ZINC000850536000 1123287091 /nfs/dbraw/zinc/28/70/91/1123287091.db2.gz GNKSCTXIHZZZAC-GXTWGEPZSA-N 1 0 269.335 3.868 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@]2(C)CC2(F)F)c(O)c1 ZINC000850536892 1123287153 /nfs/dbraw/zinc/28/71/53/1123287153.db2.gz OSJOEBGGUAYOEO-RISCZKNCSA-N 1 0 269.335 3.705 20 10 CHCDRO CC[C@H]([NH2+]C[C@@]1(C)CC1(F)F)c1ccc(C)cc1O ZINC000850535728 1123287450 /nfs/dbraw/zinc/28/74/50/1123287450.db2.gz AFBAEYWOHQXQPY-GXTWGEPZSA-N 1 0 269.335 3.787 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CC[C@]2(C)CC2(F)F)c1 ZINC000850537582 1123288196 /nfs/dbraw/zinc/28/81/96/1123288196.db2.gz WBXRGXRTVIHKFM-SMDDNHRTSA-N 1 0 269.335 3.787 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCc2ccc(O)cc21)c1ccc(N(C)C)cc1 ZINC000850543400 1123289363 /nfs/dbraw/zinc/28/93/63/1123289363.db2.gz IXIMFLDBEWRTPX-YJYMSZOUSA-N 1 0 296.414 3.796 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)C1CCC(F)CC1)c1ccccc1O ZINC000850553985 1123291052 /nfs/dbraw/zinc/29/10/52/1123291052.db2.gz GBPFMNUOKWOELP-IWMBGFJWSA-N 1 0 265.372 3.960 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]C2(CC(C)C)CC2)c1 ZINC000850567089 1123293652 /nfs/dbraw/zinc/29/36/52/1123293652.db2.gz XJLPTOIMBPUOON-GFCCVEGCSA-N 1 0 263.381 3.630 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCOC1(C)C)c1cc(Cl)ccc1O ZINC000850570192 1123294186 /nfs/dbraw/zinc/29/41/86/1123294186.db2.gz FPUZJCDLCCNTBQ-GHMZBOCLSA-N 1 0 283.799 3.511 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](O)[C@H](C)c2ccccc2)c(O)c1 ZINC000850573462 1123295636 /nfs/dbraw/zinc/29/56/36/1123295636.db2.gz MIRKEEXRLBQZNW-ZRGWGRIASA-N 1 0 299.414 3.516 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](c2ccccc2)[C@@H](C)O)c(O)c1C ZINC000850585151 1123296406 /nfs/dbraw/zinc/29/64/06/1123296406.db2.gz VZHLGAICSDPFML-HDMKZQKVSA-N 1 0 299.414 3.782 20 10 CHCDRO CCCC[N@H+](Cc1nc(C)oc1C)Cc1ccccc1O ZINC000852018597 1123393064 /nfs/dbraw/zinc/39/30/64/1123393064.db2.gz NUXQZZHMEZHTRS-UHFFFAOYSA-N 1 0 288.391 3.799 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H](C)c2ccc3c(c2)CCCO3)c1 ZINC000853095514 1123423922 /nfs/dbraw/zinc/42/39/22/1123423922.db2.gz ZLMLHTSMTZQWBP-CQSZACIVSA-N 1 0 297.398 3.876 20 10 CHCDRO C[N@H+](Cc1ccccc1O)[C@@H]1CCCc2ccccc21 ZINC000111235617 1123432149 /nfs/dbraw/zinc/43/21/49/1123432149.db2.gz PAPFUWNUIVRQLZ-QGZVFWFLSA-N 1 0 267.372 3.902 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CC[C@H]3C[C@H]3C2)cc1C(C)C ZINC000853581074 1123444143 /nfs/dbraw/zinc/44/41/43/1123444143.db2.gz RRGYBTXSDXGJGR-KBPBESRZSA-N 1 0 259.393 3.666 20 10 CHCDRO CC[C@H]([NH2+]CCOC1CCCCC1)c1ccccc1O ZINC000111636071 1123457318 /nfs/dbraw/zinc/45/73/18/1123457318.db2.gz DCRDBMHKFMPCDL-INIZCTEOSA-N 1 0 277.408 3.782 20 10 CHCDRO Cc1cc(C[N@@H+](C)Cc2ccccc2O)ccc1Cl ZINC000780757859 1123511667 /nfs/dbraw/zinc/51/16/67/1123511667.db2.gz ILDGCGJZRQFJPH-UHFFFAOYSA-N 1 0 275.779 3.986 20 10 CHCDRO Fc1cc(Cl)cc(C[NH2+]Cc2ccc3c(c2)CCO3)c1 ZINC000776799666 1123512047 /nfs/dbraw/zinc/51/20/47/1123512047.db2.gz KAUITLOQHIQDBB-UHFFFAOYSA-N 1 0 291.753 3.704 20 10 CHCDRO Cc1cccc(C[NH2+]C[C@@]2(C)CCOC3(CCC3)C2)c1O ZINC000895819577 1123518330 /nfs/dbraw/zinc/51/83/30/1123518330.db2.gz BIMKNPURGKBCBW-KRWDZBQOSA-N 1 0 289.419 3.530 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)[C@@H]1COc2ccccc2C1)c1ccccc1O ZINC000895851042 1123521451 /nfs/dbraw/zinc/52/14/51/1123521451.db2.gz IIJUPZQVTPKIFR-LZWOXQAQSA-N 1 0 297.398 3.683 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C2CC(c3ccccc3)C2)c1 ZINC000113337525 1123521618 /nfs/dbraw/zinc/52/16/18/1123521618.db2.gz YWLGKDZTJRFERK-UHFFFAOYSA-N 1 0 267.372 3.736 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2ccccc2OC(C)C)c1 ZINC000113325782 1123521794 /nfs/dbraw/zinc/52/17/94/1123521794.db2.gz FOLMQXAZFUIAOU-UHFFFAOYSA-N 1 0 285.387 3.778 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C(C)(C)c2ccc(F)cc2)c1 ZINC000113335155 1123522040 /nfs/dbraw/zinc/52/20/40/1123522040.db2.gz GLMYDPLLJQKJSN-UHFFFAOYSA-N 1 0 273.351 3.865 20 10 CHCDRO Oc1ccccc1C[N@H+](Cc1cccnc1)C1CCCC1 ZINC000113506148 1123529625 /nfs/dbraw/zinc/52/96/25/1123529625.db2.gz SWGRJYOHEIPNME-UHFFFAOYSA-N 1 0 282.387 3.732 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+]2CCC[C@@H](C)[C@@H]2C)c1O ZINC001237687803 1129128732 /nfs/dbraw/zinc/12/87/32/1129128732.db2.gz VHTMLUWJEUIEBP-PWSUYJOCSA-N 1 0 267.800 3.974 20 10 CHCDRO C[C@H]([NH2+]CCCOC(F)F)c1cc2c(cc1O)CCCC2 ZINC000194033206 1129129232 /nfs/dbraw/zinc/12/92/32/1129129232.db2.gz FCOBJBUNWAKXGI-NSHDSACASA-N 1 0 299.361 3.551 20 10 CHCDRO CCO[C@@H](C[NH2+]Cc1cc(C)c(C)cc1O)c1ccccc1 ZINC000194466762 1129134135 /nfs/dbraw/zinc/13/41/35/1129134135.db2.gz FDMUKEQTMAYKFE-IBGZPJMESA-N 1 0 299.414 3.876 20 10 CHCDRO Cc1cccc(C[NH2+]Cc2cc(F)c(N(C)C)cc2F)c1 ZINC000858090452 1123629817 /nfs/dbraw/zinc/62/98/17/1123629817.db2.gz GYGZKBXNDPWUNU-UHFFFAOYSA-N 1 0 290.357 3.629 20 10 CHCDRO Cc1ccc(C(C)(C)C[NH2+]Cc2cc(C)c(C)cc2O)nc1 ZINC000858242617 1123639105 /nfs/dbraw/zinc/63/91/05/1123639105.db2.gz YMSIXLDUFNEOJA-UHFFFAOYSA-N 1 0 298.430 3.780 20 10 CHCDRO CCOc1ccc(C[NH2+]Cc2cc(C)ccc2O)c(C)c1 ZINC000858239966 1123639135 /nfs/dbraw/zinc/63/91/35/1123639135.db2.gz XKQXFDLGAKYJAF-UHFFFAOYSA-N 1 0 285.387 3.698 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2c(F)cc(C)cc2F)c1 ZINC000858239349 1123639178 /nfs/dbraw/zinc/63/91/78/1123639178.db2.gz MOBOAHZYMARMPY-UHFFFAOYSA-N 1 0 277.314 3.577 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2c(O)ccc3ccccc32)[C@H](C)[C@H](C)O1 ZINC000783544140 1123642534 /nfs/dbraw/zinc/64/25/34/1123642534.db2.gz PJXUCEUYVZDABD-MCIONIFRSA-N 1 0 285.387 3.543 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]CC2(C(F)(F)F)CCCC2)c1 ZINC000858308165 1123642578 /nfs/dbraw/zinc/64/25/78/1123642578.db2.gz SAJGORRTGLQSFW-UHFFFAOYSA-N 1 0 287.325 3.913 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@]2(C)C[C@H]3C[C@H]3C2)c1 ZINC000858538330 1123660757 /nfs/dbraw/zinc/66/07/57/1123660757.db2.gz UEJWHKUDLFYXJG-VWPFQQQWSA-N 1 0 259.393 3.787 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@]2(C)C[C@H]3C[C@H]3C2)c(O)c1 ZINC000858536610 1123660925 /nfs/dbraw/zinc/66/09/25/1123660925.db2.gz IDXKISKNXCNCGT-ZJOBFFGXSA-N 1 0 259.393 3.787 20 10 CHCDRO Cc1cccnc1[C@@H]1CCC[C@@H]([NH2+]Cc2ccccc2O)C1 ZINC000281126580 1123683368 /nfs/dbraw/zinc/68/33/68/1123683368.db2.gz DPNDKZATHHMAKY-NVXWUHKLSA-N 1 0 296.414 3.912 20 10 CHCDRO CS[C@H]1CCC[C@@H]([NH2+]Cc2ccc(N(C)C)cc2)C1 ZINC000117394257 1123728584 /nfs/dbraw/zinc/72/85/84/1123728584.db2.gz CTXYTDAIMFVXEK-ZBFHGGJFSA-N 1 0 278.465 3.516 20 10 CHCDRO Cc1cc(C)c2c(c1)C[N@@H+](Cc1ccccc1O)CC2 ZINC000777220168 1123785825 /nfs/dbraw/zinc/78/58/25/1123785825.db2.gz PBZUYOMWDMWKIH-UHFFFAOYSA-N 1 0 267.372 3.567 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CCC(F)(F)C1)c1ccc(N(C)C)cc1 ZINC000777243730 1123797402 /nfs/dbraw/zinc/79/74/02/1123797402.db2.gz XWXUVJQSIKJDKK-DZGCQCFKSA-N 1 0 282.378 3.981 20 10 CHCDRO C[C@@]1(C[NH2+]CCCSc2nccs2)CCCS1 ZINC000862280711 1123798125 /nfs/dbraw/zinc/79/81/25/1123798125.db2.gz BCDQSUCCDWAELM-LBPRGKRZSA-N 1 0 288.507 3.501 20 10 CHCDRO C[C@H]([NH2+][C@@H]1C[C@H]1c1ccccc1F)c1ccccc1O ZINC000840788678 1123801862 /nfs/dbraw/zinc/80/18/62/1123801862.db2.gz QXDOZNBVCPZAOM-HZUKXOBISA-N 1 0 271.335 3.738 20 10 CHCDRO c1nc2c(n1Cc1ccc(N3CCCCC3)cc1)CCCC2 ZINC000862431703 1123809081 /nfs/dbraw/zinc/80/90/81/1123809081.db2.gz QMWMSEGQIPGCEO-UHFFFAOYSA-N 1 0 295.430 3.801 20 10 CHCDRO C[C@H]1C[NH+](Cc2c(O)cccc2Cl)C[C@H](C)C1(F)F ZINC000862444309 1123811465 /nfs/dbraw/zinc/81/14/65/1123811465.db2.gz VEGBPWOMORMMNN-UWVGGRQHSA-N 1 0 289.753 3.769 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2CCCC(F)(F)CC2)c1O ZINC000862467425 1123812844 /nfs/dbraw/zinc/81/28/44/1123812844.db2.gz UQCDCGRHFWXPDH-UHFFFAOYSA-N 1 0 289.753 3.975 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCCC(F)(F)CC2)cc1Cl ZINC000862467100 1123813282 /nfs/dbraw/zinc/81/32/82/1123813282.db2.gz PGKMQKIIXZNXRS-UHFFFAOYSA-N 1 0 289.753 3.975 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCCC3(CC3)CC2)c1O ZINC000862538486 1123816318 /nfs/dbraw/zinc/81/63/18/1123816318.db2.gz ACMJDVXVWJDGHA-UHFFFAOYSA-N 1 0 275.392 3.557 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)c1ccc2ccccc2c1O)c1ccn(C)n1 ZINC000840818790 1123827906 /nfs/dbraw/zinc/82/79/06/1123827906.db2.gz ZQLLANPEGMAJGC-CHWSQXEVSA-N 1 0 295.386 3.691 20 10 CHCDRO CN(C)c1ccc(C[N@H+](Cc2ccccc2)C2CC2)cc1 ZINC000195667694 1129148644 /nfs/dbraw/zinc/14/86/44/1129148644.db2.gz XINIFQWIKPDZGI-UHFFFAOYSA-N 1 0 280.415 3.917 20 10 CHCDRO CC(=O)[C@@H]1CC[N@H+](Cc2cc(C)n(-c3ccccc3)c2C)C1 ZINC001137859022 1123855736 /nfs/dbraw/zinc/85/57/36/1123855736.db2.gz FLBIGBFEHBMDSW-QGZVFWFLSA-N 1 0 296.414 3.505 20 10 CHCDRO CC[C@H]([NH2+]CCN1CCCC[C@H]1C)c1ccc(C)cc1O ZINC000794794933 1123949387 /nfs/dbraw/zinc/94/93/87/1123949387.db2.gz FCBMHVSCCRMIHL-WBVHZDCISA-N 1 0 290.451 3.616 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccc(O)cc1)c1ccc(C)cc1O ZINC000794800884 1123950547 /nfs/dbraw/zinc/95/05/47/1123950547.db2.gz FEEKQVNJLBKFOM-QGZVFWFLSA-N 1 0 285.387 3.690 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](CCO)CC(C)C)c1ccc(C)cc1O ZINC000794802144 1123950610 /nfs/dbraw/zinc/95/06/10/1123950610.db2.gz MVAZOZXNXNENQM-NVXWUHKLSA-N 1 0 293.451 3.786 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccco1)c1ccc(C)cc1O ZINC000794794316 1123951482 /nfs/dbraw/zinc/95/14/82/1123951482.db2.gz LOIZWCOAKZDNMU-OAHLLOKOSA-N 1 0 259.349 3.577 20 10 CHCDRO CC[C@H]([NH2+]CCc1nc(C)cs1)c1ccc(C)cc1O ZINC000794793738 1123951495 /nfs/dbraw/zinc/95/14/95/1123951495.db2.gz BPEFGLFQKNTQDS-AWEZNQCLSA-N 1 0 290.432 3.749 20 10 CHCDRO C[C@@H]([NH2+]CCC1(C)CC1)c1cc(Cl)ccc1O ZINC000794829707 1123962193 /nfs/dbraw/zinc/96/21/93/1123962193.db2.gz WFMVBWDJLUGUPW-SNVBAGLBSA-N 1 0 253.773 3.886 20 10 CHCDRO C[C@@H]([NH2+]CCC1(C)CC1)c1cc(Br)ccc1O ZINC000794826695 1123962508 /nfs/dbraw/zinc/96/25/08/1123962508.db2.gz CSNMAJVIJZDOFA-SNVBAGLBSA-N 1 0 298.224 3.996 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cccnc1F)c1ccc(N(C)C)cc1 ZINC000794832708 1123969647 /nfs/dbraw/zinc/96/96/47/1123969647.db2.gz DBXXBPQJXPDEIA-MRXNPFEDSA-N 1 0 287.382 3.528 20 10 CHCDRO C[C@H]([NH2+]CCCc1ccccc1F)c1cc(F)ccc1O ZINC000794840680 1123989723 /nfs/dbraw/zinc/98/97/23/1123989723.db2.gz JYPZTHBJORSLTG-LBPRGKRZSA-N 1 0 291.341 3.954 20 10 CHCDRO CC[C@@](C)([NH2+]Cc1ccccc1O)c1ccc(F)cc1 ZINC000865659867 1124003339 /nfs/dbraw/zinc/00/33/39/1124003339.db2.gz GOGSFGIDZJUELF-QGZVFWFLSA-N 1 0 273.351 3.946 20 10 CHCDRO Cc1cnc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)s1 ZINC000840935237 1124030973 /nfs/dbraw/zinc/03/09/73/1124030973.db2.gz JCUUWZXEZNXDBT-CYBMUJFWSA-N 1 0 289.448 3.677 20 10 CHCDRO CC(C)CO[C@H]1CC[N@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000120893641 1124032381 /nfs/dbraw/zinc/03/23/81/1124032381.db2.gz CXQVWGVAMIFEPC-INIZCTEOSA-N 1 0 299.414 3.792 20 10 CHCDRO CC(C)(C)c1ccncc1C[NH2+]Cc1cc(F)ccc1O ZINC000840959919 1124044055 /nfs/dbraw/zinc/04/40/55/1124044055.db2.gz YCWUCJLUFWFUQZ-UHFFFAOYSA-N 1 0 288.366 3.514 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC[C@@H]2CCSC2)c(O)c1C ZINC000866401881 1124062874 /nfs/dbraw/zinc/06/28/74/1124062874.db2.gz GAWKUNVFXSLLQD-UONOGXRCSA-N 1 0 279.449 3.803 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)o1 ZINC000866477959 1124069834 /nfs/dbraw/zinc/06/98/34/1124069834.db2.gz HCPJHUMHJUFROC-JTQLQIEISA-N 1 0 265.740 3.798 20 10 CHCDRO CS[C@H]1C[C@H]([NH2+][C@H](C)c2c(C)cc(C)cc2O)C1 ZINC000866488325 1124072639 /nfs/dbraw/zinc/07/26/39/1124072639.db2.gz MZTGXCBPAXYEQZ-JHJVBQTASA-N 1 0 265.422 3.554 20 10 CHCDRO C[C@@H]1C[C@@H]([NH2+][C@@H]2C[C@H]2C(F)(F)F)c2c1c(F)ccc2O ZINC000866499021 1124073231 /nfs/dbraw/zinc/07/32/31/1124073231.db2.gz CWQBXKAJGJTLPP-KHUVANEUSA-N 1 0 289.272 3.620 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1C[C@H]1C(F)(F)F)c1ccc(C)cc1O ZINC000866501264 1124073442 /nfs/dbraw/zinc/07/34/42/1124073442.db2.gz ZXIWPSHZNFOGFS-IJLUTSLNSA-N 1 0 273.298 3.692 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2c3ccccc3CN2C)c1 ZINC000866564452 1124083205 /nfs/dbraw/zinc/08/32/05/1124083205.db2.gz VPFVXIJHIYTZCQ-KBXCAEBGSA-N 1 0 296.414 3.538 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@H](CF)c1ccc(F)cc1)CC2 ZINC000866597087 1124086393 /nfs/dbraw/zinc/08/63/93/1124086393.db2.gz MRNZWNMWJSSEBG-LSDHHAIUSA-N 1 0 289.325 3.819 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H]2CCCn3nccc32)cc1 ZINC000866633585 1124092036 /nfs/dbraw/zinc/09/20/36/1124092036.db2.gz WCIBVSLPOCIBLJ-YOEHRIQHSA-N 1 0 298.434 3.525 20 10 CHCDRO COC[C@H]([NH2+][C@H](C)c1ccc2ccccc2c1O)C(C)C ZINC000086683224 1129166493 /nfs/dbraw/zinc/16/64/93/1129166493.db2.gz AUHJOALZCLSJEZ-DYVFJYSZSA-N 1 0 287.403 3.867 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2c(O)ccc3ccncc32)cc1 ZINC000021964434 1124107042 /nfs/dbraw/zinc/10/70/42/1124107042.db2.gz ZZWXJNQDJUFUGA-UHFFFAOYSA-N 1 0 292.382 3.881 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]Cc1ccnc(F)c1 ZINC001118994278 1131244920 /nfs/dbraw/zinc/24/49/20/1131244920.db2.gz SCPUKTTZNZTPRF-YPMHNXCESA-N 1 0 286.350 3.573 20 10 CHCDRO COc1cc(C)cc(C[NH2+]Cc2cscc2Cl)c1O ZINC001119517037 1131256706 /nfs/dbraw/zinc/25/67/06/1131256706.db2.gz MDEQLYAEDJFKIC-UHFFFAOYSA-N 1 0 297.807 3.714 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCc2cc(F)ccc21 ZINC000122656190 1124519531 /nfs/dbraw/zinc/51/95/31/1124519531.db2.gz BDQPKPZYPUFGMK-IBGZPJMESA-N 1 0 298.405 3.977 20 10 CHCDRO CC[C@H]([NH2+]Cc1ncc(C)s1)c1ccc(N(C)C)cc1 ZINC000122940052 1124545813 /nfs/dbraw/zinc/54/58/13/1124545813.db2.gz OZJHGGIHTPASOR-HNNXBMFYSA-N 1 0 289.448 3.758 20 10 CHCDRO COc1ccc(CC[NH2+][C@H](C)c2ccc(N(C)C)cc2)cc1 ZINC000123727789 1124624805 /nfs/dbraw/zinc/62/48/05/1124624805.db2.gz CTDAUESDIPSDER-OAHLLOKOSA-N 1 0 298.430 3.655 20 10 CHCDRO COCC(C)(C)CC[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000872104741 1124682319 /nfs/dbraw/zinc/68/23/19/1124682319.db2.gz OIHQXTYCWIXSBO-DGCLKSJQSA-N 1 0 295.398 3.732 20 10 CHCDRO Cc1nccnc1[C@H](C)[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000872129719 1124690113 /nfs/dbraw/zinc/69/01/13/1124690113.db2.gz ATZPFKDZPBOQQJ-KOLCDFICSA-N 1 0 291.782 3.556 20 10 CHCDRO CCCOc1ccc(C[NH2+]Cc2ccccc2CO)cc1C ZINC000873020707 1124734413 /nfs/dbraw/zinc/73/44/13/1124734413.db2.gz ASWZBVOUIXXZMR-UHFFFAOYSA-N 1 0 299.414 3.566 20 10 CHCDRO CCCOc1ccc(C[NH2+]Cc2ccccc2O)cc1C ZINC000873035820 1124735061 /nfs/dbraw/zinc/73/50/61/1124735061.db2.gz PDVSSRVJBKMJLL-UHFFFAOYSA-N 1 0 285.387 3.779 20 10 CHCDRO CCCOc1ccc(C[NH2+][C@@H](C)c2nccnc2C)cc1C ZINC000873186111 1124748326 /nfs/dbraw/zinc/74/83/26/1124748326.db2.gz FGYCENCQIRSFLO-HNNXBMFYSA-N 1 0 299.418 3.733 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]C2(C)CC(F)(F)C2)cc1 ZINC000873197592 1124751698 /nfs/dbraw/zinc/75/16/98/1124751698.db2.gz IXRONWWIGLILRV-SNAWJCMRSA-N 1 0 280.362 3.543 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2cc(N)cc(F)c2)c(O)c1C ZINC000873289436 1124761263 /nfs/dbraw/zinc/76/12/63/1124761263.db2.gz UXICFSFVBUVTHH-LBPRGKRZSA-N 1 0 288.366 3.581 20 10 CHCDRO Oc1cccc(Cl)c1C[NH+]1C[C@H]2CCCC[C@@H]2C1 ZINC000310780069 1124910932 /nfs/dbraw/zinc/91/09/32/1124910932.db2.gz FIHOWEZFWVXIMA-VXGBXAGGSA-N 1 0 265.784 3.668 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)CCC[C@@H]2CCO2)cc1 ZINC000876550870 1124959283 /nfs/dbraw/zinc/95/92/83/1124959283.db2.gz FDODVEVPIOFNJC-GOSISDBHSA-N 1 0 290.451 3.534 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCCc2ccccc2)c(O)c1 ZINC000021813599 1124972342 /nfs/dbraw/zinc/97/23/42/1124972342.db2.gz VBFVDMWHNFCUEH-OAHLLOKOSA-N 1 0 269.388 3.984 20 10 CHCDRO Cc1nc(C)c([C@@H](C)[N@H+](C)Cc2ccc(C)cc2O)s1 ZINC000876716324 1124973533 /nfs/dbraw/zinc/97/35/33/1124973533.db2.gz YLYJFSSNHUWSCJ-GFCCVEGCSA-N 1 0 290.432 3.967 20 10 CHCDRO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1ccc(C)cc1O ZINC000876942373 1124991503 /nfs/dbraw/zinc/99/15/03/1124991503.db2.gz XPXFZBJLZGJWHB-LBPRGKRZSA-N 1 0 289.350 3.699 20 10 CHCDRO CSc1ccc(C[NH2+]Cc2ccc(C)cc2O)cc1 ZINC000876969756 1124993796 /nfs/dbraw/zinc/99/37/96/1124993796.db2.gz YYEKJVODEWKIOB-UHFFFAOYSA-N 1 0 273.401 3.712 20 10 CHCDRO COc1ccc(Cl)cc1C[NH2+]Cc1c(C)cccc1O ZINC000876982471 1124994828 /nfs/dbraw/zinc/99/48/28/1124994828.db2.gz APTGINUNHPNIIX-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H]2c3ccccc3C[C@H]2C)c(O)c1 ZINC000877008566 1124996085 /nfs/dbraw/zinc/99/60/85/1124996085.db2.gz NCKFWNWPURTFFI-ACJLOTCBSA-N 1 0 267.372 3.724 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]C[C@@H](c1cccnc1)C(C)C ZINC000877082500 1125006838 /nfs/dbraw/zinc/00/68/38/1125006838.db2.gz WFYVQXQLPZZOTM-MRXNPFEDSA-N 1 0 284.403 3.625 20 10 CHCDRO Cc1ccc(C[NH2+]C[C@@H](c2cccnc2)C(C)C)c(O)c1 ZINC000877081999 1125007184 /nfs/dbraw/zinc/00/71/84/1125007184.db2.gz KHGIWHFACVPTOI-QGZVFWFLSA-N 1 0 284.403 3.625 20 10 CHCDRO Cc1cccc(C)c1C[NH2+]Cc1c(C)cccc1O ZINC000877112796 1125010615 /nfs/dbraw/zinc/01/06/15/1125010615.db2.gz ZXIKSZSZBJQITR-UHFFFAOYSA-N 1 0 255.361 3.607 20 10 CHCDRO CCC(CC)[C@H]1C[C@H]([NH2+]Cc2ccc(C)cc2O)CCO1 ZINC000877166465 1125016278 /nfs/dbraw/zinc/01/62/78/1125016278.db2.gz AMKCOMKIADTRMF-SJLPKXTDSA-N 1 0 291.435 3.774 20 10 CHCDRO Cc1ccc(C[NH2+]C2(C)CCC(F)(F)CC2)c(O)c1 ZINC000877303482 1125022082 /nfs/dbraw/zinc/02/20/82/1125022082.db2.gz IVBDOWARVHJOAV-UHFFFAOYSA-N 1 0 269.335 3.758 20 10 CHCDRO Cc1cccc(O)c1C[NH2+][C@@H]1CCCc2sccc21 ZINC000877386295 1125025707 /nfs/dbraw/zinc/02/57/07/1125025707.db2.gz HZCMWJQMYVBLKG-CQSZACIVSA-N 1 0 273.401 3.929 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+]1CC(C)(C)[C@@H]1c1cccnc1 ZINC000877547072 1125043496 /nfs/dbraw/zinc/04/34/96/1125043496.db2.gz WLLAHJZTQNJWPJ-KRWDZBQOSA-N 1 0 282.387 3.679 20 10 CHCDRO Cc1ccc2c(c1)[C@H]([NH2+]Cc1c(C)cccc1O)CC2 ZINC000877613133 1125054383 /nfs/dbraw/zinc/05/43/83/1125054383.db2.gz XUNXJOQRNISTNC-QGZVFWFLSA-N 1 0 267.372 3.786 20 10 CHCDRO Cc1ncc([C@H](C)[NH2+]Cc2cc(Cl)cc(C)c2O)s1 ZINC000877684933 1125062418 /nfs/dbraw/zinc/06/24/18/1125062418.db2.gz DITKDTFSOJHUAG-VIFPVBQESA-N 1 0 296.823 3.970 20 10 CHCDRO C[C@H]([NH2+][C@@H]1Cc2[nH]c3ccccc3c2C1)c1ccccc1O ZINC000877758258 1125073867 /nfs/dbraw/zinc/07/38/67/1125073867.db2.gz PMTJIVYFMIKSRV-STQMWFEESA-N 1 0 292.382 3.692 20 10 CHCDRO CSCc1cnc(C[NH2+][C@@H](C)c2ccccc2O)s1 ZINC000877758370 1125075176 /nfs/dbraw/zinc/07/51/76/1125075176.db2.gz WNBHDLILUBEIJS-JTQLQIEISA-N 1 0 294.445 3.563 20 10 CHCDRO Cc1cc(C)c(C[NH2+][C@@H](C)c2ccccc2O)c(C)n1 ZINC000879649728 1125222926 /nfs/dbraw/zinc/22/29/26/1125222926.db2.gz FFOZSSRZSAPPHT-ZDUSSCGKSA-N 1 0 270.376 3.563 20 10 CHCDRO COc1cccc(C[NH2+]C(C)(C)c2cccc(C)c2)c1O ZINC000130445809 1125360892 /nfs/dbraw/zinc/36/08/92/1125360892.db2.gz WEHACAHGQORFGA-UHFFFAOYSA-N 1 0 285.387 3.734 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]CC(C)(C)CC(F)F)c1 ZINC000883259552 1125387210 /nfs/dbraw/zinc/38/72/10/1125387210.db2.gz QGPSFKUVPCKKKO-JTQLQIEISA-N 1 0 287.350 3.733 20 10 CHCDRO CO[C@@H](C[NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1ccccc1 ZINC000131428469 1125391317 /nfs/dbraw/zinc/39/13/17/1125391317.db2.gz MJCZRAPEGVJQPD-KXBFYZLASA-N 1 0 298.430 3.791 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@@H]2C[C@@H]3CCCC[C@H]23)c1O ZINC000883321885 1125396317 /nfs/dbraw/zinc/39/63/17/1125396317.db2.gz OSSGKZVYXBSDEZ-PAPYEOQZSA-N 1 0 275.392 3.630 20 10 CHCDRO CCCC[NH+](CCCC)Cc1cccc(OC)c1O ZINC000131558355 1125397749 /nfs/dbraw/zinc/39/77/49/1125397749.db2.gz HQGXTWGMQGMXJC-UHFFFAOYSA-N 1 0 265.397 3.803 20 10 CHCDRO C[C@H]([NH2+]C[C@]1(C)OCCc2ccccc21)c1ccccc1O ZINC000883339972 1125397790 /nfs/dbraw/zinc/39/77/90/1125397790.db2.gz GNGKWDHMLZGUMQ-LIRRHRJNSA-N 1 0 297.398 3.531 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+](C)[C@@H]2CCc3ccccc32)c1 ZINC000131988123 1125412308 /nfs/dbraw/zinc/41/23/08/1125412308.db2.gz BBSGVKYFBIKIFC-QGZVFWFLSA-N 1 0 267.372 3.820 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+](C)[C@H]2CCc3ccccc32)c1 ZINC000131988332 1125412550 /nfs/dbraw/zinc/41/25/50/1125412550.db2.gz BBSGVKYFBIKIFC-KRWDZBQOSA-N 1 0 267.372 3.820 20 10 CHCDRO CCSCC[C@H](C)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000132241700 1125416435 /nfs/dbraw/zinc/41/64/35/1125416435.db2.gz SPYVYFGMLXAJML-KBPBESRZSA-N 1 0 280.481 3.935 20 10 CHCDRO CC1CCC([N@H+](C)Cc2ccc(N(C)C)cc2)CC1 ZINC001168221724 1125418313 /nfs/dbraw/zinc/41/83/13/1125418313.db2.gz NDECIFWMWLDQFQ-UHFFFAOYSA-N 1 0 260.425 3.763 20 10 CHCDRO CCC[N@@H+](Cc1ccc(N(C)C)c(C)c1)CC1CC1 ZINC001139669696 1131353869 /nfs/dbraw/zinc/35/38/69/1131353869.db2.gz HVCLLCIFOSZUHA-UHFFFAOYSA-N 1 0 260.425 3.683 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]CC2=CCCCC2)cc1 ZINC001202594912 1125441160 /nfs/dbraw/zinc/44/11/60/1125441160.db2.gz BQTRQSCUWDRVDB-RMKNXTFCSA-N 1 0 270.420 3.856 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(C)c(F)c2)c1 ZINC000184910101 1129261804 /nfs/dbraw/zinc/26/18/04/1129261804.db2.gz ABNXKFQLFYLAIZ-LBPRGKRZSA-N 1 0 289.350 3.699 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccccc1F ZINC000037764535 1129266979 /nfs/dbraw/zinc/26/69/79/1129266979.db2.gz YNODWLQZNOTTTD-GFCCVEGCSA-N 1 0 271.335 3.611 20 10 CHCDRO CC(C)C[C@H]1COCC[N@@H+]1Cc1c(O)ccc2ccccc21 ZINC000733790085 1129270535 /nfs/dbraw/zinc/27/05/35/1129270535.db2.gz FLRLAJUAPONNCW-INIZCTEOSA-N 1 0 299.414 3.792 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CCc3cccc(F)c3C2)cc1C ZINC001170976719 1131365053 /nfs/dbraw/zinc/36/50/53/1131365053.db2.gz WVLYQRVZOSTCMI-MRXNPFEDSA-N 1 0 299.389 3.790 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCOC1)c1ccc(N2CCCCCC2)cc1 ZINC000090774535 1129330446 /nfs/dbraw/zinc/33/04/46/1129330446.db2.gz MOSHDOYEOGRCDG-RDJZCZTQSA-N 1 0 288.435 3.507 20 10 CHCDRO CS[C@@H]1CCC[C@H]([NH2+]Cc2ccc(N(C)C)c(F)c2)C1 ZINC000735324593 1129339213 /nfs/dbraw/zinc/33/92/13/1129339213.db2.gz UIBZPCQUMMMYTQ-UONOGXRCSA-N 1 0 296.455 3.656 20 10 CHCDRO COCCCC[N@H+](Cc1ccccc1O)C1CCCC1 ZINC000735493936 1129349209 /nfs/dbraw/zinc/34/92/09/1129349209.db2.gz TUROFVXAYPEWHR-UHFFFAOYSA-N 1 0 277.408 3.563 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H](C)[C@@H]2CCCCO2)cc1 ZINC000379300143 1129358408 /nfs/dbraw/zinc/35/84/08/1129358408.db2.gz OYLSWCPZNPUGMR-QAPCUYQASA-N 1 0 290.451 3.580 20 10 CHCDRO C[C@@H]1C[C@H]1c1ccc(C[N@H+](C)Cc2ccccc2O)o1 ZINC000091974433 1129376229 /nfs/dbraw/zinc/37/62/29/1129376229.db2.gz QFRVYBNEOQMGLH-IUODEOHRSA-N 1 0 271.360 3.741 20 10 CHCDRO COc1cccc(C[NH2+]C[C@@H]2CCC[C@@H](C)[C@@H]2C)c1O ZINC000795588908 1129378959 /nfs/dbraw/zinc/37/89/59/1129378959.db2.gz QOELZYHBXBSQKR-RDBSUJKOSA-N 1 0 277.408 3.563 20 10 CHCDRO Cc1cc(C[N@H+]2CCSC[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC000738283266 1129391530 /nfs/dbraw/zinc/39/15/30/1129391530.db2.gz DEZIRWHBGVSAJD-CYBMUJFWSA-N 1 0 293.476 3.935 20 10 CHCDRO Cc1cc(C[N@H+]2CCSC[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC000738283267 1129392296 /nfs/dbraw/zinc/39/22/96/1129392296.db2.gz DEZIRWHBGVSAJD-ZDUSSCGKSA-N 1 0 293.476 3.935 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC=C(c3ccco3)C2)cc1C ZINC000795652272 1129407366 /nfs/dbraw/zinc/40/73/66/1129407366.db2.gz WWIIEBWJNYISAD-UHFFFAOYSA-N 1 0 283.371 3.891 20 10 CHCDRO CCO[C@@H]1C[C@H]([NH2+][C@H](C)c2ccccc2O)C12CCCC2 ZINC000248388104 1129416029 /nfs/dbraw/zinc/41/60/29/1129416029.db2.gz QKQSUIJRXQZVQO-XOKHGSTOSA-N 1 0 289.419 3.781 20 10 CHCDRO CCCO[C@@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)CC1 ZINC000093317123 1129421069 /nfs/dbraw/zinc/42/10/69/1129421069.db2.gz ZCNMYJDDLKDVRX-OAHLLOKOSA-N 1 0 297.826 3.827 20 10 CHCDRO CCS[C@@H]1CCCC[N@H+](Cc2cccc(OC)c2O)C1 ZINC000093361815 1129422354 /nfs/dbraw/zinc/42/23/54/1129422354.db2.gz LUODKQAPHZCJHR-CQSZACIVSA-N 1 0 295.448 3.508 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCCO[C@H]2CC(C)C)c(O)c1 ZINC000248589890 1129423830 /nfs/dbraw/zinc/42/38/30/1129423830.db2.gz YZMQTROSMSTNHR-ZVZYQTTQSA-N 1 0 291.435 3.945 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCS[C@H]3CCCC[C@@H]32)c1 ZINC000093690283 1129427132 /nfs/dbraw/zinc/42/71/32/1129427132.db2.gz ONDZUCMEOFNYOJ-HOCLYGCPSA-N 1 0 277.433 3.561 20 10 CHCDRO CCS[C@H]1CC[C@H]([N@H+](C)Cc2cc(C)ccc2O)C1 ZINC000093868898 1129428646 /nfs/dbraw/zinc/42/86/46/1129428646.db2.gz PTYRMXCXPXMXPZ-GJZGRUSLSA-N 1 0 279.449 3.807 20 10 CHCDRO Cc1cc(C[N@@H+]2CCC3(CCCC3)C2)ccc1N(C)C ZINC001139670910 1131374307 /nfs/dbraw/zinc/37/43/07/1131374307.db2.gz FLQCAIZQFHFBDJ-UHFFFAOYSA-N 1 0 272.436 3.827 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccc(F)cc1)c1cc(F)ccc1O ZINC000094616590 1129448464 /nfs/dbraw/zinc/44/84/64/1129448464.db2.gz QIJLTLIEWCNQRG-LLVKDONJSA-N 1 0 277.314 3.564 20 10 CHCDRO C[C@@H]([NH2+]C[C@]1(C)CCCO1)c1ccc2ccccc2c1O ZINC000094797010 1129452541 /nfs/dbraw/zinc/45/25/41/1129452541.db2.gz VAYKFYBWPBQYJI-ACJLOTCBSA-N 1 0 285.387 3.765 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]C1CCC(C)CC1 ZINC000742371255 1129475570 /nfs/dbraw/zinc/47/55/70/1129475570.db2.gz MKUZCAWUTGLXNS-UHFFFAOYSA-N 1 0 260.425 3.729 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H]2CC[C@@H]3CCC[C@H]3C2)c1O ZINC000742378689 1129476036 /nfs/dbraw/zinc/47/60/36/1129476036.db2.gz JQTRQKDNIMSYPK-OFQRWUPVSA-N 1 0 289.419 3.849 20 10 CHCDRO Cc1ccc(CC[C@@H](C)[NH2+]Cc2ccc3c(c2)CCO3)o1 ZINC000742380324 1129476064 /nfs/dbraw/zinc/47/60/64/1129476064.db2.gz OHRLZNBKCFFAPK-CYBMUJFWSA-N 1 0 285.387 3.634 20 10 CHCDRO COc1ccc(N2CC[C@H](C[NH2+]CCC(C)(C)C)C2)cc1 ZINC000822494191 1131381159 /nfs/dbraw/zinc/38/11/59/1131381159.db2.gz IUPFJJQNJVVKGO-OAHLLOKOSA-N 1 0 290.451 3.547 20 10 CHCDRO C[C@@H](C[NH2+]Cc1c(O)cccc1Cl)C(C)(C)C ZINC000096610172 1129544733 /nfs/dbraw/zinc/54/47/33/1129544733.db2.gz RGZYDOGTWGTLDZ-JTQLQIEISA-N 1 0 255.789 3.817 20 10 CHCDRO CC1(C2([NH2+]Cc3ccc(Br)cc3O)CC2)CC1 ZINC000691418332 1129573668 /nfs/dbraw/zinc/57/36/68/1129573668.db2.gz ZTXISEZNFQIYIR-UHFFFAOYSA-N 1 0 296.208 3.577 20 10 CHCDRO C[C@H]1CC[N@H+](Cc2c(O)cccc2Cl)C[C@H]1C ZINC000252738231 1129592011 /nfs/dbraw/zinc/59/20/11/1129592011.db2.gz AADSSOBQWGMYGS-WDEREUQCSA-N 1 0 253.773 3.524 20 10 CHCDRO CSCCCCC[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000186782334 1129634648 /nfs/dbraw/zinc/63/46/48/1129634648.db2.gz BOXIMHSSRHYCMG-CQSZACIVSA-N 1 0 280.481 3.937 20 10 CHCDRO Cc1cc(C[N@@H+]2CC[C@H]3C[C@H]32)ccc1N1CCCCC1 ZINC000828533724 1131389380 /nfs/dbraw/zinc/38/93/80/1131389380.db2.gz JUOQNSCEAFDQJO-FUHWJXTLSA-N 1 0 270.420 3.580 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2C[C@H](OC)C2(C)C)cc1 ZINC000766531200 1129683986 /nfs/dbraw/zinc/68/39/86/1129683986.db2.gz ZQNWCPHIJDKYFY-XKQJLSEDSA-N 1 0 290.451 3.607 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H](C)C[C@H]2CCOC2)cc1 ZINC000766579920 1129693771 /nfs/dbraw/zinc/69/37/71/1129693771.db2.gz CDUYIWOZEQIWGA-OWCLPIDISA-N 1 0 290.451 3.608 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)C[C@H]1CCOC1)c1ccc(N(C)C)cc1 ZINC000766582274 1129697626 /nfs/dbraw/zinc/69/76/26/1129697626.db2.gz QDMJPPSLFUFFND-DAYGRLMNSA-N 1 0 290.451 3.608 20 10 CHCDRO CC1(C[NH2+]Cc2cc(Cl)ccc2O)CC(F)(F)C1 ZINC000720976100 1129732030 /nfs/dbraw/zinc/73/20/30/1129732030.db2.gz BXCHHYLPPWZSMS-UHFFFAOYSA-N 1 0 275.726 3.571 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C[C@H]2C[C@H]2c2ccccc2)cc1F ZINC000767363967 1129788783 /nfs/dbraw/zinc/78/87/83/1129788783.db2.gz NDIAACYFQJNSRL-SJORKVTESA-N 1 0 298.405 3.785 20 10 CHCDRO Cc1cc(C[NH2+]Cc2cc(Cl)ccc2O)cs1 ZINC000381122234 1129834517 /nfs/dbraw/zinc/83/45/17/1129834517.db2.gz FKDKZCVFLWADSZ-UHFFFAOYSA-N 1 0 267.781 3.705 20 10 CHCDRO Cc1cc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)cs1 ZINC000381283944 1129836085 /nfs/dbraw/zinc/83/60/85/1129836085.db2.gz LWNHWCQIMLOKDV-ZDUSSCGKSA-N 1 0 274.433 3.973 20 10 CHCDRO C[N@H+](Cc1cccc(F)c1)Cc1cc(Cl)ccc1O ZINC000768161297 1129837480 /nfs/dbraw/zinc/83/74/80/1129837480.db2.gz WPZXRHWBILQACM-UHFFFAOYSA-N 1 0 279.742 3.817 20 10 CHCDRO Cc1ccc(O)c(C[N@H+](C)CCOc2ccccc2C)c1 ZINC000768211819 1129840377 /nfs/dbraw/zinc/84/03/77/1129840377.db2.gz DPVRRUYTZWGWOV-UHFFFAOYSA-N 1 0 285.387 3.520 20 10 CHCDRO Cc1cncc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)c1 ZINC000768222604 1129844494 /nfs/dbraw/zinc/84/44/94/1129844494.db2.gz HBTBXGYIYGORTO-HNNXBMFYSA-N 1 0 283.419 3.615 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CC[C@H](c3ccccc3)C2)c(O)c1 ZINC000768359290 1129853142 /nfs/dbraw/zinc/85/31/42/1129853142.db2.gz CCLYRLWIGDLLNG-INIZCTEOSA-N 1 0 297.398 3.780 20 10 CHCDRO Cc1ncccc1C[N@@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000768356915 1129853323 /nfs/dbraw/zinc/85/33/23/1129853323.db2.gz DCTUMDKOMVHFCN-UHFFFAOYSA-N 1 0 297.446 3.867 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@@H]1c1ccccn1 ZINC000768360233 1129854049 /nfs/dbraw/zinc/85/40/49/1129854049.db2.gz LOCQPZMVKTXDCZ-OAHLLOKOSA-N 1 0 288.778 3.778 20 10 CHCDRO COc1cccc(C[NH2+][C@@H](C)[C@@H]2CC3CCC2CC3)c1O ZINC000382126134 1129854566 /nfs/dbraw/zinc/85/45/66/1129854566.db2.gz MFADNZJWMDQRGP-USPMSXPRSA-N 1 0 289.419 3.705 20 10 CHCDRO COc1cc(C[N@@H+]2CC[C@H]2c2ccccc2)c(O)cc1C ZINC000768439395 1129855780 /nfs/dbraw/zinc/85/57/80/1129855780.db2.gz LFAQBMQBQMXPTB-INIZCTEOSA-N 1 0 283.371 3.656 20 10 CHCDRO COc1cc(C[N@H+](C)C[C@H](C)c2ccccc2)c(O)cc1C ZINC000768452724 1129857354 /nfs/dbraw/zinc/85/73/54/1129857354.db2.gz RTKDYISGIVSYBE-HNNXBMFYSA-N 1 0 299.414 3.945 20 10 CHCDRO COc1cc(C[NH2+]C2(c3ccccc3)CCC2)c(O)cc1C ZINC000768443544 1129857590 /nfs/dbraw/zinc/85/75/90/1129857590.db2.gz GAFYPNLLKNUODE-UHFFFAOYSA-N 1 0 297.398 3.878 20 10 CHCDRO Oc1cc2c(cc1C[N@@H+]1CC[C@@H](c3ccco3)C1)CCCC2 ZINC000768446482 1129858262 /nfs/dbraw/zinc/85/82/62/1129858262.db2.gz KPSHVLHRRWDVIR-MRXNPFEDSA-N 1 0 297.398 3.854 20 10 CHCDRO CCC1(CC)C[N@H+](Cc2c(O)cccc2OC)CCS1 ZINC000768527170 1129860100 /nfs/dbraw/zinc/86/01/00/1129860100.db2.gz DCUMDSNJNPXEFU-UHFFFAOYSA-N 1 0 295.448 3.508 20 10 CHCDRO COc1ccc(O)c(C[NH2+]CCC2=CCCCCC2)c1 ZINC000768533103 1129860722 /nfs/dbraw/zinc/86/07/22/1129860722.db2.gz GMZMAWQIQTZTBN-UHFFFAOYSA-N 1 0 275.392 3.771 20 10 CHCDRO CCOc1ccc(C[NH2+]CC2CCC(F)(F)CC2)c(O)c1 ZINC000800293576 1129864918 /nfs/dbraw/zinc/86/49/18/1129864918.db2.gz GMBQCCVJBNVCKT-UHFFFAOYSA-N 1 0 299.361 3.706 20 10 CHCDRO COc1ccc(C[NH2+]C2(C)Cc3ccccc3C2)cc1C ZINC000768662055 1129867468 /nfs/dbraw/zinc/86/74/68/1129867468.db2.gz OKRSRGDMLKESTO-UHFFFAOYSA-N 1 0 281.399 3.651 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[NH2+][C@@H]1CCC12CCC2 ZINC000800476052 1129876160 /nfs/dbraw/zinc/87/61/60/1129876160.db2.gz GJUZJAXXAROQGP-QGZVFWFLSA-N 1 0 270.420 3.709 20 10 CHCDRO C[N@H+](Cc1ccc2c(c1)CC(C)(C)O2)Cc1ccccc1O ZINC000768872113 1129878188 /nfs/dbraw/zinc/87/81/88/1129878188.db2.gz DAMXDRFWWYGICU-UHFFFAOYSA-N 1 0 297.398 3.738 20 10 CHCDRO CCSCCC[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000800492107 1129879544 /nfs/dbraw/zinc/87/95/44/1129879544.db2.gz BXSQCQSGCQTLTB-JQWIXIFHSA-N 1 0 283.412 3.812 20 10 CHCDRO C[N@H+](Cc1c(O)cccc1Cl)C1Cc2ccccc2C1 ZINC000769033234 1129886222 /nfs/dbraw/zinc/88/62/22/1129886222.db2.gz JWNLELMQNWKQQD-UHFFFAOYSA-N 1 0 287.790 3.645 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCC[C@@H]2c2ccc(O)cc2)c1 ZINC000769106808 1129891299 /nfs/dbraw/zinc/89/12/99/1129891299.db2.gz ODZHSDNZVZDGJS-QGZVFWFLSA-N 1 0 283.371 3.743 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H]2CCC[C@H]2CCCF)cc1F ZINC000800969565 1129900803 /nfs/dbraw/zinc/90/08/03/1129900803.db2.gz RKVVANKGRPJEJM-HOCLYGCPSA-N 1 0 296.405 3.900 20 10 CHCDRO COc1cccc(O)c1C[N@H+](CC1CC1)C1CCCCC1 ZINC000769307903 1129900984 /nfs/dbraw/zinc/90/09/84/1129900984.db2.gz LSNOQXXILYENPO-UHFFFAOYSA-N 1 0 289.419 3.946 20 10 CHCDRO c1csc(SCCC[NH2+][C@H]2CC[C@H]2C2CCC2)n1 ZINC000800972000 1129901122 /nfs/dbraw/zinc/90/11/22/1129901122.db2.gz ZRNWYBRKRNZQIA-STQMWFEESA-N 1 0 282.478 3.794 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCC[C@H]2C(C)(C)C)c1O ZINC000769308699 1129901288 /nfs/dbraw/zinc/90/12/88/1129901288.db2.gz AXQAVYLIQRDKME-HNNXBMFYSA-N 1 0 277.408 3.801 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+](C)C[C@H](C)c2ccccc2)c1 ZINC000769319554 1129902134 /nfs/dbraw/zinc/90/21/34/1129902134.db2.gz VLMZXQIUQTTZFU-HNNXBMFYSA-N 1 0 269.388 3.936 20 10 CHCDRO CCC(C)(C)[N@H+](C)Cc1ccc(N(C)C)c(F)c1 ZINC000769379913 1129905218 /nfs/dbraw/zinc/90/52/18/1129905218.db2.gz CPVCFZFKGUHMSB-UHFFFAOYSA-N 1 0 252.377 3.512 20 10 CHCDRO CC[C@H]1[C@H](C)CC[N@@H+]1Cc1cc(Cl)cc(OC)c1O ZINC000384283162 1129905778 /nfs/dbraw/zinc/90/57/78/1129905778.db2.gz OTRASADWMMJYME-MFKMUULPSA-N 1 0 283.799 3.675 20 10 CHCDRO C[C@@H]1CSCC[N@@H+]1Cc1cc(-c2ccccc2)ccc1O ZINC000769428278 1129908030 /nfs/dbraw/zinc/90/80/30/1129908030.db2.gz PNOFHKFNPMALDG-CQSZACIVSA-N 1 0 299.439 3.997 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCS[C@@H](c3ccccc3)C2)c1 ZINC000769426327 1129908551 /nfs/dbraw/zinc/90/85/51/1129908551.db2.gz PZLZLTLCTMFVSV-GOSISDBHSA-N 1 0 299.439 3.991 20 10 CHCDRO COc1cccc(O)c1C[N@@H+]1C[C@H](c2ccccc2)C[C@H]1C ZINC000769445513 1129910449 /nfs/dbraw/zinc/91/04/49/1129910449.db2.gz JZAOPGGSILOFLB-GDBMZVCRSA-N 1 0 297.398 3.779 20 10 CHCDRO COc1cccc(O)c1C[N@H+](C)[C@@H](C)Cc1ccc(C)cc1 ZINC000769464470 1129912064 /nfs/dbraw/zinc/91/20/64/1129912064.db2.gz YCUDGPGEHSRCAT-HNNXBMFYSA-N 1 0 299.414 3.772 20 10 CHCDRO CC[C@@H](C)[C@@H]1CCCC[N@@H+]1Cc1cccc(OC)c1O ZINC000769466980 1129912101 /nfs/dbraw/zinc/91/21/01/1129912101.db2.gz RRQWXLZEPHOYEJ-HIFRSBDPSA-N 1 0 277.408 3.801 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CCOC2(CCCCC2)C1 ZINC000769492914 1129913089 /nfs/dbraw/zinc/91/30/89/1129913089.db2.gz OVQLAJHEHOSIAA-UHFFFAOYSA-N 1 0 295.810 3.581 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CC[C@@H]1Cc1ccccc1 ZINC000769506161 1129913774 /nfs/dbraw/zinc/91/37/74/1129913774.db2.gz NIIBIIHDMLOSKI-MRXNPFEDSA-N 1 0 287.790 3.863 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CC[C@H]1Cc1ccccc1 ZINC000769506159 1129914172 /nfs/dbraw/zinc/91/41/72/1129914172.db2.gz NIIBIIHDMLOSKI-INIZCTEOSA-N 1 0 287.790 3.863 20 10 CHCDRO CCOc1ccc(C[NH+]2C3CCCC2CCC3)c(O)c1 ZINC000769498050 1129914336 /nfs/dbraw/zinc/91/43/36/1129914336.db2.gz DOOMAGXWXOJBRV-UHFFFAOYSA-N 1 0 275.392 3.698 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2C[C@@H](C)[C@@H]2c2ccccc2)c1 ZINC000769541279 1129916117 /nfs/dbraw/zinc/91/61/17/1129916117.db2.gz TXCZYWOCSHVHOP-AUUYWEPGSA-N 1 0 297.398 3.984 20 10 CHCDRO CCC[C@@H](C)[C@@H]1CCC[N@@H+]1Cc1c(O)cccc1OC ZINC000769536644 1129916368 /nfs/dbraw/zinc/91/63/68/1129916368.db2.gz CEAKINSKSOFHON-HIFRSBDPSA-N 1 0 277.408 3.801 20 10 CHCDRO CCOc1ccc(C[N@H+](CC)C[C@H](C)CC)c(O)c1 ZINC000769538789 1129916648 /nfs/dbraw/zinc/91/66/48/1129916648.db2.gz WPKNUUHLVMENBR-CYBMUJFWSA-N 1 0 265.397 3.659 20 10 CHCDRO CCSCC[C@H](C)[N@H+](C)Cc1cc(C)c(C)cc1O ZINC000769547223 1129916919 /nfs/dbraw/zinc/91/69/19/1129916919.db2.gz BPXAKRCGERJBKD-AWEZNQCLSA-N 1 0 281.465 3.973 20 10 CHCDRO Cc1ccc(SC[C@@H](C)[NH2+]Cc2ccccc2O)cc1 ZINC000769934420 1129933490 /nfs/dbraw/zinc/93/34/90/1129933490.db2.gz DNMHDSKHCPSTPK-CQSZACIVSA-N 1 0 287.428 3.971 20 10 CHCDRO Cc1ccc(SC[C@H](C)[NH2+]Cc2ccccc2O)cc1 ZINC000769934419 1129933614 /nfs/dbraw/zinc/93/36/14/1129933614.db2.gz DNMHDSKHCPSTPK-AWEZNQCLSA-N 1 0 287.428 3.971 20 10 CHCDRO COc1ccc(C[C@H](C)C[N@H+](C)Cc2ccccc2O)cc1 ZINC000770505242 1129947865 /nfs/dbraw/zinc/94/78/65/1129947865.db2.gz KZHDLDSSFRLPOZ-HNNXBMFYSA-N 1 0 299.414 3.711 20 10 CHCDRO CCc1cccc(C[NH2+]C[C@H](C)CC(F)(F)F)c1O ZINC000691484004 1129950881 /nfs/dbraw/zinc/95/08/81/1129950881.db2.gz RVYDIKQWELPPFD-SNVBAGLBSA-N 1 0 275.314 3.633 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CC[C@H](c3ccccc3)C2)c(O)c1 ZINC000770739385 1129957493 /nfs/dbraw/zinc/95/74/93/1129957493.db2.gz AHKFFORCXGPSFT-DOTOQJQBSA-N 1 0 297.398 3.827 20 10 CHCDRO Cc1ccncc1[C@H](C)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000771388967 1129979593 /nfs/dbraw/zinc/97/95/93/1129979593.db2.gz QDRVGEMFXCQVRI-GJZGRUSLSA-N 1 0 283.419 3.868 20 10 CHCDRO C[C@H]([NH2+]Cc1ccnc(Cl)c1Cl)c1ccccc1O ZINC001461732575 1130000056 /nfs/dbraw/zinc/00/00/56/1130000056.db2.gz VHOPISNIDUJYLX-VIFPVBQESA-N 1 0 297.185 3.945 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CCc2cc(C)c(O)c(C)c2)cc1C ZINC000786827484 1130116990 /nfs/dbraw/zinc/11/69/90/1130116990.db2.gz OIEJSMSZUJWRMC-UHFFFAOYSA-N 1 0 299.414 3.664 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CC(C)(C)C2CCOCC2)c1 ZINC000903244339 1130135229 /nfs/dbraw/zinc/13/52/29/1130135229.db2.gz RMBQSSJHWMUBLM-CQSZACIVSA-N 1 0 291.435 3.804 20 10 CHCDRO CC[C@H]([NH2+]CC[C@@H]1CCCC[C@@H]1O)c1ccc(C)cc1O ZINC000903261984 1130139432 /nfs/dbraw/zinc/13/94/32/1130139432.db2.gz AKSNFOZJVZJDSN-XIRDDKMYSA-N 1 0 291.435 3.683 20 10 CHCDRO CCc1cccc(C[N@H+](C)Cc2ccccc2O)c1 ZINC000787263153 1130143843 /nfs/dbraw/zinc/14/38/43/1130143843.db2.gz DAEDPHPUVMHMBC-UHFFFAOYSA-N 1 0 255.361 3.587 20 10 CHCDRO C[C@@H]([NH2+]C1CC2(C1)CO[C@@H](C)C2)c1cc(Cl)ccc1O ZINC000903281444 1130145407 /nfs/dbraw/zinc/14/54/07/1130145407.db2.gz GJORIWNVYHIFFW-WIZUOIALSA-N 1 0 295.810 3.654 20 10 CHCDRO C[C@H]([NH2+]CC[C@H]1CCC(F)(F)C1)c1ccccc1O ZINC000903333095 1130158502 /nfs/dbraw/zinc/15/85/02/1130158502.db2.gz NNZODHAEGNDEND-NWDGAFQWSA-N 1 0 269.335 3.868 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](c1ccccn1)C1CC1)c1ccccc1O ZINC000903335471 1130160660 /nfs/dbraw/zinc/16/06/60/1130160660.db2.gz QEPGTBCKIVXGFG-CRAIPNDOSA-N 1 0 282.387 3.979 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]CC[C@H]1CCC(F)(F)C1)CC2 ZINC000903339762 1130162367 /nfs/dbraw/zinc/16/23/67/1130162367.db2.gz CWZILQKZPLDUNX-DGCLKSJQSA-N 1 0 281.346 3.795 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCOC12CCCC2)c1cc(Cl)ccc1O ZINC000903382834 1130168737 /nfs/dbraw/zinc/16/87/37/1130168737.db2.gz JNOJYQNMXKXHNQ-IAQYHMDHSA-N 1 0 295.810 3.798 20 10 CHCDRO C[C@H]([NH2+][C@@H]1COC[C@H]1C1CC1)c1ccc2ccccc2c1O ZINC000903438837 1130176208 /nfs/dbraw/zinc/17/62/08/1130176208.db2.gz XPEDSEDGSCOSGK-UYHISHBKSA-N 1 0 297.398 3.621 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H](C(C)C)[C@@H](O)c2ccccc2)c1 ZINC000788537963 1130193507 /nfs/dbraw/zinc/19/35/07/1130193507.db2.gz ZZCPYDLFELPTAK-OALUTQOASA-N 1 0 299.414 3.548 20 10 CHCDRO Oc1ccccc1C[NH2+]Cc1cc(F)c(Cl)cc1F ZINC000788531923 1130194257 /nfs/dbraw/zinc/19/42/57/1130194257.db2.gz HVQMJCKCGYXPQX-UHFFFAOYSA-N 1 0 283.705 3.614 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CCCNc2ccccn2)c(O)c1 ZINC000788623541 1130197784 /nfs/dbraw/zinc/19/77/84/1130197784.db2.gz FGJZPZLDIGGDBL-OAHLLOKOSA-N 1 0 299.418 3.557 20 10 CHCDRO CC(C)CCC[C@H](C)[N@@H+]1CCc2cccc(O)c2C1 ZINC001170088534 1130204391 /nfs/dbraw/zinc/20/43/91/1130204391.db2.gz UVELUXMLQYVNDL-AWEZNQCLSA-N 1 0 261.409 3.965 20 10 CHCDRO CCC(CC)[C@H](CC[NH2+]Cc1ccc2c(c1)CCO2)OC ZINC000746761520 1130206069 /nfs/dbraw/zinc/20/60/69/1130206069.db2.gz PLDQORKDBRMFHH-KRWDZBQOSA-N 1 0 291.435 3.552 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H](c2ccccc2)C(C)(C)CO)c1O ZINC000788830619 1130213693 /nfs/dbraw/zinc/21/36/93/1130213693.db2.gz CJCKWMKGMHJGHB-SFHVURJKSA-N 1 0 299.414 3.550 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)cc1)CC1(SC)CCC1 ZINC000788843331 1130214248 /nfs/dbraw/zinc/21/42/48/1130214248.db2.gz NSLSQJPOBWMODN-UHFFFAOYSA-N 1 0 292.492 3.860 20 10 CHCDRO CC1([NH2+]Cc2cc(F)ccc2O)CCC(F)(F)CC1 ZINC000753571352 1130217631 /nfs/dbraw/zinc/21/76/31/1130217631.db2.gz VAKMSMUYKAKKLJ-UHFFFAOYSA-N 1 0 273.298 3.589 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)C[C@@H]2CC[C@H](C)O2)cc1 ZINC000789307257 1130242116 /nfs/dbraw/zinc/24/21/16/1130242116.db2.gz VGIIASMZLPQVJC-YJBOKZPZSA-N 1 0 290.451 3.532 20 10 CHCDRO C[C@@H]1CC[C@H](C[N@H+](Cc2ccccc2O)C2CCCC2)O1 ZINC000789327835 1130244299 /nfs/dbraw/zinc/24/42/99/1130244299.db2.gz XAQJEBUMEVYVEH-RHSMWYFYSA-N 1 0 289.419 3.704 20 10 CHCDRO C[C@@H]([NH2+]CCCCOC(C)(C)C)c1ccc(N(C)C)cc1 ZINC000789388759 1130246332 /nfs/dbraw/zinc/24/63/32/1130246332.db2.gz QQAUHXVWWJHLQG-OAHLLOKOSA-N 1 0 292.467 3.999 20 10 CHCDRO CCOC[C@@H]([NH2+]Cc1cc(Cl)cc(C)c1O)C(C)C ZINC000789590335 1130262093 /nfs/dbraw/zinc/26/20/93/1130262093.db2.gz XNEWYKWKWMLEIN-CQSZACIVSA-N 1 0 285.815 3.505 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H](C(C)C)[C@H](O)c2ccccc2)c1O ZINC000789779940 1130276604 /nfs/dbraw/zinc/27/66/04/1130276604.db2.gz RYLXDUQUQUBRTC-PKOBYXMFSA-N 1 0 299.414 3.548 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCSC1)c1cc(Cl)ccc1O ZINC000790498848 1130316578 /nfs/dbraw/zinc/31/65/78/1130316578.db2.gz UQJJINVQUVYUMT-GWCFXTLKSA-N 1 0 285.840 3.839 20 10 CHCDRO CS[C@@H]1CC[C@@H]([NH2+]Cc2c([O-])ccc(Cl)c2F)C1 ZINC000790974226 1130344020 /nfs/dbraw/zinc/34/40/20/1130344020.db2.gz QHRCXLFTWJUUEE-RKDXNWHRSA-N 1 0 289.803 3.558 20 10 CHCDRO C[N@H+](Cc1c[nH]c2ccc(F)cc12)Cc1ccccc1O ZINC001137341273 1130430912 /nfs/dbraw/zinc/43/09/12/1130430912.db2.gz GEDMGVQWDXNQIZ-UHFFFAOYSA-N 1 0 284.334 3.645 20 10 CHCDRO [O-]c1ccc(Cl)c(F)c1C[N@@H+]1CCC2(CCC2)C1 ZINC000792165459 1130435114 /nfs/dbraw/zinc/43/51/14/1130435114.db2.gz GOZAQPUHGFURFC-UHFFFAOYSA-N 1 0 269.747 3.561 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCc3cc(Cl)ccc3C2)c1O ZINC000792179425 1130435866 /nfs/dbraw/zinc/43/58/66/1130435866.db2.gz GZMKKAGOAQFMKL-UHFFFAOYSA-N 1 0 287.790 3.912 20 10 CHCDRO CC[C@@H]1C[C@H]([N@H+](CC)Cc2ccc(N(C)C)cc2)CCO1 ZINC001170239924 1130465783 /nfs/dbraw/zinc/46/57/83/1130465783.db2.gz OIHHOOZBWYOPON-QZTJIDSGSA-N 1 0 290.451 3.532 20 10 CHCDRO COCCC(C)(C)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000747100159 1130517480 /nfs/dbraw/zinc/51/74/80/1130517480.db2.gz BIVCDJDZXLORSN-UHFFFAOYSA-N 1 0 299.414 3.964 20 10 CHCDRO COCCC[C@@H](Cc1ccccc1)[NH2+]Cc1ccccc1O ZINC000793233880 1130532795 /nfs/dbraw/zinc/53/27/95/1130532795.db2.gz WEZSZUHMDFVBCP-SFHVURJKSA-N 1 0 299.414 3.520 20 10 CHCDRO CO[C@]1(C)CCC[N@H+](Cc2cc(Cl)cc(C)c2O)CC1 ZINC000793340502 1130540942 /nfs/dbraw/zinc/54/09/42/1130540942.db2.gz PCPNCASGROVWPV-MRXNPFEDSA-N 1 0 297.826 3.745 20 10 CHCDRO CC1(C)[C@@H]([NH2+]Cc2ccccc2O)C[C@@H]1Oc1ccccc1 ZINC000793530159 1130572124 /nfs/dbraw/zinc/57/21/24/1130572124.db2.gz ZEXUNRJJHULZPE-ROUUACIJSA-N 1 0 297.398 3.728 20 10 CHCDRO COc1ccc2ccc(O)c(C[NH+]3CC4(CCC4)C3)c2c1 ZINC001234526310 1130654592 /nfs/dbraw/zinc/65/45/92/1130654592.db2.gz SSMNMLBYQHTORC-UHFFFAOYSA-N 1 0 283.371 3.540 20 10 CHCDRO COc1cc(C[N@@H+]2CCC[C@H](C(C)C)C2)c(O)cc1C ZINC000780501174 1130681629 /nfs/dbraw/zinc/68/16/29/1130681629.db2.gz ZKZFSASIVBHSAA-AWEZNQCLSA-N 1 0 277.408 3.577 20 10 CHCDRO CCOCc1cc(C[NH2+][C@H]2CC[C@@H](C)C2)ccc1OC ZINC000780579167 1130685044 /nfs/dbraw/zinc/68/50/44/1130685044.db2.gz ZSHCLCZDYOEUCR-CJNGLKHVSA-N 1 0 277.408 3.510 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C(C)(C)CC(F)(F)F)cc1F ZINC000780588241 1130685794 /nfs/dbraw/zinc/68/57/94/1130685794.db2.gz VOVJAGXMEJHMGB-UHFFFAOYSA-N 1 0 292.320 3.712 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)[C@H]1CCCOC1)c1ccc(N(C)C)cc1 ZINC000780743980 1130690200 /nfs/dbraw/zinc/69/02/00/1130690200.db2.gz CHZVOSWWZXFFLV-ZVZYQTTQSA-N 1 0 290.451 3.608 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)[C@H]1CCCOC1)c1ccc(N(C)C)cc1 ZINC000780743977 1130690223 /nfs/dbraw/zinc/69/02/23/1130690223.db2.gz CHZVOSWWZXFFLV-HFTRVMKXSA-N 1 0 290.451 3.608 20 10 CHCDRO COC[C@H]1CC[N@H+](Cc2cccc(-c3ccccc3)c2O)C1 ZINC001234998000 1130700849 /nfs/dbraw/zinc/70/08/49/1130700849.db2.gz GZFOBRRJUPYQDY-HNNXBMFYSA-N 1 0 297.398 3.528 20 10 CHCDRO CC[N@H+](CCC(F)(F)F)Cc1ccc(N(C)C)cc1 ZINC000781144869 1130705294 /nfs/dbraw/zinc/70/52/94/1130705294.db2.gz STAWIVIQMUDBGV-UHFFFAOYSA-N 1 0 274.330 3.527 20 10 CHCDRO CC[C@@H]([NH2+]C[C@](C)(OC)C1CC1)c1cc(Cl)ccc1O ZINC000812735275 1130710368 /nfs/dbraw/zinc/71/03/68/1130710368.db2.gz ZFVPAQLPJGDAQP-ZBFHGGJFSA-N 1 0 297.826 3.901 20 10 CHCDRO C[C@@H]([NH2+]CCCCF)c1cc2c(cc1O)CCCC2 ZINC000812735891 1130710534 /nfs/dbraw/zinc/71/05/34/1130710534.db2.gz HVLKFUSUHXJWQM-GFCCVEGCSA-N 1 0 265.372 3.671 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH+]1CC(c2ccccc2F)C1 ZINC000812791611 1130714393 /nfs/dbraw/zinc/71/43/93/1130714393.db2.gz REZKDVQONPXRNI-UHFFFAOYSA-N 1 0 291.753 3.784 20 10 CHCDRO Oc1cccc2c1C[N@H+](Cc1cc3cccc(F)c3[nH]1)CC2 ZINC001235248543 1130728264 /nfs/dbraw/zinc/72/82/64/1130728264.db2.gz IPNBNQNOHXAZAK-UHFFFAOYSA-N 1 0 296.345 3.571 20 10 CHCDRO C[C@@H]1CC[C@@]2(CC[N@H+](Cc3cc(F)ccc3O)C2)C1 ZINC000781927306 1130748772 /nfs/dbraw/zinc/74/87/72/1130748772.db2.gz DJJVUXIMGUEQBO-MLGOLLRUSA-N 1 0 263.356 3.543 20 10 CHCDRO CCC[N@H+](CCOC)Cc1ccc(C(C)(C)C)cc1O ZINC001235676931 1130766047 /nfs/dbraw/zinc/76/60/47/1130766047.db2.gz XQLJTAAGYSSWEI-UHFFFAOYSA-N 1 0 279.424 3.548 20 10 CHCDRO CC(C)(C)c1ccc(C[N@@H+]2CCC3(CC3)C2)c(O)c1 ZINC001235678433 1130767039 /nfs/dbraw/zinc/76/70/39/1130767039.db2.gz CBNKZHJULVKFMK-UHFFFAOYSA-N 1 0 259.393 3.676 20 10 CHCDRO CC(C)(C)c1ccc(C[N@@H+]2CCC(C)(C)C2)c(O)c1 ZINC001235684748 1130767061 /nfs/dbraw/zinc/76/70/61/1130767061.db2.gz JNEWNSQPCXCIOV-UHFFFAOYSA-N 1 0 261.409 3.922 20 10 CHCDRO COc1cccc(O)c1C[NH2+][C@@H]1CCCc2ccc(C)cc21 ZINC000813790472 1130785149 /nfs/dbraw/zinc/78/51/49/1130785149.db2.gz RSNSRKOBYBTZAW-QGZVFWFLSA-N 1 0 297.398 3.876 20 10 CHCDRO Nc1ccc(C[NH+]2CCC(Cc3ccccc3F)CC2)cc1 ZINC001235867158 1130790816 /nfs/dbraw/zinc/79/08/16/1130790816.db2.gz OHHMPFUEGZTUHF-UHFFFAOYSA-N 1 0 298.405 3.863 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCC=CO1)c1cc2c(cc1O)CCCC2 ZINC000783312189 1130815483 /nfs/dbraw/zinc/81/54/83/1130815483.db2.gz ZTGJRISTKCTQOO-CJNGLKHVSA-N 1 0 287.403 3.614 20 10 CHCDRO C[C@H]([NH2+]CCc1ccc2ccccc2n1)c1ccccc1O ZINC000783505927 1130830876 /nfs/dbraw/zinc/83/08/76/1130830876.db2.gz ROAVZRLOBIPNKB-AWEZNQCLSA-N 1 0 292.382 3.834 20 10 CHCDRO COC[C@H](C)C[N@H+](Cc1ccccc1O)C1CCCCC1 ZINC000783506576 1130831167 /nfs/dbraw/zinc/83/11/67/1130831167.db2.gz MNANPGDIIYUYTQ-OAHLLOKOSA-N 1 0 291.435 3.809 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H](C)c1ccc(F)cc1)c1ccccc1O ZINC000783508736 1130831483 /nfs/dbraw/zinc/83/14/83/1130831483.db2.gz KQTZGACBWVIIDO-CHWSQXEVSA-N 1 0 273.351 3.986 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CCc2ncsc2C1 ZINC000783545901 1130836570 /nfs/dbraw/zinc/83/65/70/1130836570.db2.gz GMFCUWDNPFWIJS-UHFFFAOYSA-N 1 0 296.395 3.560 20 10 CHCDRO COc1cccc(O)c1C[NH2+]C[C@H](c1ccccc1)C1CC1 ZINC000814297640 1130861268 /nfs/dbraw/zinc/86/12/68/1130861268.db2.gz JXJRNYJAAGLCLG-MRXNPFEDSA-N 1 0 297.398 3.684 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2cscn2)c1 ZINC000697819210 1130863474 /nfs/dbraw/zinc/86/34/74/1130863474.db2.gz JQASNEUQQSTBMZ-QWRGUYRKSA-N 1 0 262.378 3.569 20 10 CHCDRO CO[C@@H]1C[N@H+](Cc2cc(C(C)C)c(C)cc2O)CC[C@@H]1C ZINC000783969002 1130865722 /nfs/dbraw/zinc/86/57/22/1130865722.db2.gz SHSKAPHEGDCJDC-SCLBCKFNSA-N 1 0 291.435 3.681 20 10 CHCDRO COc1cc(C[N@@H+]2CC[C@@H](C(C)(C)C)C2)c(O)cc1C ZINC000784030734 1130869877 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CCCC[C@H](CN)[NH2+][C@H](C)c1cc(Cl)cc(C)c1O ZINC000817963418 1131192104 /nfs/dbraw/zinc/19/21/04/1131192104.db2.gz UTMMSFSZUUUCAR-DGCLKSJQSA-N 1 0 284.831 3.522 20 10 CHCDRO CCCC[C@H](CN)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000817962244 1131192886 /nfs/dbraw/zinc/19/28/86/1131192886.db2.gz JUWINJSGYVBXRE-UKRRQHHQSA-N 1 0 286.419 3.714 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc3c(c2)CCCN3)c1 ZINC000817977811 1131193967 /nfs/dbraw/zinc/19/39/67/1131193967.db2.gz PQLAVSRJBAAYAT-CQSZACIVSA-N 1 0 296.414 3.910 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H](CN)C2CCCC2)c1O ZINC000817981431 1131195034 /nfs/dbraw/zinc/19/50/34/1131195034.db2.gz JHMWOXYRISLVQX-IAQYHMDHSA-N 1 0 296.842 3.522 20 10 CHCDRO CCn1ccnc1[C@H](C)[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001117831514 1131203290 /nfs/dbraw/zinc/20/32/90/1131203290.db2.gz PGMXPGMBCWMETE-HZSPNIEDSA-N 1 0 299.418 3.816 20 10 CHCDRO CCC(CC)C[NH2+]C[C@@H]1CCN(c2ccc(OC)cc2)C1 ZINC000818219403 1131205196 /nfs/dbraw/zinc/20/51/96/1131205196.db2.gz FCRCPEOQBZGEGA-INIZCTEOSA-N 1 0 290.451 3.547 20 10 CHCDRO CCC[C@@H](CC)[NH2+]C[C@H]1CCN(c2ccc(OC)cc2)C1 ZINC000818341566 1131209829 /nfs/dbraw/zinc/20/98/29/1131209829.db2.gz ARWDCADKUCOIML-HZPDHXFCSA-N 1 0 290.451 3.690 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@H]1C[C@]1(F)c1ccccc1)CC2 ZINC000818356843 1131211441 /nfs/dbraw/zinc/21/14/41/1131211441.db2.gz RMNOQENYWYGTRX-HFTRVMKXSA-N 1 0 283.346 3.606 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1C[C@H]2C[C@H]2C1)c1cc(Cl)ccc1O ZINC000818357823 1131211493 /nfs/dbraw/zinc/21/14/93/1131211493.db2.gz BDGCYKIARPWPCX-IQOUGMIPSA-N 1 0 265.784 3.885 20 10 CHCDRO C[C@H]([NH2+][C@@H]1C[C@H]2C[C@H]2C1)c1cc(Br)ccc1O ZINC000818358113 1131211968 /nfs/dbraw/zinc/21/19/68/1131211968.db2.gz CXSGYCGPVYASIQ-GUDRVLHUSA-N 1 0 296.208 3.604 20 10 CHCDRO Cc1cccc(C)c1C[N@@H+]1CCCc2cc(O)c(O)cc2C1 ZINC001137852686 1131424005 /nfs/dbraw/zinc/42/40/05/1131424005.db2.gz OBDNOJSIOKVPGY-UHFFFAOYSA-N 1 0 297.398 3.663 20 10 CHCDRO CC[C@H]1C[C@H]([NH2+]Cc2ccc(N(CC)CC)cc2)CCO1 ZINC000823671939 1131436933 /nfs/dbraw/zinc/43/69/33/1131436933.db2.gz YGZAHGIYLQQDNZ-AEFFLSMTSA-N 1 0 290.451 3.580 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@H]2CSc3ccccc32)cc1C ZINC000824483223 1131470566 /nfs/dbraw/zinc/47/05/66/1131470566.db2.gz JDJTYHPLSLAFSJ-HNNXBMFYSA-N 1 0 299.439 3.988 20 10 CHCDRO Oc1ccc(-c2ccccc2)cc1C[N@@H+]1CC[C@H](F)C1 ZINC000824572513 1131474524 /nfs/dbraw/zinc/47/45/24/1131474524.db2.gz YUBKPTKPLNMRIC-INIZCTEOSA-N 1 0 271.335 3.603 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@H]2CCCCC2(F)F)cc1C ZINC000824543428 1131475430 /nfs/dbraw/zinc/47/54/30/1131475430.db2.gz KBHVSJBCZVFLDQ-CQSZACIVSA-N 1 0 283.362 3.924 20 10 CHCDRO CCOCc1cc(C[NH2+]CC2=CCCCC2)ccc1OC ZINC000824538175 1131475616 /nfs/dbraw/zinc/47/56/16/1131475616.db2.gz MOIBBTNSMLNXEW-UHFFFAOYSA-N 1 0 289.419 3.822 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)Cc2ccccc2O)cc1Cl ZINC000824592094 1131476678 /nfs/dbraw/zinc/47/66/78/1131476678.db2.gz DPXWVFDFBUORTR-UHFFFAOYSA-N 1 0 291.778 3.692 20 10 CHCDRO Cc1c(CN2CC[C@@H](C)C(F)(F)C2)c2ccccc2n1C ZINC001138252641 1131482503 /nfs/dbraw/zinc/48/25/03/1131482503.db2.gz OFCPPJYPRADIAF-GFCCVEGCSA-N 1 0 292.373 3.964 20 10 CHCDRO CC[C@@H]1CC[N@H+](Cc2c3ccccc3n(C)c2C)C1 ZINC001138260164 1131483448 /nfs/dbraw/zinc/48/34/48/1131483448.db2.gz XGTIZGAKAXTQHV-CQSZACIVSA-N 1 0 256.393 3.719 20 10 CHCDRO Cc1c(C[N@@H+]2CCC[C@H](C(F)F)C2)c2ccccc2n1C ZINC001138256975 1131483558 /nfs/dbraw/zinc/48/35/58/1131483558.db2.gz QXZIOGSUHMDDSN-ZDUSSCGKSA-N 1 0 292.373 3.964 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+]C[C@@H]2CCCC2(F)F)c1O ZINC000824800287 1131485037 /nfs/dbraw/zinc/48/50/37/1131485037.db2.gz VTMYWKVGGVZIQQ-NSHDSACASA-N 1 0 289.753 3.879 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@@H]2CCO[C@H](C(C)C)C2)cc1C ZINC000824798574 1131485227 /nfs/dbraw/zinc/48/52/27/1131485227.db2.gz FAFANMKPFAQOBU-QAPCUYQASA-N 1 0 291.435 3.550 20 10 CHCDRO CO[C@H]1CC[N@H+](Cc2cc(Cl)cc(C)c2O)CC1(C)C ZINC000824821299 1131485511 /nfs/dbraw/zinc/48/55/11/1131485511.db2.gz XWENKISOBFXSFX-AWEZNQCLSA-N 1 0 297.826 3.601 20 10 CHCDRO CO[C@@H]1CC[N@H+](Cc2ccc3ccccc3c2O)CC1(C)C ZINC000824820232 1131485529 /nfs/dbraw/zinc/48/55/29/1131485529.db2.gz BPBDHOKDKDZLOJ-QGZVFWFLSA-N 1 0 299.414 3.792 20 10 CHCDRO CN1CCCc2cc(C[N@@H+]3CCC[C@](C)(F)CC3)ccc21 ZINC001138354990 1131493490 /nfs/dbraw/zinc/49/34/90/1131493490.db2.gz XSNHUJNJBIWJRG-SFHVURJKSA-N 1 0 290.426 3.783 20 10 CHCDRO CN1CCCc2cc(C[N@H+](C)Cc3ccsc3)ccc21 ZINC001138356095 1131494233 /nfs/dbraw/zinc/49/42/33/1131494233.db2.gz HJYCRBORPGZACF-UHFFFAOYSA-N 1 0 286.444 3.763 20 10 CHCDRO Oc1c(F)cc(Cl)cc1CNc1ccc2c([nH+]1)CCC2 ZINC000825124736 1131499591 /nfs/dbraw/zinc/49/95/91/1131499591.db2.gz XBBKXAJPEBXWTJ-UHFFFAOYSA-N 1 0 292.741 3.681 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+]C2(C3(C)CC3)CC2)c1O ZINC000825124866 1131500245 /nfs/dbraw/zinc/50/02/45/1131500245.db2.gz ZUTATKBCCNISGB-UHFFFAOYSA-N 1 0 265.784 3.776 20 10 CHCDRO COC[C@@H]1CCC[N@H+](Cc2ccc3ccccc3c2O)CC1 ZINC000825321961 1131506778 /nfs/dbraw/zinc/50/67/78/1131506778.db2.gz SSKBJBJMWOOMDQ-OAHLLOKOSA-N 1 0 299.414 3.794 20 10 CHCDRO Cc1nc(C[NH2+]Cc2cc(Cl)c(C)cc2O)sc1C ZINC000825309470 1131508299 /nfs/dbraw/zinc/50/82/99/1131508299.db2.gz NYJPEOXVMHBMPS-UHFFFAOYSA-N 1 0 296.823 3.717 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)Cc2cccc(N)c2)cc1 ZINC000844220883 1131536952 /nfs/dbraw/zinc/53/69/52/1131536952.db2.gz NVOWTVHVCVJZAS-UHFFFAOYSA-N 1 0 297.446 3.747 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)Cc2ccc(N(C)C)cc2C)o1 ZINC001202860742 1131544464 /nfs/dbraw/zinc/54/44/64/1131544464.db2.gz SVFSBRMUNJRIFO-AWEZNQCLSA-N 1 0 286.419 3.683 20 10 CHCDRO Fc1ccccc1C[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000035275543 1131559280 /nfs/dbraw/zinc/55/92/80/1131559280.db2.gz NLJUWFDJADTXBB-UHFFFAOYSA-N 1 0 284.378 3.716 20 10 CHCDRO Cc1cc(C[NH+]2CCC3(CC(F)C3)CC2)ccc1N(C)C ZINC001139670325 1131626434 /nfs/dbraw/zinc/62/64/34/1131626434.db2.gz KLFSMWLGMSWPKV-UHFFFAOYSA-N 1 0 290.426 3.775 20 10 CHCDRO Cc1cc(C[N@H+]2CC[C@H](C)C[C@@H]2C)ccc1N(C)C ZINC001139672727 1131627865 /nfs/dbraw/zinc/62/78/65/1131627865.db2.gz CZMASXAHFVQDOW-ZFWWWQNUSA-N 1 0 260.425 3.681 20 10 CHCDRO Cc1cc(C[N@H+]2CC[C@@H](C)C[C@@H]2C)ccc1N(C)C ZINC001139672725 1131628014 /nfs/dbraw/zinc/62/80/14/1131628014.db2.gz CZMASXAHFVQDOW-HIFRSBDPSA-N 1 0 260.425 3.681 20 10 CHCDRO Cc1cc(C[NH+]2C3CCCC2CCC3)ccc1N(C)C ZINC001139673902 1131628020 /nfs/dbraw/zinc/62/80/20/1131628020.db2.gz MRBHKCWJEKWITP-UHFFFAOYSA-N 1 0 272.436 3.968 20 10 CHCDRO C[N@H+](C/C=C/c1ccccc1)Cc1cc(F)ccc1O ZINC001140059168 1131659494 /nfs/dbraw/zinc/65/94/94/1131659494.db2.gz WVFOALFAJDEGDF-VMPITWQZSA-N 1 0 271.335 3.677 20 10 CHCDRO Cc1ccc(C)c(C[N@H+]2CC[C@H](C)C(F)(F)CC2)c1O ZINC001140178745 1131672866 /nfs/dbraw/zinc/67/28/66/1131672866.db2.gz WILJKHRKXIRXQU-ZDUSSCGKSA-N 1 0 283.362 3.876 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCc3ccsc3C2)c1O ZINC001140181423 1131673106 /nfs/dbraw/zinc/67/31/06/1131673106.db2.gz AVBRXDMNEPXZRK-UHFFFAOYSA-N 1 0 273.401 3.629 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[C@@H]2C2CCC2)c1 ZINC000845972186 1131674048 /nfs/dbraw/zinc/67/40/48/1131674048.db2.gz PILSNVXCPIQLEL-SGIREYDYSA-N 1 0 275.392 3.630 20 10 CHCDRO Cc1ccc2c(c1)CC[N@@H+](Cc1c(C)ccc(C)c1O)C2 ZINC001140184710 1131674262 /nfs/dbraw/zinc/67/42/62/1131674262.db2.gz FNXXHBANEQFONB-UHFFFAOYSA-N 1 0 281.399 3.876 20 10 CHCDRO CCC[N@H+](CCc1ccccn1)Cc1c(C)ccc(C)c1O ZINC001140184498 1131674565 /nfs/dbraw/zinc/67/45/65/1131674565.db2.gz WVPOQYMLJGWWDC-UHFFFAOYSA-N 1 0 298.430 3.859 20 10 CHCDRO C[C@H](CCCc1cccnc1)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000834554805 1131683567 /nfs/dbraw/zinc/68/35/67/1131683567.db2.gz GHIBBXPFVSRKGA-OAHLLOKOSA-N 1 0 296.414 3.518 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]CCOC1CCCCCC1)CC2 ZINC000834595323 1131686212 /nfs/dbraw/zinc/68/62/12/1131686212.db2.gz XPZUVFLXRRPFMK-MRXNPFEDSA-N 1 0 289.419 3.709 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]C1CC(c3ccccc3)C1)CC2 ZINC000834640976 1131690267 /nfs/dbraw/zinc/69/02/67/1131690267.db2.gz VDEFTRSLHISLCA-OFLPRAFFSA-N 1 0 279.383 3.915 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]C2CC3(CCC3)C2)cc1 ZINC000846106619 1131691292 /nfs/dbraw/zinc/69/12/92/1131691292.db2.gz GRZIHGZMMBXYEZ-HYXAFXHYSA-N 1 0 270.420 3.688 20 10 CHCDRO CCSCC[C@@H](C)[NH2+][C@H](C)c1cccc(OC)c1O ZINC000846148917 1131691503 /nfs/dbraw/zinc/69/15/03/1131691503.db2.gz ULNNQMVXBPIHGN-VXGBXAGGSA-N 1 0 283.437 3.583 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]CCc1cc3ccccc3o1)CC2 ZINC000834663995 1131691587 /nfs/dbraw/zinc/69/15/87/1131691587.db2.gz LRNAFJGKKDNRKQ-INIZCTEOSA-N 1 0 293.366 3.958 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CC2(C3CC3)CCC2)c1O ZINC000846157951 1131692223 /nfs/dbraw/zinc/69/22/23/1131692223.db2.gz PZZQPCRCICTWBK-GFCCVEGCSA-N 1 0 275.392 3.632 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]C2(Cc3ccccc3)CC2)c1O ZINC000846165620 1131692767 /nfs/dbraw/zinc/69/27/67/1131692767.db2.gz WONKQJAXAAKSPR-CQSZACIVSA-N 1 0 297.398 3.827 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]C[C@H]2CCCC(F)(F)C2)c1O ZINC000846166872 1131692838 /nfs/dbraw/zinc/69/28/38/1131692838.db2.gz DSAKGDWLFGHICS-NEPJUHHUSA-N 1 0 299.361 3.877 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CCCc2ccccc2)c1O ZINC000846137329 1131693767 /nfs/dbraw/zinc/69/37/67/1131693767.db2.gz NSOGBLAKWBFUDI-CQSZACIVSA-N 1 0 285.387 3.684 20 10 CHCDRO CCC(CC)(C[NH2+][C@@H](C)c1cccc(OC)c1O)SC ZINC000846143095 1131695004 /nfs/dbraw/zinc/69/50/04/1131695004.db2.gz APROTUHMBKTMPH-LBPRGKRZSA-N 1 0 297.464 3.973 20 10 CHCDRO C[C@]1(CC[NH2+][C@@H]2CCc3cccc(O)c32)C[C@]1(F)Cl ZINC000846184285 1131697792 /nfs/dbraw/zinc/69/77/92/1131697792.db2.gz JLMWVOXKMZKOTB-BYCMXARLSA-N 1 0 283.774 3.674 20 10 CHCDRO CO[C@@H]1CCCC[C@H]1[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000846200621 1131699663 /nfs/dbraw/zinc/69/96/63/1131699663.db2.gz GOWSUFYEIJDJSZ-BPGGGUHBSA-N 1 0 293.382 3.627 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CC[C@H]2CCC[C@@H]2C1 ZINC001140339500 1131702313 /nfs/dbraw/zinc/70/23/13/1131702313.db2.gz VNMPEGHADDFPAQ-VXGBXAGGSA-N 1 0 265.784 3.668 20 10 CHCDRO CCN(CC)c1ccc(CNc2cc[nH+]cc2)cc1 ZINC000083411702 1131703530 /nfs/dbraw/zinc/70/35/30/1131703530.db2.gz ACADPCVCHVFYLY-UHFFFAOYSA-N 1 0 255.365 3.540 20 10 CHCDRO CSc1ccc(CC[NH2+][C@H]2CCc3cccc(O)c32)cc1 ZINC000834790557 1131705192 /nfs/dbraw/zinc/70/51/92/1131705192.db2.gz RXSOGXBYCHIYDK-INIZCTEOSA-N 1 0 299.439 3.934 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@@H]1Cc3ccc(Cl)cc3C1)CC2 ZINC000834793988 1131706012 /nfs/dbraw/zinc/70/60/12/1131706012.db2.gz LOGGGDUKXSVCHI-CVEARBPZSA-N 1 0 299.801 3.790 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2cc(F)cnc2Cl)c(O)c1 ZINC000834836835 1131710168 /nfs/dbraw/zinc/71/01/68/1131710168.db2.gz PJMXBYWNAOOLAX-SNVBAGLBSA-N 1 0 294.757 3.739 20 10 CHCDRO Cc1cc(C[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)ccn1 ZINC000834859460 1131712976 /nfs/dbraw/zinc/71/29/76/1131712976.db2.gz DECNKPONUKJJDX-AWEZNQCLSA-N 1 0 296.414 3.825 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H](C)CC(C)(C)O)c1O ZINC000834877061 1131716193 /nfs/dbraw/zinc/71/61/93/1131716193.db2.gz SGEQJLZFJAMUST-MNOVXSKESA-N 1 0 285.815 3.554 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCOC3(CCC3)C2)c(O)c1 ZINC000834882429 1131716476 /nfs/dbraw/zinc/71/64/76/1131716476.db2.gz JVXMDQORWLRIAK-LSDHHAIUSA-N 1 0 289.419 3.701 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@@](C)(CC)OC)cc1 ZINC000834882175 1131717139 /nfs/dbraw/zinc/71/71/39/1131717139.db2.gz KCWNCMILNGCCMS-WMLDXEAASA-N 1 0 278.440 3.608 20 10 CHCDRO CO[C@](C)(C[NH2+][C@H](C)c1cc(C)ccc1O)c1ccccc1 ZINC000834884116 1131717951 /nfs/dbraw/zinc/71/79/51/1131717951.db2.gz KKLVLKPLDJRVDW-DNVCBOLYSA-N 1 0 299.414 3.913 20 10 CHCDRO CO[C@](C)(C[NH2+][C@@H]1CCc2cccc(O)c21)c1ccccc1 ZINC000834885989 1131718438 /nfs/dbraw/zinc/71/84/38/1131718438.db2.gz ZCRXIGBQSLMVPI-VQIMIIECSA-N 1 0 297.398 3.531 20 10 CHCDRO CO[C@@](C)(C[NH2+][C@@H]1CCc2cccc(O)c21)c1ccccc1 ZINC000834885983 1131718495 /nfs/dbraw/zinc/71/84/95/1131718495.db2.gz ZCRXIGBQSLMVPI-APWZRJJASA-N 1 0 297.398 3.531 20 10 CHCDRO Oc1ccc2ccncc2c1C[NH+]1CCCCCCC1 ZINC000834885582 1131718694 /nfs/dbraw/zinc/71/86/94/1131718694.db2.gz BPNMWZQNVWFBKX-UHFFFAOYSA-N 1 0 270.376 3.707 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2C[C@H](C)n3ccnc32)cc1 ZINC000834896815 1131721668 /nfs/dbraw/zinc/72/16/68/1131721668.db2.gz OBQLUQQGZLRMIB-GRDNDAEWSA-N 1 0 298.434 3.696 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1nccn1CC)c1ccc(C)cc1O ZINC000834897182 1131721745 /nfs/dbraw/zinc/72/17/45/1131721745.db2.gz YLMHBZVYPRBFCT-UKRRQHHQSA-N 1 0 287.407 3.719 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+]CCC[C@H]2CCOC2)c1O ZINC000834906621 1131729224 /nfs/dbraw/zinc/72/92/24/1131729224.db2.gz YOVRQTABWLWIMD-STQMWFEESA-N 1 0 297.826 3.821 20 10 CHCDRO Cc1ccc2c(c1)C[N@@H+](Cc1ccc(Cl)cc1O)CC2 ZINC001140461163 1131747205 /nfs/dbraw/zinc/74/72/05/1131747205.db2.gz FWSOODOJFZFQAT-UHFFFAOYSA-N 1 0 287.790 3.912 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2ccc(Cl)cc2O)CCC1(F)F ZINC001140461379 1131747781 /nfs/dbraw/zinc/74/77/81/1131747781.db2.gz JZEDKQGAGFKOLS-SECBINFHSA-N 1 0 275.726 3.523 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]C[C@@]2(C)CCCS2)cc1 ZINC000835041443 1131762860 /nfs/dbraw/zinc/76/28/60/1131762860.db2.gz CHFLKWKKOKEPPH-UKINESCASA-N 1 0 290.476 3.641 20 10 CHCDRO COC(C)(C)C[C@H](C)[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC000835040227 1131763005 /nfs/dbraw/zinc/76/30/05/1131763005.db2.gz OHHVXSRPIYYNFC-LZNQSLFOSA-N 1 0 290.451 3.559 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]C[C@@H]2CCCC2(F)F)cc1 ZINC000835055293 1131766945 /nfs/dbraw/zinc/76/69/45/1131766945.db2.gz UKUNFWXOQQRHDC-RGDDUWESSA-N 1 0 294.389 3.791 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CCc2ccc(C)cn2)cc1 ZINC000835063555 1131768521 /nfs/dbraw/zinc/76/85/21/1131768521.db2.gz ZWCDNJHQQMTMGL-UHFFFAOYSA-N 1 0 297.446 3.569 20 10 CHCDRO CC(C)(C)C1CC[NH+](Cc2cc(F)ccc2O)CC1 ZINC000232491102 1131779052 /nfs/dbraw/zinc/77/90/52/1131779052.db2.gz RCDLQYARVQQKJW-UHFFFAOYSA-N 1 0 265.372 3.789 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)Cc1cc(F)ccc1C ZINC001140594846 1131817201 /nfs/dbraw/zinc/81/72/01/1131817201.db2.gz RLDTXWOKBIKBTR-UHFFFAOYSA-N 1 0 273.351 3.862 20 10 CHCDRO COc1cccc([C@H]2CC[N@H+](Cc3cc(C)ccc3O)C2)c1 ZINC001140623180 1131831139 /nfs/dbraw/zinc/83/11/39/1131831139.db2.gz IRIFABLQKZGZKQ-INIZCTEOSA-N 1 0 297.398 3.699 20 10 CHCDRO Cc1c(O)ccc(C[N@@H+]2CCc3ccccc3[C@H]2C)c1O ZINC001140742411 1131905197 /nfs/dbraw/zinc/90/51/97/1131905197.db2.gz NIOWWMXGBUJAIB-CYBMUJFWSA-N 1 0 283.371 3.526 20 10 CHCDRO Cc1c(O)ccc(C[NH+](CC(C)C)CC(C)C)c1O ZINC001140742746 1131905740 /nfs/dbraw/zinc/90/57/40/1131905740.db2.gz XMJONMJYFRDJHB-UHFFFAOYSA-N 1 0 265.397 3.520 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2ccc(O)c(C)c2O)cc1C ZINC001140747543 1131906958 /nfs/dbraw/zinc/90/69/58/1131906958.db2.gz FGKKXYSFPHWHGW-UHFFFAOYSA-N 1 0 285.387 3.655 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CC=CCC1)c1ccc(N(C)C)cc1 ZINC000773001097 1131914086 /nfs/dbraw/zinc/91/40/86/1131914086.db2.gz NDOCELIJPDXPPV-RDJZCZTQSA-N 1 0 258.409 3.902 20 10 CHCDRO CC[C@H]1CCC[N@@H+]1Cc1ccc(N(C)C)cc1Cl ZINC001140923658 1131965403 /nfs/dbraw/zinc/96/54/03/1131965403.db2.gz GCPUZHNOGHLYCK-ZDUSSCGKSA-N 1 0 266.816 3.780 20 10 CHCDRO Cc1ccc(C[N@@H+]2CCC[C@H](Oc3ccccc3)C2)c(O)c1 ZINC001140949540 1131969759 /nfs/dbraw/zinc/96/97/59/1131969759.db2.gz CZNXNIUBLISWRE-SFHVURJKSA-N 1 0 297.398 3.744 20 10 CHCDRO Cc1ccc(C[N@H+](C)CCc2ccc(F)cc2)c(O)c1 ZINC001140951035 1131972413 /nfs/dbraw/zinc/97/24/13/1131972413.db2.gz VKZLKFGMEUBHBP-UHFFFAOYSA-N 1 0 273.351 3.514 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CC[C@@H]2CCCS2)c1 ZINC000715700268 1131990077 /nfs/dbraw/zinc/99/00/77/1131990077.db2.gz XWDUTNBMDOUBKP-STQMWFEESA-N 1 0 265.422 3.637 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H]2CCCC[C@H]2CC)c1O ZINC000037032042 1131990367 /nfs/dbraw/zinc/99/03/67/1131990367.db2.gz MPAKLSVJWKMMHE-UKRRQHHQSA-N 1 0 277.408 3.849 20 10 CHCDRO CCCC[N@H+](C)Cc1cc2c3c(c1)CCCN3CCC2 ZINC001141075110 1132005058 /nfs/dbraw/zinc/00/50/58/1132005058.db2.gz ZFMCQASUBLJWSR-UHFFFAOYSA-N 1 0 272.436 3.617 20 10 CHCDRO CC[C@H](C)[N@H+](C)Cc1cc2c3c(c1)CCCN3CCC2 ZINC001141074769 1132004951 /nfs/dbraw/zinc/00/49/51/1132004951.db2.gz BCTUTZBLZBWXQT-AWEZNQCLSA-N 1 0 272.436 3.616 20 10 CHCDRO c1c(C[NH+]2C[C@@H]3CCC[C@H]3C2)cc2c3c1CCCN3CCC2 ZINC001141074553 1132006311 /nfs/dbraw/zinc/00/63/11/1132006311.db2.gz LXQBBLCVTIKGDU-OALUTQOASA-N 1 0 296.458 3.617 20 10 CHCDRO CCCCCC[C@@H](C)[NH2+]Cc1cc(OC)ccc1O ZINC000037138575 1132007332 /nfs/dbraw/zinc/00/73/32/1132007332.db2.gz DYGJGWIIHFKBNA-CYBMUJFWSA-N 1 0 265.397 3.849 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)[C@@H]1CCc2c(F)cccc2C1 ZINC001171438581 1132017230 /nfs/dbraw/zinc/01/72/30/1132017230.db2.gz TYXZNHXIQAFLOZ-MRXNPFEDSA-N 1 0 299.389 3.911 20 10 CHCDRO C[C@@H]1CCC[C@@H]([NH2+]Cc2ccc3c(c2)CCO3)[C@@H]1C ZINC000037362699 1132030035 /nfs/dbraw/zinc/03/00/35/1132030035.db2.gz WZIZOVHYPNVVCX-XJKCOSOUSA-N 1 0 259.393 3.536 20 10 CHCDRO Clc1ccc(CC[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC000037362749 1132031241 /nfs/dbraw/zinc/03/12/41/1132031241.db2.gz UBMSQWBODIOQOX-UHFFFAOYSA-N 1 0 287.790 3.607 20 10 CHCDRO Cc1ccc(CC[C@H](C)[NH2+]CCc2ccc(O)c(O)c2)cc1 ZINC001171659008 1132070431 /nfs/dbraw/zinc/07/04/31/1132070431.db2.gz WMYOYFFMAGKUEC-HNNXBMFYSA-N 1 0 299.414 3.560 20 10 CHCDRO C[N@H+](Cc1ccccc1O)[C@H]1CSc2ccccc2C1 ZINC001172206334 1132141142 /nfs/dbraw/zinc/14/11/42/1132141142.db2.gz OQUYIILFLMYUSQ-OAHLLOKOSA-N 1 0 285.412 3.541 20 10 CHCDRO C[N@H+](Cc1ccc(C2CC2)cc1)Cc1ccccc1O ZINC000838800194 1132147890 /nfs/dbraw/zinc/14/78/90/1132147890.db2.gz SMPKDMMKGGJCPA-UHFFFAOYSA-N 1 0 267.372 3.902 20 10 CHCDRO CC[C@H](C)OCC[C@@H](C)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC001172343681 1132178178 /nfs/dbraw/zinc/17/81/78/1132178178.db2.gz RAEXGAUOFMLIRH-PMPSAXMXSA-N 1 0 292.467 3.997 20 10 CHCDRO CC[C@@H](C)OCC[C@H](C)[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001172349566 1132181690 /nfs/dbraw/zinc/18/16/90/1132181690.db2.gz VKCSJVVPXLNKQT-JKSUJKDBSA-N 1 0 292.467 3.778 20 10 CHCDRO Cc1cc(Cl)cc(C[NH+]2CC(CC(F)(F)F)C2)c1O ZINC000839139144 1132184279 /nfs/dbraw/zinc/18/42/79/1132184279.db2.gz YAWAAARXHHIGKL-UHFFFAOYSA-N 1 0 293.716 3.738 20 10 CHCDRO Oc1ccc(-c2ccccc2)cc1C[NH+]1CC2(CC(F)C2)C1 ZINC000839139942 1132184548 /nfs/dbraw/zinc/18/45/48/1132184548.db2.gz LTHIXPDGJXVEEP-UHFFFAOYSA-N 1 0 297.373 3.993 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCSC3(CCC3)CC2)cc1 ZINC000839625032 1132227145 /nfs/dbraw/zinc/22/71/45/1132227145.db2.gz LJKASGHGNDFJBX-UHFFFAOYSA-N 1 0 290.476 3.614 20 10 CHCDRO Oc1ccc(CC[NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)cc1O ZINC001172550121 1132262495 /nfs/dbraw/zinc/26/24/95/1132262495.db2.gz CNECBROUCIAQJA-IAGOWNOFSA-N 1 0 297.398 3.566 20 10 CHCDRO COC1CCC([NH2+][C@H](C)c2c(C)cc(C)cc2O)CC1 ZINC000840791681 1132288290 /nfs/dbraw/zinc/28/82/90/1132288290.db2.gz BVCWBOXFIZPTEW-WLYUNCDWSA-N 1 0 277.408 3.617 20 10 CHCDRO CO[C@@H]1C[C@H]([NH2+][C@H](C)c2ccc(C)c(C)c2O)C12CCC2 ZINC000840806494 1132288681 /nfs/dbraw/zinc/28/86/81/1132288681.db2.gz HUGUJAHEFOILTP-VNQPRFMTSA-N 1 0 289.419 3.617 20 10 CHCDRO C[N@H+](Cc1ccccc1O)C1CC(C)(C)OC(C)(C)C1 ZINC001172660777 1132292624 /nfs/dbraw/zinc/29/26/24/1132292624.db2.gz XHFBSXLXVLQCNI-UHFFFAOYSA-N 1 0 277.408 3.560 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1C[C@@H](C)O[C@@H]1C)c1cc(Cl)ccc1O ZINC000840873078 1132299424 /nfs/dbraw/zinc/29/94/24/1132299424.db2.gz QQEMLXISZUKMSK-FJJYHAOUSA-N 1 0 297.826 3.900 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCCC[C@H]1F)c1cc(Cl)ccc1O ZINC000840876148 1132300271 /nfs/dbraw/zinc/30/02/71/1132300271.db2.gz MRKCJJGJKUSSLU-OASPWFOLSA-N 1 0 271.763 3.977 20 10 CHCDRO COCC1CCC([NH2+][C@@H](C)c2c(C)cc(C)cc2O)CC1 ZINC000840875839 1132300784 /nfs/dbraw/zinc/30/07/84/1132300784.db2.gz JMOZRVBVKLUPLV-FHERZECASA-N 1 0 291.435 3.865 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)C1(OC)CCC1)c1ccc(N(C)C)cc1 ZINC000840883715 1132303407 /nfs/dbraw/zinc/30/34/07/1132303407.db2.gz HOMBKQOIZSHWLT-YOEHRIQHSA-N 1 0 290.451 3.751 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+][C@H](C)c1cccnc1 ZINC000840893530 1132305476 /nfs/dbraw/zinc/30/54/76/1132305476.db2.gz KNMJDJODZZJUAY-HZPDHXFCSA-N 1 0 297.446 3.738 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CCCC(F)(F)F)c(Cl)c1 ZINC000840902897 1132307345 /nfs/dbraw/zinc/30/73/45/1132307345.db2.gz WVJFASGRGDQHCI-UHFFFAOYSA-N 1 0 281.705 3.786 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]CC(C)(C)c1ccccn1 ZINC000840951454 1132311391 /nfs/dbraw/zinc/31/13/91/1132311391.db2.gz XUPXATSNKHJVQF-UHFFFAOYSA-N 1 0 297.446 3.523 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@@H]2CCCSC2)c(Cl)c1 ZINC000840945641 1132312030 /nfs/dbraw/zinc/31/20/30/1132312030.db2.gz RWNCDBKCZROORM-NSHDSACASA-N 1 0 285.840 3.587 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CC[C@]2(C)[C@H](C1)C2(F)F ZINC000840948007 1132312041 /nfs/dbraw/zinc/31/20/41/1132312041.db2.gz OUSVWRSDDHZWND-JKSUJKDBSA-N 1 0 294.389 3.538 20 10 CHCDRO CCCC[N@H+](Cc1cnc(CC)nc1)Cc1ccccc1O ZINC000840943189 1132312074 /nfs/dbraw/zinc/31/20/74/1132312074.db2.gz KYIOQJFYMUHGPK-UHFFFAOYSA-N 1 0 299.418 3.547 20 10 CHCDRO CO[C@@](C)([C@H](C)[NH2+]Cc1cc(Cl)cc(C)c1O)C1CC1 ZINC000840961473 1132313520 /nfs/dbraw/zinc/31/35/20/1132313520.db2.gz WPUFTIMJWWWQBD-ZBEGNZNMSA-N 1 0 297.826 3.647 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+][C@@H]2CCCC[C@H]2F)cc1 ZINC000840962154 1132314320 /nfs/dbraw/zinc/31/43/20/1132314320.db2.gz IOVSLJJTVQDPMG-SDKBWNRFSA-N 1 0 276.399 3.636 20 10 CHCDRO CO[C@@](C)([C@@H](C)[NH2+]Cc1cc(Cl)cc(C)c1O)C1CC1 ZINC000840961470 1132314340 /nfs/dbraw/zinc/31/43/40/1132314340.db2.gz WPUFTIMJWWWQBD-BZNIZROVSA-N 1 0 297.826 3.647 20 10 CHCDRO C[C@H]1CC[N@H+](Cc2c(O)ccc3ccccc32)CC[C@]1(C)O ZINC001231587458 1132317030 /nfs/dbraw/zinc/31/70/30/1132317030.db2.gz CLLFOENVRJMTDX-LIRRHRJNSA-N 1 0 299.414 3.528 20 10 CHCDRO Oc1ccc2ccccc2c1C[NH+]1CCC2(CCCO2)CC1 ZINC001231589381 1132319473 /nfs/dbraw/zinc/31/94/73/1132319473.db2.gz FALZPHDCPNKGHQ-UHFFFAOYSA-N 1 0 297.398 3.690 20 10 CHCDRO Cc1cccc(C[N@@H+]2Cc3ccccc3C(C)(C)C2)c1O ZINC001231595322 1132320757 /nfs/dbraw/zinc/32/07/57/1132320757.db2.gz WPBOVXHWUMMTMH-UHFFFAOYSA-N 1 0 281.399 3.994 20 10 CHCDRO [NH3+]Cc1ccc(NCc2ccc(N3CCCCC3)cc2)cc1 ZINC000841058098 1132324037 /nfs/dbraw/zinc/32/40/37/1132324037.db2.gz GFKPBIMXRYQDNM-UHFFFAOYSA-N 1 0 295.430 3.748 20 10 CHCDRO COc1ccc(C[NH2+]Cc2cccc3c2CCCN3)cc1C ZINC000841082352 1132326283 /nfs/dbraw/zinc/32/62/83/1132326283.db2.gz DXIIPGGSSGLADU-UHFFFAOYSA-N 1 0 296.414 3.652 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)Cc1ccc(F)cc1OC ZINC001231605308 1132327449 /nfs/dbraw/zinc/32/74/49/1132327449.db2.gz KOBIUMYRMGKVRM-UHFFFAOYSA-N 1 0 289.350 3.562 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCCC(F)(F)[C@H](F)C2)c(O)c1 ZINC001231843360 1132377146 /nfs/dbraw/zinc/37/71/46/1132377146.db2.gz WTBVHAVZCHMFMN-CQSZACIVSA-N 1 0 287.325 3.578 20 10 CHCDRO Cc1cc(C)c(C[N@H+](C)Cc2ccc(F)cc2)c(O)c1 ZINC001231843437 1132377408 /nfs/dbraw/zinc/37/74/08/1132377408.db2.gz ZHRMEZUMVDFZCK-UHFFFAOYSA-N 1 0 273.351 3.780 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCC[C@H]2c2ccccn2)c(O)c1 ZINC001231844148 1132377815 /nfs/dbraw/zinc/37/78/15/1132377815.db2.gz HMNNXTMSTFXALG-KRWDZBQOSA-N 1 0 282.387 3.741 20 10 CHCDRO CC[N@H+](Cc1cccnc1)Cc1cc(Cl)c(C)cc1O ZINC001231870612 1132384008 /nfs/dbraw/zinc/38/40/08/1132384008.db2.gz LZOQTXHGJFJLAG-UHFFFAOYSA-N 1 0 290.794 3.771 20 10 CHCDRO Oc1c(C[N@@H+]2CCC[C@@H](CF)C2)ccc2ccccc21 ZINC001231880669 1132388828 /nfs/dbraw/zinc/38/88/28/1132388828.db2.gz BWDUMZNURCKYIM-ZDUSSCGKSA-N 1 0 273.351 3.727 20 10 CHCDRO CC[N@H+](Cc1ccc2ccccc2c1O)C1CCOCC1 ZINC001231882794 1132390204 /nfs/dbraw/zinc/39/02/04/1132390204.db2.gz VFHHJXIVXNNDTL-UHFFFAOYSA-N 1 0 285.387 3.546 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCCC[C@H]1F)c1ccc(Cl)cc1O ZINC000841756477 1132393113 /nfs/dbraw/zinc/39/31/13/1132393113.db2.gz VVVZYDMGLXKUIA-ZWKOPEQDSA-N 1 0 271.763 3.977 20 10 CHCDRO C[C@@H]([NH2+]CCC(F)(F)F)c1ccc(Cl)cc1O ZINC000841756980 1132394319 /nfs/dbraw/zinc/39/43/19/1132394319.db2.gz DISQXSDMPRUNMW-SSDOTTSWSA-N 1 0 267.678 3.649 20 10 CHCDRO CC[C@@H]([NH2+][C@H](CO)CC1CCCCC1)c1ccccc1O ZINC000841760449 1132395393 /nfs/dbraw/zinc/39/53/93/1132395393.db2.gz FLDUTHAHSPIJOB-DOTOQJQBSA-N 1 0 291.435 3.764 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2COCc3ccccc32)c(O)c1C ZINC000841761634 1132396282 /nfs/dbraw/zinc/39/62/82/1132396282.db2.gz QAFQHHWYRIUSIK-RDTXWAMCSA-N 1 0 297.398 3.931 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cc(C)nc(C)c1 ZINC001232003844 1132409177 /nfs/dbraw/zinc/40/91/77/1132409177.db2.gz WREWVNZGQNMIRJ-UHFFFAOYSA-N 1 0 297.446 3.787 20 10 CHCDRO Oc1cc(O)c(C[NH+]2CC3(C2)CCCCC3)cc1Cl ZINC001232262583 1132445200 /nfs/dbraw/zinc/44/52/00/1132445200.db2.gz KSMGEOPVOAMRQP-UHFFFAOYSA-N 1 0 281.783 3.517 20 10 CHCDRO COc1cc(O)c(C[NH+]2C3CCCC2CCC3)cc1Cl ZINC001232267415 1132447276 /nfs/dbraw/zinc/44/72/76/1132447276.db2.gz BLGSGLXWPDNUFF-UHFFFAOYSA-N 1 0 295.810 3.961 20 10 CHCDRO COc1cc(O)c(C[NH+]2CCCCCCC2)cc1Cl ZINC001232270175 1132447300 /nfs/dbraw/zinc/44/73/00/1132447300.db2.gz WYEVTNWDALGEDR-UHFFFAOYSA-N 1 0 283.799 3.820 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@H](C)CC(F)F)c(O)c1 ZINC000842892783 1132474881 /nfs/dbraw/zinc/47/48/81/1132474881.db2.gz FFNPPZVBTOXSBV-PWSUYJOCSA-N 1 0 271.351 3.951 20 10 CHCDRO C[C@H](C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F)CC(F)F ZINC000842891142 1132475098 /nfs/dbraw/zinc/47/50/98/1132475098.db2.gz ZUQGLYZQJVCADQ-NGZCFLSTSA-N 1 0 287.325 3.961 20 10 CHCDRO C[C@H]([NH2+][C@H]1C[C@@H](OC(C)(C)C)C1)c1cc(F)ccc1O ZINC000842922959 1132475583 /nfs/dbraw/zinc/47/55/83/1132475583.db2.gz ZVAIIECWPCSIQI-WCFLWFBJSA-N 1 0 281.371 3.528 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCS[C@@H]1C)c1cc2c(cc1O)CCCC2 ZINC000842927860 1132476263 /nfs/dbraw/zinc/47/62/63/1132476263.db2.gz GEXHKSIDGOQYSA-HWWQOWPSSA-N 1 0 291.460 3.816 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCS[C@@H]1C)c1ccc(N(C)C)cc1 ZINC000842927359 1132476688 /nfs/dbraw/zinc/47/66/88/1132476688.db2.gz CNDVQMSDWTWLTN-UHOFOFEASA-N 1 0 278.465 3.687 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1C[C@@H](OC(C)(C)C)C1)c1ccccc1O ZINC000842922894 1132476793 /nfs/dbraw/zinc/47/67/93/1132476793.db2.gz YYSQIMPGWIXYSH-VNHYZAJKSA-N 1 0 277.408 3.779 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2CCS[C@H]2C)c1O ZINC000842928827 1132477639 /nfs/dbraw/zinc/47/76/39/1132477639.db2.gz LTXWLLBKQZJTDO-OUJBWJOFSA-N 1 0 285.840 3.899 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2cccc(C(C)(C)C)c2O)C[C@H]1F ZINC001143104597 1132501998 /nfs/dbraw/zinc/50/19/98/1132501998.db2.gz VZLHPTGSNBTIMO-IUODEOHRSA-N 1 0 279.399 3.870 20 10 CHCDRO CC(C)(C)c1cccc(C[N@@H+]2CCC(C)(C)C2)c1O ZINC001143110878 1132504245 /nfs/dbraw/zinc/50/42/45/1132504245.db2.gz SHINUTZBIXXNTM-UHFFFAOYSA-N 1 0 261.409 3.922 20 10 CHCDRO CCCO[C@H]1CC[N@H+](Cc2cccc(C(C)(C)C)c2O)C1 ZINC001143110597 1132504626 /nfs/dbraw/zinc/50/46/26/1132504626.db2.gz KTQVCCBKXBRFEZ-HNNXBMFYSA-N 1 0 291.435 3.691 20 10 CHCDRO CCC[N@H+](CC)Cc1c([O-])cc(Br)cc1F ZINC001233026685 1132564298 /nfs/dbraw/zinc/56/42/98/1132564298.db2.gz CNZJNCWQPTZNNF-UHFFFAOYSA-N 1 0 290.176 3.526 20 10 CHCDRO Cc1cc(Br)cc(C[N@@H+](C)C2CC(C)C2)c1O ZINC001233107028 1132571790 /nfs/dbraw/zinc/57/17/90/1132571790.db2.gz SIOTUGVRJYVHOM-UHFFFAOYSA-N 1 0 298.224 3.693 20 10 CHCDRO Oc1cccc(Cl)c1C[NH+]1CCCCCCC1 ZINC000131980437 1132574492 /nfs/dbraw/zinc/57/44/92/1132574492.db2.gz DNOCGRWQZPFVAL-UHFFFAOYSA-N 1 0 253.773 3.812 20 10 CHCDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CCc3occc3C2)c1 ZINC001233287054 1132594569 /nfs/dbraw/zinc/59/45/69/1132594569.db2.gz UVFLEGRGBOIRCM-UHFFFAOYSA-N 1 0 285.387 3.841 20 10 CHCDRO CC(C)(C)c1ccc(O)c(C[NH+]2CCC(F)CC2)c1 ZINC001233284019 1132595358 /nfs/dbraw/zinc/59/53/58/1132595358.db2.gz DXDLBXNDUFTSES-UHFFFAOYSA-N 1 0 265.372 3.624 20 10 CHCDRO CC(C)[C@@H]1COCC[N@@H+]1Cc1cc(C(C)(C)C)ccc1O ZINC001233286026 1132595699 /nfs/dbraw/zinc/59/56/99/1132595699.db2.gz BKGGODSSHGYRPZ-INIZCTEOSA-N 1 0 291.435 3.547 20 10 CHCDRO CO[C@H]1CC[N@H+](Cc2cc(C(C)(C)C)ccc2O)[C@@H](C)C1 ZINC001233287426 1132596827 /nfs/dbraw/zinc/59/68/27/1132596827.db2.gz PELSODCVZDZLGW-BBRMVZONSA-N 1 0 291.435 3.689 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CCCC3(CCC3)C2)c1O ZINC001233290844 1132598237 /nfs/dbraw/zinc/59/82/37/1132598237.db2.gz ZALCTKGIEXVMOR-UHFFFAOYSA-N 1 0 295.810 3.820 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CCCc2ccccc2C1 ZINC000133966161 1132608731 /nfs/dbraw/zinc/60/87/31/1132608731.db2.gz SCBAKRXKRKVQEF-UHFFFAOYSA-N 1 0 287.790 3.994 20 10 CHCDRO C[C@]1(CF)CC[N@H+](Cc2ccc(C(F)(F)F)cc2O)C1 ZINC001233452115 1132624380 /nfs/dbraw/zinc/62/43/80/1132624380.db2.gz LHAYMWZNSIWSLC-CYBMUJFWSA-N 1 0 291.288 3.593 20 10 CHCDRO CC(C)[NH+](Cc1cccc(OC(F)(F)F)c1O)C(C)C ZINC001233727634 1132670836 /nfs/dbraw/zinc/67/08/36/1132670836.db2.gz NPLWPULAOOPGMC-UHFFFAOYSA-N 1 0 291.313 3.910 20 10 CHCDRO C[C@H]1C[C@@H](c2ccncc2Nc2ccc(N)cc2)C[C@@H]([NH3+])C1 ZINC001159383710 1132837588 /nfs/dbraw/zinc/83/75/88/1132837588.db2.gz KOUCOAKKGDTORZ-GUTXKFCHSA-N 1 0 296.418 3.638 20 10 CHCDRO CC(C)([NH3+])c1ccc(Nc2ccc3c(c2)CCN3)cc1 ZINC001159522109 1132857970 /nfs/dbraw/zinc/85/79/70/1132857970.db2.gz CNYULHCQKZODMQ-UHFFFAOYSA-N 1 0 267.376 3.592 20 10 CHCDRO Cc1cccc(C)c1C[NH2+]Cc1ccc(N(C)C)cc1C ZINC000773397168 1132952955 /nfs/dbraw/zinc/95/29/55/1132952955.db2.gz LTVRDNHMXQOGRK-UHFFFAOYSA-N 1 0 282.431 3.968 20 10 CHCDRO COc1ccc(C[NH2+]CCC[C@H]2C=CCC2)cc1C ZINC001203553670 1133339415 /nfs/dbraw/zinc/33/94/15/1133339415.db2.gz MAFWZZZNYVZURE-HNNXBMFYSA-N 1 0 259.393 3.840 20 10 CHCDRO Cc1cccc(C[N@@H+](C)Cc2cc(Cl)ccc2O)c1 ZINC001203648837 1133348144 /nfs/dbraw/zinc/34/81/44/1133348144.db2.gz WVKNYWGKQHGQJV-UHFFFAOYSA-N 1 0 275.779 3.986 20 10 CHCDRO COc1cc(C)c(C[N@H+](C)Cc2ccccc2O)cc1C ZINC001203759114 1133367349 /nfs/dbraw/zinc/36/73/49/1133367349.db2.gz WMPORIFJMOAWQG-UHFFFAOYSA-N 1 0 285.387 3.650 20 10 CHCDRO Oc1ccc(C[NH+]2CCC3(CCCCC3)CC2)cc1O ZINC001203875123 1133378099 /nfs/dbraw/zinc/37/80/99/1133378099.db2.gz HQPCHCKJMVGZBM-UHFFFAOYSA-N 1 0 275.392 3.644 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CC[C@H]3CCCC[C@H]3C2)cc1 ZINC001203933588 1133386718 /nfs/dbraw/zinc/38/67/18/1133386718.db2.gz AUFIENSMUKZSQO-SJORKVTESA-N 1 0 272.436 3.765 20 10 CHCDRO CCN(CC)c1ccc(C[NH+]2CCC(CF)CC2)cc1 ZINC001203939045 1133386843 /nfs/dbraw/zinc/38/68/43/1133386843.db2.gz JRCCPUMPADFPKF-UHFFFAOYSA-N 1 0 278.415 3.714 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@H+](C)Cc1cccs1 ZINC001204220246 1133420792 /nfs/dbraw/zinc/42/07/92/1133420792.db2.gz CLTZJDPPJZFQAQ-UHFFFAOYSA-N 1 0 274.433 3.755 20 10 CHCDRO CC1CC[NH+](Cc2ccc(N3CCCC3)cc2)CC1 ZINC001204320318 1133436246 /nfs/dbraw/zinc/43/62/46/1133436246.db2.gz SJZQECOEOZMQDA-UHFFFAOYSA-N 1 0 258.409 3.519 20 10 CHCDRO CC(C)[N@@H+](Cc1ccc(N2CCCC2)cc1)CC1CC1 ZINC001204327564 1133436508 /nfs/dbraw/zinc/43/65/08/1133436508.db2.gz ZAHUJSSRHMENAY-UHFFFAOYSA-N 1 0 272.436 3.907 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[N@@H+]1CC2CCC1CC2 ZINC001204322969 1133437021 /nfs/dbraw/zinc/43/70/21/1133437021.db2.gz XBFFRINUCCRGCS-UHFFFAOYSA-N 1 0 270.420 3.661 20 10 CHCDRO C[C@@H]1CCC[N@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001204320057 1133437051 /nfs/dbraw/zinc/43/70/51/1133437051.db2.gz MQPJORYUCYPNTM-OAHLLOKOSA-N 1 0 258.409 3.519 20 10 CHCDRO C[N@@H+](Cc1ccc(N2CCCC2)cc1)CC1CC(F)(F)C1 ZINC001204322645 1133437178 /nfs/dbraw/zinc/43/71/78/1133437178.db2.gz UPLAURLIOUHZQB-UHFFFAOYSA-N 1 0 294.389 3.764 20 10 CHCDRO CCC1CC[NH+](Cc2ccc(N3CCCC3)cc2)CC1 ZINC001204324439 1133437679 /nfs/dbraw/zinc/43/76/79/1133437679.db2.gz LIKYFMLSRMTUQW-UHFFFAOYSA-N 1 0 272.436 3.909 20 10 CHCDRO Cc1cc(C)cc(C[N@@H+]2CCc3cccc(O)c3C2)c1 ZINC001204525305 1133458333 /nfs/dbraw/zinc/45/83/33/1133458333.db2.gz YKMLCXVQYDMWRI-UHFFFAOYSA-N 1 0 267.372 3.567 20 10 CHCDRO CC[N@H+](C/C=C\c1ccc(N(C)C)cc1)CC(C)C ZINC001204880868 1133494653 /nfs/dbraw/zinc/49/46/53/1133494653.db2.gz JJZCKFBBGMDQGX-FPLPWBNLSA-N 1 0 260.425 3.744 20 10 CHCDRO CC(C)C[C@@H]1CC[N@H+](Cc2cc(F)c(N(C)C)cc2F)C1 ZINC001204875615 1133495451 /nfs/dbraw/zinc/49/54/51/1133495451.db2.gz OWIKGPXQPWGJND-ZDUSSCGKSA-N 1 0 296.405 3.899 20 10 CHCDRO CC[N@@H+](Cc1ccc(N(C)C)cc1)C[C@H](CC(C)C)OC ZINC001205143572 1133536601 /nfs/dbraw/zinc/53/66/01/1133536601.db2.gz PVDQBLQNRVGRSM-SFHVURJKSA-N 1 0 292.467 3.636 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2ccc(N(C)C)cc2)cc1F ZINC001205243536 1133549048 /nfs/dbraw/zinc/54/90/48/1133549048.db2.gz JCLAJIXAQYCSEE-UHFFFAOYSA-N 1 0 286.394 3.832 20 10 CHCDRO CC[C@@H]1C[N@H+](Cc2cc(C(C)C)ccc2O)CCCO1 ZINC001205503517 1133583595 /nfs/dbraw/zinc/58/35/95/1133583595.db2.gz ATABXSMTJCEMPM-MRXNPFEDSA-N 1 0 277.408 3.517 20 10 CHCDRO CCC[C@]1(COC)CCC[N@@H+]1Cc1ccc(Cl)cc1O ZINC001205540869 1133585698 /nfs/dbraw/zinc/58/56/98/1133585698.db2.gz LHNXTUDUPTZSIS-MRXNPFEDSA-N 1 0 297.826 3.827 20 10 CHCDRO COc1cc(C)cc(C[NH2+]CC[C@H](C)c2ccccc2)c1O ZINC001205556000 1133588457 /nfs/dbraw/zinc/58/84/57/1133588457.db2.gz ZKWRYAXKENRXJP-HNNXBMFYSA-N 1 0 299.414 3.993 20 10 CHCDRO CCc1cccc(C[N@H+](CCOC)[C@H]2CC[C@@H](C)C2)c1O ZINC001205608817 1133594275 /nfs/dbraw/zinc/59/42/75/1133594275.db2.gz KQNCMWZGKHTIMR-PBHICJAKSA-N 1 0 291.435 3.592 20 10 CHCDRO CC(C)c1ccc(O)c(C[NH2+]CCC2(F)CCC2)c1 ZINC001206127493 1133661432 /nfs/dbraw/zinc/66/14/32/1133661432.db2.gz HIYWRNYRMGBTDF-UHFFFAOYSA-N 1 0 265.372 3.888 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)CC(C)(C)C ZINC001206167961 1133666777 /nfs/dbraw/zinc/66/67/77/1133666777.db2.gz NHQBSYIQIIVQQO-CQSZACIVSA-N 1 0 262.441 3.975 20 10 CHCDRO Oc1cccc2c1C[N@H+](C/C=C\c1ccc(F)c(F)c1)C2 ZINC001207242932 1133782417 /nfs/dbraw/zinc/78/24/17/1133782417.db2.gz GVBSPGWDZKEAAF-IHWYPQMZSA-N 1 0 287.309 3.699 20 10 CHCDRO Oc1cccc2c1C[N@H+](CCCc1ccccc1F)CC2 ZINC001207497401 1133809089 /nfs/dbraw/zinc/80/90/89/1133809089.db2.gz XIAMLTZSMBXFIQ-UHFFFAOYSA-N 1 0 285.362 3.522 20 10 CHCDRO Oc1cc(Cl)ccc1C[NH2+]C[C@@H]1CCCC2(CCC2)O1 ZINC001207700921 1133839990 /nfs/dbraw/zinc/83/99/90/1133839990.db2.gz VQWMMRUBCIHDIM-AWEZNQCLSA-N 1 0 295.810 3.627 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(C[N@@H+](C)C2CC2)cc1 ZINC001209519457 1134034452 /nfs/dbraw/zinc/03/44/52/1134034452.db2.gz VMADYKBQOBKLHH-UHFFFAOYSA-N 1 0 254.377 3.688 20 10 CHCDRO CC(=O)[C@@H]1CC[N@H+](Cc2ccc(-n3c(C)ccc3C)cc2)C1 ZINC001209519694 1134034894 /nfs/dbraw/zinc/03/48/94/1134034894.db2.gz FLECPAMIBHTMKC-GOSISDBHSA-N 1 0 296.414 3.505 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]C1C[C@H]2CC[C@@H](C1)S2 ZINC000403607173 1134812894 /nfs/dbraw/zinc/81/28/94/1134812894.db2.gz UAXHXZIRCZFSSZ-YHWZYXNKSA-N 1 0 283.824 3.562 20 10 CHCDRO CCc1cc(Nc2ccc3c(c2)CCCN3)cc[nH+]1 ZINC000307771064 1134947499 /nfs/dbraw/zinc/94/74/99/1134947499.db2.gz CFDDUTZBMDOVJN-UHFFFAOYSA-N 1 0 253.349 3.746 20 10 CHCDRO CC[C@H](C)CC[C@H](C)Oc1ccc(N2CC[NH2+]CC2)cc1 ZINC001218356276 1135093905 /nfs/dbraw/zinc/09/39/05/1135093905.db2.gz BCXVHWJWJQPBRD-HOTGVXAUSA-N 1 0 290.451 3.690 20 10 CHCDRO CCC[C@H](C)[C@H](CC)Oc1ccc(N2CC[NH2+]CC2)cc1 ZINC001218439344 1135105263 /nfs/dbraw/zinc/10/52/63/1135105263.db2.gz SPFJDIQXZPLFJI-YJBOKZPZSA-N 1 0 290.451 3.690 20 10 CHCDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]CCOc1ccccc1 ZINC000314533575 1135146013 /nfs/dbraw/zinc/14/60/13/1135146013.db2.gz ALLOOTFUTQZWGS-HOCLYGCPSA-N 1 0 297.398 3.918 20 10 CHCDRO COC1(CC[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)CCC1 ZINC000315246675 1135151740 /nfs/dbraw/zinc/15/17/40/1135151740.db2.gz RGNRUPFHJYLOAP-ZIAGYGMSSA-N 1 0 289.419 3.798 20 10 CHCDRO Cc1cc(F)ccc1CC[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000315550534 1135156580 /nfs/dbraw/zinc/15/65/80/1135156580.db2.gz QJCNYVQAWFCRIE-MRXNPFEDSA-N 1 0 285.362 3.659 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCN(C)[C@H](C)C1)c1ccc2ccccc2c1O ZINC000316830241 1135169653 /nfs/dbraw/zinc/16/96/53/1135169653.db2.gz RVFHFZKHYXGQQW-IJEWVQPXSA-N 1 0 298.430 3.679 20 10 CHCDRO C[C@@H]([NH2+]CCCOCC1CC1)c1cc(Cl)ccc1O ZINC000184900869 262033462 /nfs/dbraw/zinc/03/34/62/262033462.db2.gz RUGOUYJEHWFTEW-LLVKDONJSA-N 1 0 283.799 3.513 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)c2cc(C)ccc2O)cc1 ZINC000035628580 260030857 /nfs/dbraw/zinc/03/08/57/260030857.db2.gz IXOLZAGXUUFKRO-ZDUSSCGKSA-N 1 0 271.360 3.560 20 10 CHCDRO CC[C@H]([NH2+]C[C@](C)(OC)C1CC1)c1ccc(C)cc1O ZINC000291301166 522637144 /nfs/dbraw/zinc/63/71/44/522637144.db2.gz SKVIQRLRVNTEOW-RDJZCZTQSA-N 1 0 277.408 3.556 20 10 CHCDRO c1cc(N2CCCCC2)ccc1C[NH2+]C1CCCC1 ZINC000020014230 170969505 /nfs/dbraw/zinc/96/95/05/170969505.db2.gz BSQDSTLLYJPYMV-UHFFFAOYSA-N 1 0 258.409 3.709 20 10 CHCDRO COc1cccc(C[NH2+][C@H](C)c2ccccc2C)c1O ZINC000020126195 171010176 /nfs/dbraw/zinc/01/01/76/171010176.db2.gz WJMQVDONEUXTTD-CYBMUJFWSA-N 1 0 271.360 3.560 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cccc(C)c2)c1 ZINC000020134180 171021763 /nfs/dbraw/zinc/02/17/63/171021763.db2.gz IFMVTRPDDOCXPS-ZDUSSCGKSA-N 1 0 271.360 3.560 20 10 CHCDRO CC(C)CCC[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000038093653 174107627 /nfs/dbraw/zinc/10/76/27/174107627.db2.gz WDMJIEUNFBGWKL-UHFFFAOYSA-N 1 0 260.425 3.813 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)CCc2ccco2)cc1C ZINC000035052675 260006398 /nfs/dbraw/zinc/00/63/98/260006398.db2.gz AJUQDVQQTYLZOH-AWEZNQCLSA-N 1 0 273.376 3.708 20 10 CHCDRO COc1cccc(C[NH2+][C@H](C)c2ccc(F)cc2F)c1O ZINC000036952825 260056366 /nfs/dbraw/zinc/05/63/66/260056366.db2.gz XIRODJBPBZGQER-SNVBAGLBSA-N 1 0 293.313 3.530 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(F)cc2F)c(O)c1 ZINC000051016668 260794833 /nfs/dbraw/zinc/79/48/33/260794833.db2.gz HOCBPLKZVUMGMJ-LLVKDONJSA-N 1 0 277.314 3.830 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCCO1)c1ccc(N2CCCCC2)cc1 ZINC000153136969 261073560 /nfs/dbraw/zinc/07/35/60/261073560.db2.gz QASVERGWUKBZBV-CRAIPNDOSA-N 1 0 288.435 3.507 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCCO1)c1ccc(N2CCCCC2)cc1 ZINC000153136864 261073594 /nfs/dbraw/zinc/07/35/94/261073594.db2.gz QASVERGWUKBZBV-MAUKXSAKSA-N 1 0 288.435 3.507 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](O)c1ccccc1)c1ccc(N(C)C)cc1 ZINC000153830995 261083353 /nfs/dbraw/zinc/08/33/53/261083353.db2.gz XGQNBEUTKMSXTM-RBUKOAKNSA-N 1 0 298.430 3.527 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CC)c1ccncc1)c1ccccc1O ZINC000156002531 261111781 /nfs/dbraw/zinc/11/17/81/261111781.db2.gz PPAGKJMBFCLIPT-JKSUJKDBSA-N 1 0 270.376 3.979 20 10 CHCDRO C[C@@H]([NH2+][C@H](CCO)c1ccccc1)c1ccc(N(C)C)cc1 ZINC000160985603 261233566 /nfs/dbraw/zinc/23/35/66/261233566.db2.gz KSNCTSNJLCIZGI-DNVCBOLYSA-N 1 0 298.430 3.527 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCCOC1)c1ccc(N2CCCCC2)cc1 ZINC000177926713 261720438 /nfs/dbraw/zinc/72/04/38/261720438.db2.gz VYOJKPXJZGDUNN-RDJZCZTQSA-N 1 0 288.435 3.507 20 10 CHCDRO C[C@H](O)c1ccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)cc1 ZINC000178546906 261749199 /nfs/dbraw/zinc/74/91/99/261749199.db2.gz KIXBMOWSJJGNCK-GJZGRUSLSA-N 1 0 298.430 3.657 20 10 CHCDRO C[C@@H]([NH2+]CCC[C@@H]1CCCCO1)c1cc(F)ccc1O ZINC000184000306 262004420 /nfs/dbraw/zinc/00/44/20/262004420.db2.gz XFCHLLYBMCCEKR-OCCSQVGLSA-N 1 0 281.371 3.531 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccccn1)c1cc2c(cc1O)CCCC2 ZINC000184839341 262030913 /nfs/dbraw/zinc/03/09/13/262030913.db2.gz VOPWPJWZRSXUTA-CQSZACIVSA-N 1 0 296.414 3.559 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)c2cc(C)ccc2O)cc1F ZINC000184927589 262033978 /nfs/dbraw/zinc/03/39/78/262033978.db2.gz MZHSQROQQFDHDK-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)c2cc(F)ccc2O)cc1F ZINC000184927960 262034171 /nfs/dbraw/zinc/03/41/71/262034171.db2.gz KKRDIPIBWIZOHE-JTQLQIEISA-N 1 0 293.313 3.530 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(C)cc2C)c1 ZINC000185066727 262039125 /nfs/dbraw/zinc/03/91/25/262039125.db2.gz VXPOWOUCHXSBRM-CQSZACIVSA-N 1 0 285.387 3.868 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H](CCO)c2ccccc2)c(O)c1 ZINC000185525986 262058696 /nfs/dbraw/zinc/05/86/96/262058696.db2.gz OBQWECCVXJAJCL-RDJZCZTQSA-N 1 0 299.414 3.517 20 10 CHCDRO C[C@@H]([NH2+]CC1(CCO)CCCCC1)c1cc(F)ccc1O ZINC000185669640 262065395 /nfs/dbraw/zinc/06/53/95/262065395.db2.gz QMIBMOGLSAPHHX-CYBMUJFWSA-N 1 0 295.398 3.515 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)C1CCOCC1)c1cc(Cl)ccc1O ZINC000185782213 262070674 /nfs/dbraw/zinc/07/06/74/262070674.db2.gz QRNMFAKVDPLQTI-GHMZBOCLSA-N 1 0 283.799 3.511 20 10 CHCDRO COC[C@@H]([NH2+][C@H](C)c1cc(C)ccc1O)c1ccccc1 ZINC000186034378 262076229 /nfs/dbraw/zinc/07/62/29/262076229.db2.gz SMMQCZZMVQXTAN-RHSMWYFYSA-N 1 0 285.387 3.739 20 10 CHCDRO CCOCCC1(C[NH2+][C@H](C)c2cc(C)ccc2O)CCC1 ZINC000186115910 262079790 /nfs/dbraw/zinc/07/97/90/262079790.db2.gz JCIVGUPXXBSHIL-OAHLLOKOSA-N 1 0 291.435 3.948 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2nc(C3CC3)cs2)c1 ZINC000186117322 262080343 /nfs/dbraw/zinc/08/03/43/262080343.db2.gz PPODJHJJHFVDFK-NSHDSACASA-N 1 0 288.416 3.885 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCOC3(CCCC3)C2)c1 ZINC000186129118 262081141 /nfs/dbraw/zinc/08/11/41/262081141.db2.gz FTQATLPYURFWKM-GJZGRUSLSA-N 1 0 289.419 3.843 20 10 CHCDRO COc1cc(F)cc(C[NH2+][C@@H](C)c2ccc(C)cc2O)c1 ZINC000186216897 262084735 /nfs/dbraw/zinc/08/47/35/262084735.db2.gz YSURJYHGYNXSLA-LBPRGKRZSA-N 1 0 289.350 3.699 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(Cl)cn2)c1 ZINC000186229849 262085608 /nfs/dbraw/zinc/08/56/08/262085608.db2.gz NUVOISZTBQJILM-LLVKDONJSA-N 1 0 276.767 3.600 20 10 CHCDRO C/C=C/C[C@H](CO)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000186519441 262096395 /nfs/dbraw/zinc/09/63/95/262096395.db2.gz QSZKQLBNYLOJNH-PRXHZCDDSA-N 1 0 285.387 3.523 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(C(C)(C)O)cc2)c(O)c1 ZINC000186602900 262101516 /nfs/dbraw/zinc/10/15/16/262101516.db2.gz NQCOGXDKZXXSRR-AWEZNQCLSA-N 1 0 299.414 3.779 20 10 CHCDRO Cc1cnc([C@H](C)C[NH2+][C@@H](C)c2cc(C)ccc2O)s1 ZINC000186766174 262108637 /nfs/dbraw/zinc/10/86/37/262108637.db2.gz ZYIXKVVLSNVZNA-YPMHNXCESA-N 1 0 290.432 3.920 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCCOCC1)c1ccc2ccccc2c1O ZINC000186234509 262312366 /nfs/dbraw/zinc/31/23/66/262312366.db2.gz SZACOSGZDAOETR-UKRRQHHQSA-N 1 0 285.387 3.765 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CN(C)Cc3ccccc32)c(O)c1 ZINC000370375082 267313324 /nfs/dbraw/zinc/31/33/24/267313324.db2.gz QWWMVJFOAANCDB-KSSFIOAISA-N 1 0 296.414 3.538 20 10 CHCDRO CC(C)OCCC[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000184863405 327834653 /nfs/dbraw/zinc/83/46/53/327834653.db2.gz FMHBACSYSZEKBM-LLVKDONJSA-N 1 0 271.788 3.511 20 10 CHCDRO COc1ccc([C@H](C)[NH2+][C@H](C)c2ccccc2O)cc1 ZINC000090339505 327094218 /nfs/dbraw/zinc/09/42/18/327094218.db2.gz MBTJCKHUELCVNA-QWHCGFSZSA-N 1 0 271.360 3.813 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C(C)(C)c2ccccc2)c1 ZINC000264970512 330006374 /nfs/dbraw/zinc/00/63/74/330006374.db2.gz QOPWACUJIUAJAT-UHFFFAOYSA-N 1 0 255.361 3.726 20 10 CHCDRO C[C@H]1C[C@@H]([NH2+]CC2CC=CC2)c2c1c(F)ccc2O ZINC000527951661 330294450 /nfs/dbraw/zinc/29/44/50/330294450.db2.gz RJPQXFQEPAFKKM-GXFFZTMASA-N 1 0 261.340 3.635 20 10 CHCDRO C[C@H]([NH2+][C@H]1[C@@H](C)[C@@H](C)O[C@H]1C)c1ccc(Cl)cc1O ZINC000528008394 330303530 /nfs/dbraw/zinc/30/35/30/330303530.db2.gz TZKCDTUBMHBFTC-AOVQSLKQSA-N 1 0 283.799 3.508 20 10 CHCDRO COc1ccc([C@@H]([NH2+][C@H](C)c2ccccc2O)C2CC2)cn1 ZINC000528041631 330305795 /nfs/dbraw/zinc/30/57/95/330305795.db2.gz BTFQBOVMGILOFG-XIKOKIGWSA-N 1 0 298.386 3.598 20 10 CHCDRO Cc1cccc(C[NH2+][C@H]2CCCc3sccc32)c1O ZINC000154657400 330663276 /nfs/dbraw/zinc/66/32/76/330663276.db2.gz OADGJFRHKMPOSD-AWEZNQCLSA-N 1 0 273.401 3.929 20 10 CHCDRO CC(C)[C@H](CCO)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000230664225 333320085 /nfs/dbraw/zinc/32/00/85/333320085.db2.gz SVLDXMFOWJHGCX-DYVFJYSZSA-N 1 0 287.403 3.603 20 10 CHCDRO CC(C)C[NH2+]Cc1ccc(N2CCC(C)CC2)cc1 ZINC000062734054 519747101 /nfs/dbraw/zinc/74/71/01/519747101.db2.gz GNMFGXOXEFOTHE-UHFFFAOYSA-N 1 0 260.425 3.669 20 10 CHCDRO CC[NH+](CC)Cc1ccc(NCc2ccccc2O)cc1 ZINC000076262613 520753522 /nfs/dbraw/zinc/75/35/22/520753522.db2.gz VCEKNBITNGXNJI-UHFFFAOYSA-N 1 0 284.403 3.846 20 10 CHCDRO CCCc1nc(C)c(C[NH2+]Cc2cc(C)c(C)cc2O)o1 ZINC000291735684 521497177 /nfs/dbraw/zinc/49/71/77/521497177.db2.gz OJVLVSFFDNGNQX-UHFFFAOYSA-N 1 0 288.391 3.548 20 10 CHCDRO C[NH+](C)Cc1ccc(NCc2cccc(Cl)c2O)cc1 ZINC000158043224 521910322 /nfs/dbraw/zinc/91/03/22/521910322.db2.gz GZHSYQYYQNOZKI-UHFFFAOYSA-N 1 0 290.794 3.719 20 10 CHCDRO CC[C@H]([NH2+]CCCCOC(C)C)c1ccc(C)cc1O ZINC000280263964 522580459 /nfs/dbraw/zinc/58/04/59/522580459.db2.gz XKKNMLDTROUDJQ-INIZCTEOSA-N 1 0 279.424 3.947 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1cccnc1)c1ccc(C)cc1O ZINC000280099200 522699395 /nfs/dbraw/zinc/69/93/95/522699395.db2.gz MYRYKLNYKRNJKF-BBRMVZONSA-N 1 0 270.376 3.898 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCOC2(CCC2)C1)c1ccccc1O ZINC000274961636 522719869 /nfs/dbraw/zinc/71/98/69/522719869.db2.gz WVUXKJBKONNYMS-HIFRSBDPSA-N 1 0 275.392 3.535 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](O)c1ccsc1)c1ccc(C)cc1O ZINC000279970156 522865110 /nfs/dbraw/zinc/86/51/10/522865110.db2.gz CYPHWHCLYKRUAZ-ZBFHGGJFSA-N 1 0 291.416 3.536 20 10 CHCDRO CC[C@@H]([NH2+]Cc1c(C)noc1C)c1ccc(C)cc1O ZINC000280295822 522870030 /nfs/dbraw/zinc/87/00/30/522870030.db2.gz ZNEREOJHHFLTSE-OAHLLOKOSA-N 1 0 274.364 3.546 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cccc(OC)c1)c1ccc(C)cc1O ZINC000280156368 522884093 /nfs/dbraw/zinc/88/40/93/522884093.db2.gz QLLJMPNZEHRMHD-QGZVFWFLSA-N 1 0 285.387 3.950 20 10 CHCDRO CC[C@@H](c1ccncc1)[N@H+](C)Cc1cc(F)ccc1O ZINC000290293409 523120021 /nfs/dbraw/zinc/12/00/21/523120021.db2.gz APQIASJZCRWSBE-HNNXBMFYSA-N 1 0 274.339 3.509 20 10 CHCDRO Cc1cccc(C(C)(C)[NH2+]Cc2ccccc2O)c1 ZINC000130448830 524232740 /nfs/dbraw/zinc/23/27/40/524232740.db2.gz ASJKJTYVMJZSJR-UHFFFAOYSA-N 1 0 255.361 3.726 20 10 CHCDRO C[C@H](CCc1ccc(O)cc1)[NH2+][C@H]1CCc2cccc(O)c21 ZINC000297568307 524235454 /nfs/dbraw/zinc/23/54/54/524235454.db2.gz GLCZFRJFGSRMHU-DYVFJYSZSA-N 1 0 297.398 3.696 20 10 CHCDRO C[C@@H](CCc1ccc(O)cc1)[NH2+][C@H]1CCc2cccc(O)c21 ZINC000297568308 524526049 /nfs/dbraw/zinc/52/60/49/524526049.db2.gz GLCZFRJFGSRMHU-GUYCJALGSA-N 1 0 297.398 3.696 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@H](C)c2cccc(Cl)c2)c1 ZINC000020124329 524754963 /nfs/dbraw/zinc/75/49/63/524754963.db2.gz XFYMTMBKPOOTSI-LLVKDONJSA-N 1 0 291.778 3.905 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(F)c(F)c2)c1 ZINC000049577276 524772816 /nfs/dbraw/zinc/77/28/16/524772816.db2.gz ICFLZOGQQMILFY-JTQLQIEISA-N 1 0 293.313 3.530 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C2(c3nccs3)CCCC2)c1 ZINC000265202500 525345334 /nfs/dbraw/zinc/34/53/34/525345334.db2.gz BLJWJJUDRAJZBX-UHFFFAOYSA-N 1 0 288.416 3.716 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H]2CCC[C@@H](C(F)(F)F)C2)c1 ZINC000071407919 525354494 /nfs/dbraw/zinc/35/44/94/525354494.db2.gz WMPYGTADAPGMGI-OLZOCXBDSA-N 1 0 287.325 3.911 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCCc2ncccc2C)c1 ZINC000296522481 525360576 /nfs/dbraw/zinc/36/05/76/525360576.db2.gz PZTBZHPIZLMCFB-OAHLLOKOSA-N 1 0 284.403 3.687 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccc3c(n2)CCCC3)c1 ZINC000278586900 525364371 /nfs/dbraw/zinc/36/43/71/525364371.db2.gz YPUFCZHRCMGIBC-AWEZNQCLSA-N 1 0 296.414 3.825 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccccc1N(C)C ZINC000093941543 525526976 /nfs/dbraw/zinc/52/69/76/525526976.db2.gz QNNCDBQDKHXCEL-OAHLLOKOSA-N 1 0 297.446 3.669 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCCC(C)(F)F)c(O)c1 ZINC000297307271 525726298 /nfs/dbraw/zinc/72/62/98/525726298.db2.gz MRADEFNUNJTONB-LLVKDONJSA-N 1 0 257.324 3.787 20 10 CHCDRO c1cc(N2CCCCC2)ccc1C[NH2+]C[C@H]1CCSC1 ZINC000226376784 526431269 /nfs/dbraw/zinc/43/12/69/526431269.db2.gz VFMVKBOGUZEUIP-MRXNPFEDSA-N 1 0 290.476 3.520 20 10 CHCDRO Cc1nc(C)c([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2)s1 ZINC000040445929 526754375 /nfs/dbraw/zinc/75/43/75/526754375.db2.gz JOXBAPZKIACMDF-NSHDSACASA-N 1 0 289.448 3.677 20 10 CHCDRO C[N@H+](Cc1ccc(OC(F)F)cc1)Cc1ccccc1O ZINC000109771143 1125469289 /nfs/dbraw/zinc/46/92/89/1125469289.db2.gz CKJYKTLMAWFYMY-UHFFFAOYSA-N 1 0 293.313 3.626 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2CCCc3occc32)cc1F ZINC000113320814 1125494296 /nfs/dbraw/zinc/49/42/96/1125494296.db2.gz YNTDYNUPTWYSOF-OAHLLOKOSA-N 1 0 288.366 3.652 20 10 CHCDRO CCCC[C@@H](C)[C@@H](C)[NH2+]Cc1c([O-])cccc1F ZINC001183918662 1122247905 /nfs/dbraw/zinc/24/79/05/1122247905.db2.gz BETWXKUEOLOTSF-VXGBXAGGSA-N 1 0 253.361 3.836 20 10 CHCDRO CCC(CC)[C@@H](O)C[NH2+][C@@H](CC)c1cc(Cl)ccc1O ZINC000775503159 1122631122 /nfs/dbraw/zinc/63/11/22/1122631122.db2.gz CTLRWNNUFFIVTQ-HOCLYGCPSA-N 1 0 299.842 3.883 20 10 CHCDRO Cc1cccc(C[N@H+](C2CC2)C2CCCCC2)c1O ZINC000775651837 1122866354 /nfs/dbraw/zinc/86/63/54/1122866354.db2.gz QVTJBVBUATWAFT-UHFFFAOYSA-N 1 0 259.393 3.998 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)C1CC(F)(F)C1 ZINC000862280143 1123798390 /nfs/dbraw/zinc/79/83/90/1123798390.db2.gz WNNHFPZFSDHDBP-LBPRGKRZSA-N 1 0 282.378 3.584 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]CC1CCC(F)(F)CC1 ZINC000877500271 1125035697 /nfs/dbraw/zinc/03/56/97/1125035697.db2.gz QZDLOQNJDNLUFK-UHFFFAOYSA-N 1 0 269.335 3.616 20 10 CHCDRO CC(C)(C[NH2+][C@@H]1CCc2cccc(O)c21)CC(F)F ZINC000883259887 1125387095 /nfs/dbraw/zinc/38/70/95/1125387095.db2.gz CFIKRHHGPCJDJK-LLVKDONJSA-N 1 0 269.335 3.651 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCC(F)(F)C(C)(C)C2)c1 ZINC001140619781 1131829150 /nfs/dbraw/zinc/82/91/50/1131829150.db2.gz OLZUAKWSWDDALK-UHFFFAOYSA-N 1 0 269.335 3.568 20 10 CHCDRO Cc1ncc(C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)o1 ZINC000840794091 1132287183 /nfs/dbraw/zinc/28/71/83/1132287183.db2.gz CNLPCNBLSMUBKC-VIFPVBQESA-N 1 0 280.755 3.501 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCCC[C@H]2F)c1 ZINC000840877238 1132300878 /nfs/dbraw/zinc/30/08/78/1132300878.db2.gz ZQXXANGIOHETMJ-MRVWCRGKSA-N 1 0 251.345 3.632 20 10 CHCDRO C[C@@H](CCC1CCCC1)[NH2+]CCc1ccc(N)cc1 ZINC000841034641 1132320915 /nfs/dbraw/zinc/32/09/15/1132320915.db2.gz IYRAFWDZBMMNRD-AWEZNQCLSA-N 1 0 260.425 3.760 20 10 CHCDRO CCC1(CC)CC[NH+](Cc2cccc(OC)c2O)CC1 ZINC000134078067 1125527880 /nfs/dbraw/zinc/52/78/80/1125527880.db2.gz UFAOLMOOWRTDHZ-UHFFFAOYSA-N 1 0 277.408 3.803 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cccc(N(C)C)c1)c1ccccc1O ZINC000121083349 1125555808 /nfs/dbraw/zinc/55/58/08/1125555808.db2.gz XMYPACUPEHOIKW-QGZVFWFLSA-N 1 0 284.403 3.699 20 10 CHCDRO CCCC[NH2+][C@H](C)c1ccc(Br)cc1O ZINC000134902838 1125569513 /nfs/dbraw/zinc/56/95/13/1125569513.db2.gz ZBOMJKMKDKEUDH-SECBINFHSA-N 1 0 272.186 3.605 20 10 CHCDRO CCCC[NH2+][C@H](C)c1cc(Br)ccc1O ZINC000134902548 1125569700 /nfs/dbraw/zinc/56/97/00/1125569700.db2.gz OFNOMJZINCGGQB-SECBINFHSA-N 1 0 272.186 3.605 20 10 CHCDRO CCOC[C@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)C(C)C ZINC000841753801 1125592028 /nfs/dbraw/zinc/59/20/28/1125592028.db2.gz WOAYGEAGYPUBBR-FZMZJTMJSA-N 1 0 285.815 3.757 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1cc[nH]c(=O)c1)c1ccc(Cl)cc1O ZINC000841757259 1125596547 /nfs/dbraw/zinc/59/65/47/1125596547.db2.gz MWEJKWMZYRUSLJ-VHSXEESVSA-N 1 0 292.766 3.558 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H]2CCOC3(CCCCC3)C2)c1 ZINC000136744535 1125647695 /nfs/dbraw/zinc/64/76/95/1125647695.db2.gz IJQDUUORCNZFKH-INIZCTEOSA-N 1 0 289.419 3.672 20 10 CHCDRO CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](C)c1c([O-])cccc1F ZINC000886487854 1125679970 /nfs/dbraw/zinc/67/99/70/1125679970.db2.gz XYAMTAJNJMWBLW-UONOGXRCSA-N 1 0 296.430 3.692 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCCSC1)c1ccc(N(C)C)cc1 ZINC000286859865 1125753785 /nfs/dbraw/zinc/75/37/85/1125753785.db2.gz BAWZXIUNXGOYKK-ZIAGYGMSSA-N 1 0 278.465 3.546 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1CCCSC1)c1ccccc1O ZINC000286963302 1125756258 /nfs/dbraw/zinc/75/62/58/1125756258.db2.gz IBPYJIUOBXAPQB-GXTWGEPZSA-N 1 0 265.422 3.576 20 10 CHCDRO CN(C)c1ccc(C[NH+]2CCC(OC(C)(C)C)CC2)cc1 ZINC000092454017 1125757786 /nfs/dbraw/zinc/75/77/86/1125757786.db2.gz HAXHYYIOSBDWJY-UHFFFAOYSA-N 1 0 290.451 3.532 20 10 CHCDRO C[C@H](C1CC1)[N@H+](Cc1cc(Cl)ccc1O)C1CC1 ZINC000768532523 1129861707 /nfs/dbraw/zinc/86/17/07/1129861707.db2.gz MOYCREFCSHQTRC-SNVBAGLBSA-N 1 0 265.784 3.809 20 10 CHCDRO CSC1(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)CC1 ZINC000788605164 1130197171 /nfs/dbraw/zinc/19/71/71/1130197171.db2.gz GUPJLLXXBOIDBH-ONGXEEELSA-N 1 0 281.396 3.565 20 10 CHCDRO Cc1cccc(C[NH2+]Cc2ccc(OC(F)F)cc2)c1O ZINC000158066115 1126745689 /nfs/dbraw/zinc/74/56/89/1126745689.db2.gz VCVISMMFMUNWSQ-UHFFFAOYSA-N 1 0 293.313 3.592 20 10 CHCDRO Oc1ccccc1C[NH2+]Cc1ccc(C(F)F)cc1 ZINC000159800786 1126753407 /nfs/dbraw/zinc/75/34/07/1126753407.db2.gz VPJBOGMDEHUIPJ-UHFFFAOYSA-N 1 0 263.287 3.620 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H]1CCC[C@@H]2C[C@@H]21 ZINC001202769754 1126774961 /nfs/dbraw/zinc/77/49/61/1126774961.db2.gz ZZKUJACODRZETN-KBMXLJTQSA-N 1 0 268.404 3.765 20 10 CHCDRO Cc1ncc(C[N@@H+](C)Cc2cc(Cl)cc(C)c2O)s1 ZINC000179790665 1126834005 /nfs/dbraw/zinc/83/40/05/1126834005.db2.gz XPAVKNVGLOKNNE-UHFFFAOYSA-N 1 0 296.823 3.751 20 10 CHCDRO Cc1cc(Cl)ccc1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC001649006027 1126839147 /nfs/dbraw/zinc/83/91/47/1126839147.db2.gz VPSOOARCDVEUCO-UHFFFAOYSA-N 1 0 287.790 3.873 20 10 CHCDRO Cc1cc(N(C)C)ccc1CNc1ccc(C(C)(C)[NH3+])cc1 ZINC000904477375 1126854094 /nfs/dbraw/zinc/85/40/94/1126854094.db2.gz VAFXVBHVFPDPOZ-UHFFFAOYSA-N 1 0 297.446 3.867 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+](C)[C@@H](C)c2ccccn2)c1O ZINC000182066854 1126865802 /nfs/dbraw/zinc/86/58/02/1126865802.db2.gz QKPABYQMIQUOFS-LBPRGKRZSA-N 1 0 290.794 3.942 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccccc1O ZINC000183414091 1126886725 /nfs/dbraw/zinc/88/67/25/1126886725.db2.gz ZEUCWXFQVZRUIZ-HNNXBMFYSA-N 1 0 296.414 3.843 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCOc2ccccc21)c1ccccc1O ZINC000183504759 1126887591 /nfs/dbraw/zinc/88/75/91/1126887591.db2.gz NJDYZEUBTUQLHF-ZIAGYGMSSA-N 1 0 283.371 3.609 20 10 CHCDRO CC(C)c1nc(CC[NH2+][C@@H](C)c2ccccc2O)cs1 ZINC000183482868 1126887659 /nfs/dbraw/zinc/88/76/59/1126887659.db2.gz AGCIJQWFMJHJPK-LBPRGKRZSA-N 1 0 290.432 3.865 20 10 CHCDRO CCc1nc([C@@H](C)[NH2+][C@H](C)c2ccccc2O)cs1 ZINC000183508221 1126887965 /nfs/dbraw/zinc/88/79/65/1126887965.db2.gz SOSSSJKFSFMJQS-GHMZBOCLSA-N 1 0 276.405 3.823 20 10 CHCDRO C[C@H](C[NH2+][C@H](C)c1ccccc1O)Oc1ccccc1F ZINC000183534739 1126888963 /nfs/dbraw/zinc/88/89/63/1126888963.db2.gz XOEPOMDZRLNLRS-CHWSQXEVSA-N 1 0 289.350 3.649 20 10 CHCDRO C[C@@H]([NH2+]C[C@H](C)Oc1ccccc1)c1ccccc1O ZINC000183605579 1126889806 /nfs/dbraw/zinc/88/98/06/1126889806.db2.gz UHGRBRQGDOXHSO-UONOGXRCSA-N 1 0 271.360 3.510 20 10 CHCDRO CCOC1CC(CC[NH2+]Cc2cc(Cl)cc(C)c2O)C1 ZINC000187977680 1126917653 /nfs/dbraw/zinc/91/76/53/1126917653.db2.gz GRYVITIFYVRQKY-UHFFFAOYSA-N 1 0 297.826 3.649 20 10 CHCDRO CCOC1CC(CC[NH2+][C@@H](C)c2ccc(N(C)C)cc2)C1 ZINC000189258791 1126929554 /nfs/dbraw/zinc/92/95/54/1126929554.db2.gz ZPHQKZZUTUSVML-SYJJWHGVSA-N 1 0 290.451 3.608 20 10 CHCDRO Cc1nc([C@H]2CCC[N@@H+]2Cc2cc(C)ccc2O)cs1 ZINC000189940941 1126937285 /nfs/dbraw/zinc/93/72/85/1126937285.db2.gz PCQJHBMVDRQZPB-OAHLLOKOSA-N 1 0 288.416 3.803 20 10 CHCDRO Cc1cc(C[NH+]2CCC(C(F)F)CC2)ccc1N(C)C ZINC000815062262 1130954342 /nfs/dbraw/zinc/95/43/42/1130954342.db2.gz RBPYGNLUZNAUGH-UHFFFAOYSA-N 1 0 282.378 3.538 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+]C[C@H]2CCC(F)(F)C2)c1O ZINC000797603830 1130997922 /nfs/dbraw/zinc/99/79/22/1130997922.db2.gz BJRLDRAOGUAOKF-JTQLQIEISA-N 1 0 289.753 3.879 20 10 CHCDRO Cc1ccncc1[C@@H](C)[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000271332752 1127076181 /nfs/dbraw/zinc/07/61/81/1127076181.db2.gz BGUFICYXPMPRMB-OAHLLOKOSA-N 1 0 295.430 3.623 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H]2CCCc3cn[nH]c32)cc1 ZINC000271436418 1127081680 /nfs/dbraw/zinc/08/16/80/1127081680.db2.gz BQFCUQXAGVXDIE-GUYCJALGSA-N 1 0 298.434 3.594 20 10 CHCDRO Cc1cccnc1C[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000271574179 1127093268 /nfs/dbraw/zinc/09/32/68/1127093268.db2.gz UPSZQGMHICUBCT-UHFFFAOYSA-N 1 0 295.430 3.621 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@H]2CCO[C@H](C)C2)cc1 ZINC000271639877 1127095735 /nfs/dbraw/zinc/09/57/35/1127095735.db2.gz ZOFJTRWQCGCUMC-PMPSAXMXSA-N 1 0 290.451 3.608 20 10 CHCDRO CC1(F)CC[NH+](Cc2c(O)ccc(F)c2Cl)CC1 ZINC001237121225 1131056004 /nfs/dbraw/zinc/05/60/04/1131056004.db2.gz LBUNPMALEAXKJC-UHFFFAOYSA-N 1 0 275.726 3.509 20 10 CHCDRO C[N@H+](Cc1cc(C(F)(F)F)ccc1O)CC(C)(C)C ZINC001237139854 1131057190 /nfs/dbraw/zinc/05/71/90/1131057190.db2.gz QDOAPKGBBTYJTI-UHFFFAOYSA-N 1 0 275.314 3.889 20 10 CHCDRO CC[C@H](CC(F)(F)F)[NH2+]Cc1cc(C)c(C)cc1O ZINC000760651159 1127144835 /nfs/dbraw/zinc/14/48/35/1127144835.db2.gz BJPLSHQPVFCXAN-GFCCVEGCSA-N 1 0 275.314 3.830 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccsc2)c(O)c1 ZINC000283893882 1127162074 /nfs/dbraw/zinc/16/20/74/1127162074.db2.gz CQDMZXXMJVLWDS-GFCCVEGCSA-N 1 0 261.390 3.921 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CCC[C@H]1[C@@H]1CCCO1 ZINC000284016703 1127169984 /nfs/dbraw/zinc/16/99/84/1127169984.db2.gz HXVXPPMESBQCPZ-HKUYNNGSSA-N 1 0 297.398 3.689 20 10 CHCDRO Cc1csc(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)n1 ZINC000284264028 1127179214 /nfs/dbraw/zinc/17/92/14/1127179214.db2.gz WLCYOFKNMMSRDP-GFCCVEGCSA-N 1 0 276.405 3.625 20 10 CHCDRO Oc1cc(Cl)c(F)cc1CN1CCCC[C@@H](F)C1 ZINC001237934553 1131153926 /nfs/dbraw/zinc/15/39/26/1131153926.db2.gz KNHDSMXRLIOPOX-SNVBAGLBSA-N 1 0 275.726 3.509 20 10 CHCDRO C[C@]1(F)CCCN(Cc2cc(F)c(Cl)cc2O)C1 ZINC001237934706 1131154134 /nfs/dbraw/zinc/15/41/34/1131154134.db2.gz NFJDYCWHGRWYOZ-ZDUSSCGKSA-N 1 0 275.726 3.509 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1ccccc1O ZINC000285826929 1127244011 /nfs/dbraw/zinc/24/40/11/1127244011.db2.gz XLSUEYXHHGOMSL-HZMBPMFUSA-N 1 0 292.329 3.867 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC[C@H](C(F)(F)F)C2)cc1C ZINC000057535366 1127263150 /nfs/dbraw/zinc/26/31/50/1127263150.db2.gz HFEICHDYJJYCTM-ZDUSSCGKSA-N 1 0 287.325 3.783 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccc(N)cc1)C1CCCCC1 ZINC000817955453 1131190017 /nfs/dbraw/zinc/19/00/17/1131190017.db2.gz BEYKTCWMPQORNK-QGZVFWFLSA-N 1 0 260.425 3.760 20 10 CHCDRO CCC[C@H]([NH2+]CCc1ccc(N)cc1)C1CCCC1 ZINC000817956743 1131190918 /nfs/dbraw/zinc/19/09/18/1131190918.db2.gz BUVLUCOIDMCOJQ-KRWDZBQOSA-N 1 0 260.425 3.760 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCC(C)(C)C1)c1cc(F)ccc1O ZINC000168861833 1131201731 /nfs/dbraw/zinc/20/17/31/1131201731.db2.gz QICPOAXNPOPSIX-CMPLNLGQSA-N 1 0 251.345 3.761 20 10 CHCDRO COCc1ccc(C[NH2+]Cc2c(C)c3ccccc3n2C)o1 ZINC000355125874 1127318847 /nfs/dbraw/zinc/31/88/47/1127318847.db2.gz RAVUWKIYSYYPFY-UHFFFAOYSA-N 1 0 298.386 3.516 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+]C/C=C/c1ccncc1 ZINC000355123412 1127319043 /nfs/dbraw/zinc/31/90/43/1127319043.db2.gz JXOSDBZTODSWRC-AATRIKPKSA-N 1 0 291.398 3.685 20 10 CHCDRO CC[C@@H](CC(F)(F)F)[NH2+][C@@H](C)c1ccccc1O ZINC000760903764 1127325376 /nfs/dbraw/zinc/32/53/76/1127325376.db2.gz YRGTXWGIIAEOBV-UWVGGRQHSA-N 1 0 261.287 3.774 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H]2c3ccccc3O[C@H]2C)cc1C ZINC000288544456 1127346124 /nfs/dbraw/zinc/34/61/24/1127346124.db2.gz LBBSCHLLNYNZHH-UGSOOPFHSA-N 1 0 283.371 3.621 20 10 CHCDRO CCCC[C@@H](CCC)[NH2+]Cc1cccc(OC)c1O ZINC000226269724 1127389313 /nfs/dbraw/zinc/38/93/13/1127389313.db2.gz QHWVFFCUCMEKEO-CQSZACIVSA-N 1 0 265.397 3.849 20 10 CHCDRO c1cc(C[NH2+]C2CCC3(CCC3)CC2)cc2c1OCC2 ZINC001649010223 1127398812 /nfs/dbraw/zinc/39/88/12/1127398812.db2.gz RSPUNJWZGDNRTO-UHFFFAOYSA-N 1 0 271.404 3.824 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]CCc1ccc(Cl)cc1 ZINC000226582178 1127411861 /nfs/dbraw/zinc/41/18/61/1127411861.db2.gz DXJBHELXVYEIRJ-UHFFFAOYSA-N 1 0 279.742 3.517 20 10 CHCDRO C[C@H]1CCCC[N@H+](Cc2cc(F)c(N(C)C)cc2F)C1 ZINC001308694612 1127430764 /nfs/dbraw/zinc/43/07/64/1127430764.db2.gz LNARPPULAITYHB-LBPRGKRZSA-N 1 0 282.378 3.653 20 10 CHCDRO C[C@@H]([NH2+]C1CC(C)C1)c1ccc2ccccc2c1O ZINC000168838560 1127472072 /nfs/dbraw/zinc/47/20/72/1127472072.db2.gz XXTVFKYGNPIUSH-MBHSVXNSSA-N 1 0 255.361 3.995 20 10 CHCDRO CS[C@@H](C)C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000168851896 1127472922 /nfs/dbraw/zinc/47/29/22/1127472922.db2.gz OEOPWUYMNOBXQQ-NWDGAFQWSA-N 1 0 275.417 3.948 20 10 CHCDRO CCc1noc(C)c1C[NH2+]Cc1cc(Cl)cc(C)c1O ZINC000293547298 1127504845 /nfs/dbraw/zinc/50/48/45/1127504845.db2.gz DMXGASAWXGQOOJ-UHFFFAOYSA-N 1 0 294.782 3.503 20 10 CHCDRO Cc1cccc(C[N@@H+]2CC(C)(C)[C@H]2c2ccncc2)c1O ZINC000294050997 1127545370 /nfs/dbraw/zinc/54/53/70/1127545370.db2.gz WZMBGAKWXKMAHF-QGZVFWFLSA-N 1 0 282.387 3.679 20 10 CHCDRO Oc1ccccc1[C@H](CCc1ccccc1)[NH2+]CCF ZINC000294122212 1127551042 /nfs/dbraw/zinc/55/10/42/1127551042.db2.gz KUMVCVSNPPQRKI-INIZCTEOSA-N 1 0 273.351 3.625 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CCC[C@@H]2C(C)C)c1O ZINC000228606806 1127572152 /nfs/dbraw/zinc/57/21/52/1127572152.db2.gz XVRBCTIZXDRJQT-CYBMUJFWSA-N 1 0 283.799 3.675 20 10 CHCDRO COc1cc(O)c(C[NH2+][C@H](C)CCC=C(C)C)cc1OC ZINC000295101490 1127620596 /nfs/dbraw/zinc/62/05/96/1127620596.db2.gz SWHHWJBCVXGWRU-CYBMUJFWSA-N 1 0 293.407 3.634 20 10 CHCDRO C[C@H](CC[NH2+]Cc1ccccc1O)c1ccccc1 ZINC000060942210 1127625020 /nfs/dbraw/zinc/62/50/20/1127625020.db2.gz NVECVHVHNCFRMD-CQSZACIVSA-N 1 0 255.361 3.676 20 10 CHCDRO CC[C@H]1CC[C@@H](C)[N@@H+]1Cc1cc(Cl)cc(OC)c1O ZINC000229121195 1127650619 /nfs/dbraw/zinc/65/06/19/1127650619.db2.gz WEZAQJGVAMVYNT-MFKMUULPSA-N 1 0 283.799 3.817 20 10 CHCDRO COc1cc(O)c(C[N@H+]2C[C@H](C)C[C@H](C)C2)cc1Cl ZINC001232267443 1127653888 /nfs/dbraw/zinc/65/38/88/1127653888.db2.gz BXPNENKLGCLAPQ-PHIMTYICSA-N 1 0 283.799 3.532 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]C[C@@H]1[C@@H]3Cc4ccccc4[C@H]13)CC2 ZINC000297115481 1127688510 /nfs/dbraw/zinc/68/85/10/1127688510.db2.gz YHDNPPKCEXWFHU-XLSPSMHOSA-N 1 0 291.394 3.555 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1[C@H]2CCCO[C@@H]2C1(C)C)c1ccccc1O ZINC000364363106 1127697974 /nfs/dbraw/zinc/69/79/74/1127697974.db2.gz NFNXGWYUKADYFJ-WTTBNOFXSA-N 1 0 289.419 3.637 20 10 CHCDRO CCc1nc([C@H](C)[NH2+][C@H]2CCc3cccc(O)c32)cs1 ZINC000297685638 1127704077 /nfs/dbraw/zinc/70/40/77/1127704077.db2.gz LRZHDEFSDRJAPV-JQWIXIFHSA-N 1 0 288.416 3.749 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CC[C@@H](C)C1)c1cc(F)ccc1O ZINC000230413080 1127752386 /nfs/dbraw/zinc/75/23/86/1127752386.db2.gz WCRLUSGGDHFJDC-WOPDTQHZSA-N 1 0 251.345 3.618 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)C1CC1 ZINC000323921087 1127892960 /nfs/dbraw/zinc/89/29/60/1127892960.db2.gz VDFCRKKUAPJONA-KRWDZBQOSA-N 1 0 258.409 3.565 20 10 CHCDRO C[C@]1(F)CCCN(Cc2cccc(C(F)(F)F)c2O)C1 ZINC001233415955 1127960559 /nfs/dbraw/zinc/96/05/59/1127960559.db2.gz PXGWKIDWWCVCLK-ZDUSSCGKSA-N 1 0 291.288 3.735 20 10 CHCDRO CC[C@H](COC)[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000152853666 1128153700 /nfs/dbraw/zinc/15/37/00/1128153700.db2.gz CXXDZBMOECMHOQ-NVXWUHKLSA-N 1 0 290.451 3.753 20 10 CHCDRO Cc1cccc(C[NH2+][C@H](C)Cc2cccc(F)c2)c1O ZINC001168464880 1128166225 /nfs/dbraw/zinc/16/62/25/1128166225.db2.gz LZQCBEIZTBYRDX-CYBMUJFWSA-N 1 0 273.351 3.561 20 10 CHCDRO CCC[N@H+](CCC(=O)c1ccccc1)Cc1ccccc1O ZINC000777594353 1128167435 /nfs/dbraw/zinc/16/74/35/1128167435.db2.gz NMPZEHWOCVFKQL-UHFFFAOYSA-N 1 0 297.398 3.877 20 10 CHCDRO C[C@@H]1CCC[C@@H]([N@H+](C)Cc2cc3c(cc2O)CCC3)C1 ZINC000914785174 1128244531 /nfs/dbraw/zinc/24/45/31/1128244531.db2.gz RIUPUGBZQJNYNI-CXAGYDPISA-N 1 0 273.420 3.891 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCCc2cccnc21)c1ccc(N(C)C)cc1 ZINC000927056760 1128212225 /nfs/dbraw/zinc/21/22/25/1128212225.db2.gz WZXVEDDHPSITEE-RDTXWAMCSA-N 1 0 295.430 3.876 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCCc3cccnc32)c1 ZINC000927060400 1128212567 /nfs/dbraw/zinc/21/25/67/1128212567.db2.gz BHNSGIAKJTWARP-MLGOLLRUSA-N 1 0 298.386 3.524 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CC(C)(C)OC2(C)C)c(O)c1 ZINC000927101532 1128217592 /nfs/dbraw/zinc/21/75/92/1128217592.db2.gz NSYKZECQUGWPRC-UONOGXRCSA-N 1 0 291.435 3.945 20 10 CHCDRO c1cc2c(cc1C[NH2+][C@@H]1C[C@@H]3CCCC[C@H]13)CCCO2 ZINC001203503967 1128229335 /nfs/dbraw/zinc/22/93/35/1128229335.db2.gz LSJABQKLDSLSKJ-BHYGNILZSA-N 1 0 271.404 3.680 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2CC3(CCC3)C[C@@H]2C)cc1C ZINC000762146155 1128273258 /nfs/dbraw/zinc/27/32/58/1128273258.db2.gz VEWVNZQSFPLMIL-AWEZNQCLSA-N 1 0 259.393 3.774 20 10 CHCDRO CCC(CC)[C@@H](C[NH2+][C@@H](C)c1cc(C)ccc1O)N(C)C ZINC000035628955 1128319927 /nfs/dbraw/zinc/31/99/27/1128319927.db2.gz VIJYXFMHAURGDO-WMLDXEAASA-N 1 0 292.467 3.718 20 10 CHCDRO C[C@@H]1CCC[N@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C1 ZINC000915790580 1128338236 /nfs/dbraw/zinc/33/82/36/1128338236.db2.gz WCLQOXGISXLBSS-GFCCVEGCSA-N 1 0 277.408 3.627 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C[C@@H]1F ZINC000777967750 1128352651 /nfs/dbraw/zinc/35/26/51/1128352651.db2.gz ZAMAMLSNMCDXTO-RISCZKNCSA-N 1 0 295.398 3.575 20 10 CHCDRO CCN(C)c1ccc(C[NH+]2CCC(c3ncco3)CC2)cc1 ZINC000931444999 1128361887 /nfs/dbraw/zinc/36/18/87/1128361887.db2.gz XBGJEVXYOWMYOA-UHFFFAOYSA-N 1 0 299.418 3.510 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H](CO)CC2CCCC2)c1 ZINC000798936804 1128391699 /nfs/dbraw/zinc/39/16/99/1128391699.db2.gz GTAIEDFXGOSPTG-GOEBONIOSA-N 1 0 291.435 3.540 20 10 CHCDRO CCN(C)c1ccc(C[NH2+][C@H](c2ccccn2)C2CC2)cc1 ZINC000932382596 1128406122 /nfs/dbraw/zinc/40/61/22/1128406122.db2.gz AHRIIGOEZDCJEI-IBGZPJMESA-N 1 0 295.430 3.779 20 10 CHCDRO CCC[C@@H](C)CC[C@H](C)[NH2+]Cc1ccc(O)cc1O ZINC001257467232 1128456941 /nfs/dbraw/zinc/45/69/41/1128456941.db2.gz HQHTZRYEEZRHAS-OLZOCXBDSA-N 1 0 265.397 3.792 20 10 CHCDRO Oc1cc2c(cc1C[N@@H+]1CC[C@H]1c1ccccc1)CCC2 ZINC000917446487 1128500042 /nfs/dbraw/zinc/50/00/42/1128500042.db2.gz VHZDCZMWPSWSPU-SFHVURJKSA-N 1 0 279.383 3.828 20 10 CHCDRO C[C@H]([NH2+]C[C@]1(N(C)C)CCC[C@@H](C)C1)c1ccccc1O ZINC000040668282 1128527113 /nfs/dbraw/zinc/52/71/13/1128527113.db2.gz ZTCUJHPARCIRBN-VKJFTORMSA-N 1 0 290.451 3.553 20 10 CHCDRO CC[C@H]([NH2+]CCc1sc(C)nc1C)c1ccccc1O ZINC000155752613 1128613835 /nfs/dbraw/zinc/61/38/35/1128613835.db2.gz QDVUYIXFUQEULN-AWEZNQCLSA-N 1 0 290.432 3.749 20 10 CHCDRO Cc1cccc(C[N@@H+]2CC[C@@H](c3ccccc3)C2)c1O ZINC000158027548 1128663383 /nfs/dbraw/zinc/66/33/83/1128663383.db2.gz BLTMXCTTXHQDQU-MRXNPFEDSA-N 1 0 267.372 3.690 20 10 CHCDRO COc1ccc(C[NH2+]CCOc2cc(C)cc(C)c2)cc1C ZINC000920181490 1128670047 /nfs/dbraw/zinc/67/00/47/1128670047.db2.gz PLXWWWSWNYAYHU-UHFFFAOYSA-N 1 0 299.414 3.789 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2ccccc2O)Cc2ccccc21 ZINC000778995442 1128674469 /nfs/dbraw/zinc/67/44/69/1128674469.db2.gz RSTWTODCVHHRPT-CYBMUJFWSA-N 1 0 253.345 3.512 20 10 CHCDRO CC[N@H+](CCc1ccccc1)Cc1cc(F)ccc1O ZINC000778996987 1128675603 /nfs/dbraw/zinc/67/56/03/1128675603.db2.gz YIHRTJGCDFPEFP-UHFFFAOYSA-N 1 0 273.351 3.596 20 10 CHCDRO Cc1ccccc1C[N@H+](Cc1ccccc1O)C1CC1 ZINC000778996435 1128675793 /nfs/dbraw/zinc/67/57/93/1128675793.db2.gz OMRASWCSAAMHLK-UHFFFAOYSA-N 1 0 267.372 3.865 20 10 CHCDRO Oc1ccccc1C[NH+]1CCC(c2cccc(F)c2)CC1 ZINC000779014483 1128678878 /nfs/dbraw/zinc/67/88/78/1128678878.db2.gz KOUFRFGSNFLASY-UHFFFAOYSA-N 1 0 285.362 3.911 20 10 CHCDRO Cc1cc(Br)cc([C@@H](C)[NH2+]CC2(C)CC2)c1O ZINC000779035727 1128696168 /nfs/dbraw/zinc/69/61/68/1128696168.db2.gz GKTJZZPWAGCQOD-SNVBAGLBSA-N 1 0 298.224 3.914 20 10 CHCDRO C[C@@H]1CCC[C@@H](C)C1[NH2+]Cc1ccc2c(c1)CCO2 ZINC000921066029 1128699343 /nfs/dbraw/zinc/69/93/43/1128699343.db2.gz HLYIJSULDGNYDK-CHWSQXEVSA-N 1 0 259.393 3.536 20 10 CHCDRO COc1ccc([C@@H]([NH2+]Cc2ccccc2O)C2CC2)cc1 ZINC000134225783 1128706265 /nfs/dbraw/zinc/70/62/65/1128706265.db2.gz YDMCFWNBUQBXFE-SFHVURJKSA-N 1 0 283.371 3.642 20 10 CHCDRO CCOC[C@H](C)[NH2+][C@H](CC)c1cc(Cl)ccc1O ZINC000779073528 1128719236 /nfs/dbraw/zinc/71/92/36/1128719236.db2.gz OONDIPVSRGWBEX-GXFFZTMASA-N 1 0 271.788 3.511 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+]C[C@H]2CCC(C)(C)O2)c2c1c(F)ccc2O ZINC000779078461 1128721996 /nfs/dbraw/zinc/72/19/96/1128721996.db2.gz GHNFBFVAPXSAAX-WZRBSPASSA-N 1 0 293.382 3.627 20 10 CHCDRO C[C@@H]([NH2+]CCc1c(F)cccc1F)c1cc(F)ccc1O ZINC000185067905 1117759238 /nfs/dbraw/zinc/75/92/38/1117759238.db2.gz XIWXFXQVQFECKJ-SNVBAGLBSA-N 1 0 295.304 3.703 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCCNc2ccccc2)c1 ZINC000185489367 1117828037 /nfs/dbraw/zinc/82/80/37/1117828037.db2.gz BAOZHJPXJRQLTA-HNNXBMFYSA-N 1 0 284.403 3.853 20 10 CHCDRO CCO[C@H](CC[NH2+][C@@H](C)c1cc(C)ccc1O)C(C)C ZINC000185625372 1117859909 /nfs/dbraw/zinc/85/99/09/1117859909.db2.gz HUDZKSGRNGRCIO-WMLDXEAASA-N 1 0 279.424 3.802 20 10 CHCDRO CO[C@@H](C[NH2+][C@H](C)c1ccc(C)cc1O)C1CCCC1 ZINC000692981380 1117959174 /nfs/dbraw/zinc/95/91/74/1117959174.db2.gz UWAGZFCHNLELHQ-DYVFJYSZSA-N 1 0 277.408 3.556 20 10 CHCDRO CCCCCC[C@H](C)[NH2+]Cc1cc(OC)ccc1O ZINC000037138577 1117968611 /nfs/dbraw/zinc/96/86/11/1117968611.db2.gz DYGJGWIIHFKBNA-ZDUSSCGKSA-N 1 0 265.397 3.849 20 10 CHCDRO Cc1cccc(C[N@@H+](C)[C@@H](C)c2ccccc2)c1O ZINC000179596669 1128748555 /nfs/dbraw/zinc/74/85/55/1128748555.db2.gz FSDHSAJBDUMLGY-AWEZNQCLSA-N 1 0 255.361 3.894 20 10 CHCDRO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1ccccc1O ZINC000179568938 1128748688 /nfs/dbraw/zinc/74/86/88/1128748688.db2.gz QVGPOCOVRNFJMT-INIZCTEOSA-N 1 0 283.371 3.738 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000128768775 1118024982 /nfs/dbraw/zinc/02/49/82/1118024982.db2.gz ZKZCMEIJCGVXTA-HUUCEWRRSA-N 1 0 290.451 3.578 20 10 CHCDRO C[C@@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)CC1 ZINC000211517717 1118069654 /nfs/dbraw/zinc/06/96/54/1118069654.db2.gz NKLVXSIRSZVNIU-LLVKDONJSA-N 1 0 253.773 3.668 20 10 CHCDRO COc1ccc([C@H](C)[N@H+](C)Cc2cccc(C)c2O)cc1 ZINC000179664438 1128753861 /nfs/dbraw/zinc/75/38/61/1128753861.db2.gz JXJIDMODUSWZAU-AWEZNQCLSA-N 1 0 285.387 3.902 20 10 CHCDRO C[C@@H]([NH2+]CCOC(F)(F)F)c1ccc2ccccc2c1O ZINC000398216732 1118100442 /nfs/dbraw/zinc/10/04/42/1118100442.db2.gz LUZXLUIBZNHAFA-SNVBAGLBSA-N 1 0 299.292 3.732 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2CS[C@@H](C(C)(C)C)C2)cc1 ZINC000754129435 1118108768 /nfs/dbraw/zinc/10/87/68/1118108768.db2.gz QCXOXWSHJCXNBN-GOEBONIOSA-N 1 0 292.492 3.762 20 10 CHCDRO CCC[N@H+](CCCc1ccncc1)Cc1ccccc1O ZINC000764960197 1118128132 /nfs/dbraw/zinc/12/81/32/1118128132.db2.gz LFEFGDSPCPOWFP-UHFFFAOYSA-N 1 0 284.403 3.632 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1C[C@@H]1C)c1ccc(N2CCCCC2)cc1 ZINC000765336882 1118145163 /nfs/dbraw/zinc/14/51/63/1118145163.db2.gz LIUZHOPNLNGLOI-ZOBUZTSGSA-N 1 0 272.436 3.984 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H](C)C2CC2)cc1 ZINC000765391390 1118147412 /nfs/dbraw/zinc/14/74/12/1118147412.db2.gz DXPADKYABKGDFH-KGLIPLIRSA-N 1 0 260.425 3.839 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccoc2C)cc1 ZINC000765398291 1118149135 /nfs/dbraw/zinc/14/91/35/1118149135.db2.gz YOJHGPOVRKKRPP-CYBMUJFWSA-N 1 0 272.392 3.895 20 10 CHCDRO CC[C@@H]([NH2+]CCN(C)[C@@H](C)CC)c1ccc(N(C)C)cc1 ZINC000765657140 1118188008 /nfs/dbraw/zinc/18/80/08/1118188008.db2.gz VVBXLNISASITFZ-MAUKXSAKSA-N 1 0 291.483 3.524 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]CC2(C3CC3)CCC2)c1 ZINC000186156557 1118198587 /nfs/dbraw/zinc/19/85/87/1118198587.db2.gz BVWYJPGJADDKDY-GFCCVEGCSA-N 1 0 275.392 3.632 20 10 CHCDRO COc1cnccc1[C@@H](C)[NH2+][C@H](C)c1ccc(C)cc1O ZINC000188797734 1128765460 /nfs/dbraw/zinc/76/54/60/1128765460.db2.gz DWIITAXKAZDMQU-CHWSQXEVSA-N 1 0 286.375 3.516 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CC[C@@H]3CCC[C@@H]3C2)c1O ZINC001140181947 1118246642 /nfs/dbraw/zinc/24/66/42/1118246642.db2.gz XXUSRHARAXGKIM-LSDHHAIUSA-N 1 0 259.393 3.631 20 10 CHCDRO Oc1ccc2ccccc2c1C[NH+]1C[C@@H]2CCC[C@H]2C1 ZINC000147937693 1118255345 /nfs/dbraw/zinc/25/53/45/1118255345.db2.gz HIKMRWYGWQHMHI-GJZGRUSLSA-N 1 0 267.372 3.777 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CC[C@@H](c2ccccc2)C1 ZINC000179934858 1128767429 /nfs/dbraw/zinc/76/74/29/1128767429.db2.gz BPMFOJMTGPBLPA-CQSZACIVSA-N 1 0 271.335 3.521 20 10 CHCDRO COc1ccc([C@@H]2CC[N@H+](Cc3cccc(C)c3O)C2)cc1 ZINC000179955155 1128769133 /nfs/dbraw/zinc/76/91/33/1128769133.db2.gz FFHPLQQEPSKFCA-MRXNPFEDSA-N 1 0 297.398 3.699 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]CCCOC1CCCCC1 ZINC000083551587 1118356519 /nfs/dbraw/zinc/35/65/19/1118356519.db2.gz GPHKMQREQGLQSF-UHFFFAOYSA-N 1 0 297.826 3.875 20 10 CHCDRO C[C@H]1CCCCC[C@@H]1[NH2+]Cc1ccc2c(c1)CCO2 ZINC000088509478 1118521231 /nfs/dbraw/zinc/52/12/31/1118521231.db2.gz RZOITFGSWPXROZ-BBRMVZONSA-N 1 0 259.393 3.680 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CC[C@@H](C)C[C@H]2C)c1O ZINC000252854015 1118550316 /nfs/dbraw/zinc/55/03/16/1118550316.db2.gz KPFGFBCITUUHPG-GHMZBOCLSA-N 1 0 283.799 3.675 20 10 CHCDRO CS[C@@H]1CCC[C@H]([NH2+][C@H](C)c2cc(F)ccc2O)C1 ZINC000248522198 1118569553 /nfs/dbraw/zinc/56/95/53/1118569553.db2.gz RWLOIORZDBHVMN-KGYLQXTDSA-N 1 0 283.412 3.856 20 10 CHCDRO C[N@H+](Cc1c(O)cccc1Cl)CC1(O)CCCCCC1 ZINC000779204463 1128787241 /nfs/dbraw/zinc/78/72/41/1128787241.db2.gz SSCDIWBMHIEQJL-UHFFFAOYSA-N 1 0 297.826 3.563 20 10 CHCDRO COc1ccc(C[NH2+]C[C@@H]2CCCC[C@@H]2C)cc1C ZINC000109935539 1118590494 /nfs/dbraw/zinc/59/04/94/1118590494.db2.gz OELUBJZLZVIXLZ-BBRMVZONSA-N 1 0 261.409 3.920 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)[C@@H](OC)C1CC1)c1cc(Cl)ccc1O ZINC000834901876 1118621608 /nfs/dbraw/zinc/62/16/08/1118621608.db2.gz AGKXPCDEXUYZRW-FUEDEBDSSA-N 1 0 297.826 3.900 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)[C@@H](OC)C1CC1)c1ccc(N(C)C)cc1 ZINC000834904930 1118623267 /nfs/dbraw/zinc/62/32/67/1118623267.db2.gz QZXXHRZHPKDHIA-JEBQAFNWSA-N 1 0 290.451 3.607 20 10 CHCDRO COc1ccc(C[NH2+]CC2CCC(C)CC2)cc1C ZINC000109962585 1118626826 /nfs/dbraw/zinc/62/68/26/1118626826.db2.gz PDRGGAHBAMDECR-UHFFFAOYSA-N 1 0 261.409 3.920 20 10 CHCDRO CCO[C@@H]1CCCC[C@H]1[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000834911179 1118629346 /nfs/dbraw/zinc/62/93/46/1118629346.db2.gz HLFSKEJNNXDOCO-ZTFGCOKTSA-N 1 0 290.451 3.751 20 10 CHCDRO C[C@@H]1CCCC[N@@H+]1Cc1c(O)cccc1Br ZINC000707135419 1118641558 /nfs/dbraw/zinc/64/15/58/1118641558.db2.gz SITMCVRUCZPDMH-SNVBAGLBSA-N 1 0 284.197 3.529 20 10 CHCDRO CC[C@H]1CC[C@H](C)[N@@H+]1Cc1c(O)cccc1Br ZINC000707138800 1118642628 /nfs/dbraw/zinc/64/26/28/1118642628.db2.gz HODGWVMYVMZYHB-QWRGUYRKSA-N 1 0 298.224 3.918 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2c(O)cccc2Br)[C@@H](C)[C@H]1C ZINC000707138843 1118643728 /nfs/dbraw/zinc/64/37/28/1118643728.db2.gz IDDACCIGBWYJTL-VWYCJHECSA-N 1 0 298.224 3.631 20 10 CHCDRO C[C@H]1CCC[N@H+](Cc2c(O)cccc2Br)[C@H]1C ZINC000707147316 1118648452 /nfs/dbraw/zinc/64/84/52/1118648452.db2.gz YHBHIUDHHFLRGD-QWRGUYRKSA-N 1 0 298.224 3.775 20 10 CHCDRO C[C@@H]1CCC[N@H+](Cc2c(O)cccc2Br)CC1 ZINC000707153051 1118650748 /nfs/dbraw/zinc/65/07/48/1118650748.db2.gz SZJUFIGYKWLYLM-LLVKDONJSA-N 1 0 298.224 3.777 20 10 CHCDRO Cc1csc(C[NH2+][C@@H](C)c2ccc(C)cc2O)c1 ZINC000382259699 1118653415 /nfs/dbraw/zinc/65/34/15/1118653415.db2.gz GYCNCYGUYDNITP-LBPRGKRZSA-N 1 0 261.390 3.921 20 10 CHCDRO C[C@@]1(F)CCC[N@H+](Cc2ccc(Cl)cc2O)CC1 ZINC001140461922 1118720491 /nfs/dbraw/zinc/72/04/91/1118720491.db2.gz YJPYOBZMHJIMLO-CQSZACIVSA-N 1 0 271.763 3.760 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+][C@@H]2CC[C@H](C)[C@H](C)C2)c1O ZINC000252873735 1118848138 /nfs/dbraw/zinc/84/81/38/1118848138.db2.gz VQVWJFITFULGKA-MISXGVKJSA-N 1 0 297.826 3.969 20 10 CHCDRO C[N@H+](Cc1ccccc1O)Cc1cc(Cl)ccc1F ZINC000091974508 1118952806 /nfs/dbraw/zinc/95/28/06/1118952806.db2.gz ZDSULDSEXDANEN-UHFFFAOYSA-N 1 0 279.742 3.817 20 10 CHCDRO CCC[N@H+](Cc1ccccc1O)[C@H](C)c1cccnc1 ZINC000076074097 1119182572 /nfs/dbraw/zinc/18/25/72/1119182572.db2.gz MNLFLESVBWUFOP-CQSZACIVSA-N 1 0 270.376 3.760 20 10 CHCDRO C[C@@H](O)C[C@H](C)C[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000077428679 1119195035 /nfs/dbraw/zinc/19/50/35/1119195035.db2.gz UGNCYYJWUPFHHA-LSDHHAIUSA-N 1 0 299.414 3.556 20 10 CHCDRO COC[C@H](C)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000178667371 1119221342 /nfs/dbraw/zinc/22/13/42/1119221342.db2.gz PLKSSKYCOQITIU-CVEARBPZSA-N 1 0 290.451 3.610 20 10 CHCDRO C[C@@H]([NH2+]Cc1cc(F)ccc1O)C1CCCCC1 ZINC000226611325 1119224338 /nfs/dbraw/zinc/22/43/38/1119224338.db2.gz OSBAWYCLJGASBU-LLVKDONJSA-N 1 0 251.345 3.590 20 10 CHCDRO CC1(C[NH2+]Cc2cc(Br)ccc2O)CCCC1 ZINC000224747133 1119226070 /nfs/dbraw/zinc/22/60/70/1119226070.db2.gz JCRKBGYLZNNRCS-UHFFFAOYSA-N 1 0 298.224 3.825 20 10 CHCDRO COCCC1(C[NH2+][C@H](C)c2cc(Cl)ccc2O)CCC1 ZINC000185752550 1119276488 /nfs/dbraw/zinc/27/64/88/1119276488.db2.gz KNVFKTINORDPBV-GFCCVEGCSA-N 1 0 297.826 3.903 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CCc2ccc(C)nc2)cc1 ZINC000161557688 1119302234 /nfs/dbraw/zinc/30/22/34/1119302234.db2.gz ORNXSOPBBOYSCW-INIZCTEOSA-N 1 0 297.446 3.739 20 10 CHCDRO CC[C@@H]([NH2+]CCC1SCCS1)c1ccccc1O ZINC000693778086 1119333160 /nfs/dbraw/zinc/33/31/60/1119333160.db2.gz VDWXPGGXPZNMNX-GFCCVEGCSA-N 1 0 283.462 3.629 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]C1CCSCC1 ZINC000168831663 1119480986 /nfs/dbraw/zinc/48/09/86/1119480986.db2.gz AUTWYWRTZXJOPR-DGCLKSJQSA-N 1 0 277.433 3.734 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]CCCc1ccccc1)CC2 ZINC000383379744 1119610158 /nfs/dbraw/zinc/61/01/58/1119610158.db2.gz MKNBDHIJKWYFHQ-MRXNPFEDSA-N 1 0 267.372 3.602 20 10 CHCDRO CCc1ccc(C[NH2+]Cc2ccc(N(C)C)cc2)s1 ZINC000051717333 1119648561 /nfs/dbraw/zinc/64/85/61/1119648561.db2.gz UURCOTSDVROHOQ-UHFFFAOYSA-N 1 0 274.433 3.666 20 10 CHCDRO CC[C@@H](Cc1ccccc1)[NH2+]Cc1cccc(OC)c1O ZINC000075944374 1128866515 /nfs/dbraw/zinc/86/65/15/1128866515.db2.gz AWJLMRHGCJWXMN-INIZCTEOSA-N 1 0 285.387 3.512 20 10 CHCDRO CCc1ccc(C(C)(C)[NH2+]Cc2ccccc2O)cc1 ZINC000177598088 1119830429 /nfs/dbraw/zinc/83/04/29/1119830429.db2.gz VBSPSWJBQIBFJV-UHFFFAOYSA-N 1 0 269.388 3.980 20 10 CHCDRO C[C@H]([NH2+]Cc1cc(F)cc(F)c1)c1ccc(N(C)C)cc1 ZINC000177719179 1119848418 /nfs/dbraw/zinc/84/84/18/1119848418.db2.gz OWUKVQMPJKNVBR-LBPRGKRZSA-N 1 0 290.357 3.882 20 10 CHCDRO C[C@@H]([NH2+]Cc1cc(F)cc(F)c1)c1ccc(N(C)C)cc1 ZINC000177719192 1119848644 /nfs/dbraw/zinc/84/86/44/1119848644.db2.gz OWUKVQMPJKNVBR-GFCCVEGCSA-N 1 0 290.357 3.882 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCc2cccc(O)c21)c1ccsc1 ZINC000310771714 1119949182 /nfs/dbraw/zinc/94/91/82/1119949182.db2.gz CVJHYRVYXMIEMG-GWCFXTLKSA-N 1 0 259.374 3.792 20 10 CHCDRO CN(C)c1ccc(C[NH2+]Cc2ccc(F)c(Cl)c2)cc1 ZINC000053155632 1120014766 /nfs/dbraw/zinc/01/47/66/1120014766.db2.gz ATNFUNJXNQBIIK-UHFFFAOYSA-N 1 0 292.785 3.835 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@H](C)CC2CCCCC2)c1 ZINC000694674882 1120014824 /nfs/dbraw/zinc/01/48/24/1120014824.db2.gz MQQPTXBGIUADLY-CYBMUJFWSA-N 1 0 277.408 3.849 20 10 CHCDRO CCCN(CCC)c1ccc(C[NH2+][C@H](C)C[C@@H](C)O)cc1 ZINC000782977985 1120104032 /nfs/dbraw/zinc/10/40/32/1120104032.db2.gz HUOUWKJEPQIVFM-HZPDHXFCSA-N 1 0 292.467 3.562 20 10 CHCDRO CC[C@@H]([NH2+]CC(C)(C)SC)c1ccccc1O ZINC000169215377 1120104855 /nfs/dbraw/zinc/10/48/55/1120104855.db2.gz YUZNNUBNEXHZEG-GFCCVEGCSA-N 1 0 253.411 3.575 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@@H]1CCCC(F)(F)C1)CC2 ZINC000695117521 1120109550 /nfs/dbraw/zinc/10/95/50/1120109550.db2.gz ANERKMCNSUYCJC-VXGBXAGGSA-N 1 0 267.319 3.547 20 10 CHCDRO COc1ccc(C[NH2+]Cc2cc(F)ccc2F)cc1C ZINC000111233232 1120141495 /nfs/dbraw/zinc/14/14/95/1120141495.db2.gz WBYJQFADHPOERB-UHFFFAOYSA-N 1 0 277.314 3.572 20 10 CHCDRO C[C@@H]([NH2+]CC=C(Cl)Cl)c1ccc(N(C)C)cc1 ZINC000407400046 1120153997 /nfs/dbraw/zinc/15/39/97/1120153997.db2.gz IPKJXSBSRFPTJL-SNVBAGLBSA-N 1 0 273.207 3.722 20 10 CHCDRO COc1ccc(C[N@@H+]2CCC[C@H]2C(C)C)c([O-])c1Cl ZINC001236805669 1128895427 /nfs/dbraw/zinc/89/54/27/1128895427.db2.gz DPRUHSXTBLWUSM-LBPRGKRZSA-N 1 0 283.799 3.675 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCOC1(C)C)c1ccc2ccccc2c1O ZINC000328416163 1120175442 /nfs/dbraw/zinc/17/54/42/1120175442.db2.gz IKSCIWPHERUZHG-MLGOLLRUSA-N 1 0 285.387 3.764 20 10 CHCDRO CC[C@@H]([NH2+]CCCOC(C)(C)C)c1ccccc1O ZINC000695278308 1120183278 /nfs/dbraw/zinc/18/32/78/1120183278.db2.gz CXLDRARZEZVUSV-CQSZACIVSA-N 1 0 265.397 3.638 20 10 CHCDRO Cc1cc(C[NH2+]Cc2cccnc2)c(C)n1-c1ccccc1 ZINC000314297279 1120183948 /nfs/dbraw/zinc/18/39/48/1120183948.db2.gz DIFKAUIZOFUOJF-UHFFFAOYSA-N 1 0 291.398 3.779 20 10 CHCDRO CC(=O)c1cc(F)cc(C[NH+]2CCC3(CCC3)CC2)c1O ZINC000308741741 1120196815 /nfs/dbraw/zinc/19/68/15/1120196815.db2.gz HIOJGOPGEYLTIW-UHFFFAOYSA-N 1 0 291.366 3.500 20 10 CHCDRO CC[C@@H](C)[C@](C)(O)C[NH2+][C@@H](CC)c1ccc(N(C)C)cc1 ZINC000765948068 1120251171 /nfs/dbraw/zinc/25/11/71/1120251171.db2.gz YYNMJNQNKMWUPJ-FHLIZLRMSA-N 1 0 292.467 3.590 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCN(C(C)C)C(C)C)c(O)c1C ZINC000756374109 1120276926 /nfs/dbraw/zinc/27/69/26/1120276926.db2.gz XXPSMGQDHDQHGD-INIZCTEOSA-N 1 0 292.467 3.778 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H](C)Cc2ccco2)c(O)c1C ZINC000756379206 1120283193 /nfs/dbraw/zinc/28/31/93/1120283193.db2.gz MEDFNSCYGYHPRX-OCCSQVGLSA-N 1 0 273.376 3.884 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCc2ccccc21)c1ccccc1O ZINC000182791024 1120328058 /nfs/dbraw/zinc/32/80/58/1120328058.db2.gz XZCCCKDIQWNOPN-UKRRQHHQSA-N 1 0 267.372 3.773 20 10 CHCDRO CC[C@@H]([NH2+]CC1(OC)CCCCC1)c1ccccc1O ZINC000186505246 1120342725 /nfs/dbraw/zinc/34/27/25/1120342725.db2.gz SCTRNBGTYNCOLP-OAHLLOKOSA-N 1 0 277.408 3.782 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCc2ccc3c(c2)CCO3)c(O)c1 ZINC000185451988 1120377257 /nfs/dbraw/zinc/37/72/57/1120377257.db2.gz BEOHRSANYQUZOW-AWEZNQCLSA-N 1 0 297.398 3.529 20 10 CHCDRO COc1cccc(C[NH2+]CCC2=CCCCCC2)c1O ZINC000185406076 1120377418 /nfs/dbraw/zinc/37/74/18/1120377418.db2.gz WDWQIYABDAYKFM-UHFFFAOYSA-N 1 0 275.392 3.771 20 10 CHCDRO CCCC(O)(CCC)C[NH2+][C@H](C)c1ccc(C)cc1O ZINC000185500825 1120378372 /nfs/dbraw/zinc/37/83/72/1120378372.db2.gz APPANDUSHDGXJO-CQSZACIVSA-N 1 0 279.424 3.683 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCc3cccc(C)c3C2)c1O ZINC000763502105 1128912846 /nfs/dbraw/zinc/91/28/46/1128912846.db2.gz HEODXUZIOUFJOH-UHFFFAOYSA-N 1 0 267.372 3.567 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CC(C)(C)OC2(C)C)c(O)c1 ZINC000186499951 1120399759 /nfs/dbraw/zinc/39/97/59/1120399759.db2.gz VRFHLJFEDKDPGI-DOMZBBRYSA-N 1 0 277.408 3.697 20 10 CHCDRO Cc1csc([C@H](C)C[NH2+][C@@H](C)c2ccc(C)cc2O)n1 ZINC000186573085 1120402513 /nfs/dbraw/zinc/40/25/13/1120402513.db2.gz OFDFHEKWTYTUJZ-YPMHNXCESA-N 1 0 290.432 3.920 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](C)Cc2ccc(N(C)C)cc2)cc1C ZINC000024980202 1120528678 /nfs/dbraw/zinc/52/86/78/1120528678.db2.gz YHRNBHMMIVSVSP-UHFFFAOYSA-N 1 0 298.430 3.707 20 10 CHCDRO CCN1CCCC[C@@H]1C[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000756565184 1120531884 /nfs/dbraw/zinc/53/18/84/1120531884.db2.gz WIJFHZXBQPGNHH-GXTWGEPZSA-N 1 0 296.842 3.571 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H](c2ccccn2)C2CC2)cc1F ZINC000922587004 1120558227 /nfs/dbraw/zinc/55/82/27/1120558227.db2.gz VGWROYYXIROZOS-GOSISDBHSA-N 1 0 299.393 3.528 20 10 CHCDRO CCO[C@@H](C[NH2+]Cc1cc(C)ccc1O)c1ccccc1 ZINC000194459307 1120600160 /nfs/dbraw/zinc/60/01/60/1120600160.db2.gz SGIQXEZSORNCGO-SFHVURJKSA-N 1 0 285.387 3.568 20 10 CHCDRO COc1ccc(C[NH2+][C@H]2CCSC3(CCC3)C2)cc1C ZINC000922841981 1120609794 /nfs/dbraw/zinc/60/97/94/1120609794.db2.gz HPFORMXUTZTHLC-HNNXBMFYSA-N 1 0 291.460 3.912 20 10 CHCDRO c1cnc2c(c1)CCC[C@H]2[NH2+]Cc1ccc2c(c1)CCCO2 ZINC000922878465 1120615910 /nfs/dbraw/zinc/61/59/10/1120615910.db2.gz WGBDJHFHAQHJKB-QGZVFWFLSA-N 1 0 294.398 3.574 20 10 CHCDRO CC(C)(C)CCC[NH2+]Cc1c(O)cccc1Cl ZINC000313295542 1120705982 /nfs/dbraw/zinc/70/59/82/1120705982.db2.gz KHWCKAMVFMDARF-UHFFFAOYSA-N 1 0 255.789 3.962 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[C@@H](C)C[C@H]2C)c1 ZINC000070111037 1128940491 /nfs/dbraw/zinc/94/04/91/1128940491.db2.gz TWJGSZZZYUUPCJ-NFFDBFGFSA-N 1 0 277.408 3.876 20 10 CHCDRO CSCC[C@H](C)[N@H+](C)Cc1cc(C)c(C)cc1O ZINC000093558707 1120822548 /nfs/dbraw/zinc/82/25/48/1120822548.db2.gz NAQMNWPJWLRFPB-ZDUSSCGKSA-N 1 0 267.438 3.582 20 10 CHCDRO CC(C)[C@@](C)(O)C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000185434167 1120911729 /nfs/dbraw/zinc/91/17/29/1120911729.db2.gz ZLSZNWIZNXLKCN-ACJLOTCBSA-N 1 0 287.403 3.603 20 10 CHCDRO Cc1cc(C[NH2+]C[C@H]2CCCOC2)c(C)n1-c1ccccc1 ZINC000314486947 1120955300 /nfs/dbraw/zinc/95/53/00/1120955300.db2.gz QKMFGOKONNKPSB-QGZVFWFLSA-N 1 0 298.430 3.610 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2C[C@H](c3ccccc3)[C@@H]2C)c(O)c1 ZINC000763517886 1128960508 /nfs/dbraw/zinc/96/05/08/1128960508.db2.gz JUBRULBOYPIDJX-DOPJRALCSA-N 1 0 297.398 3.683 20 10 CHCDRO CCC(F)(F)C(C)(C)C[NH2+]Cc1ccccc1O ZINC000700721230 1121117287 /nfs/dbraw/zinc/11/72/87/1121117287.db2.gz OGQMXJQJLKJGSA-UHFFFAOYSA-N 1 0 257.324 3.553 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cccc(F)c2F)c1 ZINC000182405565 1128965890 /nfs/dbraw/zinc/96/58/90/1128965890.db2.gz QHGHDGXKBVVYPT-JTQLQIEISA-N 1 0 293.313 3.530 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)C1CCC(C)CC1 ZINC000085070161 1121175044 /nfs/dbraw/zinc/17/50/44/1121175044.db2.gz WXQIXPCVWHKNMP-UHFFFAOYSA-N 1 0 260.425 3.940 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@H]1CCC[C@@H](C)O1 ZINC001203162005 1121227277 /nfs/dbraw/zinc/22/72/77/1121227277.db2.gz VBDIUTDTZFPIFL-UKRRQHHQSA-N 1 0 286.419 3.534 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]CCCOC(C)C ZINC000020198223 1121231730 /nfs/dbraw/zinc/23/17/30/1121231730.db2.gz IMSSTSORPFRVAI-ZIAGYGMSSA-N 1 0 277.408 3.654 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccccc2O)cc1F ZINC000094952449 1121247411 /nfs/dbraw/zinc/24/74/11/1121247411.db2.gz YQTGINFGIAGPTQ-GFCCVEGCSA-N 1 0 259.324 3.691 20 10 CHCDRO C[C@H]1CSCC[N@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000192180406 1128974278 /nfs/dbraw/zinc/97/42/78/1128974278.db2.gz LUKWZUZNSUDZMF-CYBMUJFWSA-N 1 0 287.428 3.730 20 10 CHCDRO C[C@@H](C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F)C1CC1 ZINC000756483701 1121300209 /nfs/dbraw/zinc/30/02/09/1121300209.db2.gz VJVUJXODGHUSDO-NRUUGDAUSA-N 1 0 263.356 3.715 20 10 CHCDRO CCc1cc(C[NH2+][C@@H](CC)c2ccc(N(C)C)cc2)on1 ZINC000766133930 1121302838 /nfs/dbraw/zinc/30/28/38/1121302838.db2.gz FNWGHVPGRNKICW-KRWDZBQOSA-N 1 0 287.407 3.544 20 10 CHCDRO C[C@H]([NH2+]CCC1(F)CCC1)c1ccc(N(C)C)cc1 ZINC000705230144 1121393566 /nfs/dbraw/zinc/39/35/66/1121393566.db2.gz PKGIYHURQRYBFL-ZDUSSCGKSA-N 1 0 264.388 3.686 20 10 CHCDRO CC(=O)c1cc(Cl)cc(C[NH+]2[C@H](C)CC[C@H]2C)c1O ZINC000706475359 1121431062 /nfs/dbraw/zinc/43/10/62/1121431062.db2.gz HHDJBBQZQLSHFI-NXEZZACHSA-N 1 0 281.783 3.621 20 10 CHCDRO CC1(C2([NH2+]Cc3c(O)cccc3Br)CC2)CC1 ZINC000706883630 1121443979 /nfs/dbraw/zinc/44/39/79/1121443979.db2.gz RUHYNPDBYORYPN-UHFFFAOYSA-N 1 0 296.208 3.577 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCC[C@H]1C1CCCCC1 ZINC000708485197 1121468543 /nfs/dbraw/zinc/46/85/43/1121468543.db2.gz JDPQWOXHOPUFNO-INIZCTEOSA-N 1 0 259.393 3.937 20 10 CHCDRO CCc1cccc(C[NH2+][C@H]2CCCc3occc32)c1O ZINC000709455293 1121470525 /nfs/dbraw/zinc/47/05/25/1121470525.db2.gz NTNBVANDXGWRON-HNNXBMFYSA-N 1 0 271.360 3.715 20 10 CHCDRO C[C@@H]([NH2+]C1CCC(F)(F)CC1)c1ccccc1O ZINC000688455738 1128987862 /nfs/dbraw/zinc/98/78/62/1128987862.db2.gz MPHLIJRSWZVVMP-SNVBAGLBSA-N 1 0 255.308 3.621 20 10 CHCDRO Nc1ccc(CCc2ccc(Nc3[nH]cc[nH+]3)cc2)cc1 ZINC001176085146 1121535109 /nfs/dbraw/zinc/53/51/09/1121535109.db2.gz XHFBOYBGEKIVFH-UHFFFAOYSA-N 1 0 278.359 3.521 20 10 CHCDRO Cc1cc(Nc2cc(C(F)(F)F)ccc2O)cc(C)[nH+]1 ZINC001176056995 1121543578 /nfs/dbraw/zinc/54/35/78/1121543578.db2.gz JAUIMYPBLARPQI-UHFFFAOYSA-N 1 0 282.265 3.588 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)c1cc(F)ccc1O ZINC000248491391 1121571381 /nfs/dbraw/zinc/57/13/81/1121571381.db2.gz IQELHKGMOMHQTA-JDFRZJQESA-N 1 0 285.362 3.986 20 10 CHCDRO CSC[C@H](C)[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2C ZINC000168786239 1121610313 /nfs/dbraw/zinc/61/03/13/1121610313.db2.gz SGLZTHPCGXCBMI-SRVKXCTJSA-N 1 0 265.422 3.590 20 10 CHCDRO C[C@@H]1CCC[C@@H]([NH2+]Cc2ccc3c(c2)CCCO3)[C@@H]1C ZINC001177092315 1121712170 /nfs/dbraw/zinc/71/21/70/1121712170.db2.gz BWSYJJCIJGCLJY-CKEIUWERSA-N 1 0 273.420 3.926 20 10 CHCDRO Cc1cc(C[N@H+]2C[C@@H](C)OC[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC000255956305 1121715694 /nfs/dbraw/zinc/71/56/94/1121715694.db2.gz GUGHSWIFABWSIF-ZIAGYGMSSA-N 1 0 291.435 3.607 20 10 CHCDRO COc1ccc(C[NH2+]C[C@H](C)N(C)c2ccccc2)cc1C ZINC000727643709 1121729600 /nfs/dbraw/zinc/72/96/00/1121729600.db2.gz HICYSDDUJOLFHD-INIZCTEOSA-N 1 0 298.430 3.618 20 10 CHCDRO COc1ccc([C@@H](C)[C@H](C)[NH2+]Cc2ccccc2O)cc1 ZINC000747100305 1121731733 /nfs/dbraw/zinc/73/17/33/1121731733.db2.gz VOLYREUNBJAAIZ-KBPBESRZSA-N 1 0 285.387 3.683 20 10 CHCDRO C[C@@H](Cc1ccsc1)[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001177441469 1121732259 /nfs/dbraw/zinc/73/22/59/1121732259.db2.gz BZNCXRUTDKCROD-ZDUSSCGKSA-N 1 0 287.428 3.794 20 10 CHCDRO C[C@@H]1CCCC[C@@H]1C[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001177575482 1121738357 /nfs/dbraw/zinc/73/83/57/1121738357.db2.gz JNJTYXJXXSBFST-CHWSQXEVSA-N 1 0 296.405 3.947 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]C[C@@H]2Cc3ccccc32)cc1 ZINC001177724613 1121746123 /nfs/dbraw/zinc/74/61/23/1121746123.db2.gz DGIYUYYQQRBGAW-XFHJGTJQSA-N 1 0 292.426 3.695 20 10 CHCDRO CC(C)CSCCC[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001178205802 1121771605 /nfs/dbraw/zinc/77/16/05/1121771605.db2.gz VEPYZUGBNCLDEL-UHFFFAOYSA-N 1 0 293.476 3.881 20 10 CHCDRO CC[C@@H](CSC)[NH2+]Cc1ccc(N(CC)CC)c(F)c1 ZINC001178365597 1121783291 /nfs/dbraw/zinc/78/32/91/1121783291.db2.gz NFHAMNGQRFTXNF-AWEZNQCLSA-N 1 0 298.471 3.903 20 10 CHCDRO CCCOc1ccc(C[NH2+]C2C[C@@H](C)O[C@H](C)C2)cc1C ZINC001178398322 1121783865 /nfs/dbraw/zinc/78/38/65/1121783865.db2.gz MPRPALIDCWAWRF-HUUCEWRRSA-N 1 0 291.435 3.829 20 10 CHCDRO Cc1cc(C[NH2+][C@@H]2CCCOC2)c(C)n1-c1cccc(C)c1 ZINC000730018091 1121790093 /nfs/dbraw/zinc/79/00/93/1121790093.db2.gz YMUJYUQYNVVMIW-GOSISDBHSA-N 1 0 298.430 3.671 20 10 CHCDRO C[C@@H]1C[C@@H](F)C[N@@H+]1Cc1ccc(N(C)C)c2ccccc12 ZINC001204232709 1121828550 /nfs/dbraw/zinc/82/85/50/1121828550.db2.gz IVIMJUAQMROBND-UKRRQHHQSA-N 1 0 286.394 3.838 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)cc1 ZINC001179228835 1121862637 /nfs/dbraw/zinc/86/26/37/1121862637.db2.gz UAIHZSPZWCUIJS-GOEGGOLHSA-N 1 0 284.447 3.792 20 10 CHCDRO CN(C)c1ccc(C[NH2+]CC[C@@H]2CC=CCC2)cc1F ZINC001179359142 1121873902 /nfs/dbraw/zinc/87/39/02/1121873902.db2.gz ONBAYLWVIOCNOL-CQSZACIVSA-N 1 0 276.399 3.728 20 10 CHCDRO COc1cc(C)cc(C[N@@H+]2CCCC[C@@H]2C(C)C)c1O ZINC001179952863 1121930834 /nfs/dbraw/zinc/93/08/34/1121930834.db2.gz SWAZBAAAEAISRI-OAHLLOKOSA-N 1 0 277.408 3.720 20 10 CHCDRO CCN(C)c1ccc(CN[C@H](C)c2ncc(C)s2)cc1 ZINC000773839484 1121939302 /nfs/dbraw/zinc/93/93/02/1121939302.db2.gz NQMIAIKFQJCKOI-CYBMUJFWSA-N 1 0 289.448 3.758 20 10 CHCDRO CC(C)C[C@H]1CC[N@H+](Cc2cc(F)c(F)cc2[O-])C1 ZINC001180267612 1121970512 /nfs/dbraw/zinc/97/05/12/1121970512.db2.gz YUTNHOKJHKSNCX-LLVKDONJSA-N 1 0 269.335 3.538 20 10 CHCDRO Cc1cccc(CC[NH2+]Cc2ccc(N(C)C)c(F)c2)c1 ZINC000733327478 1121977991 /nfs/dbraw/zinc/97/79/91/1121977991.db2.gz RSYSRNDVJSEFQN-UHFFFAOYSA-N 1 0 286.394 3.532 20 10 CHCDRO CCc1cccc(C[N@@H+]2CCc3c(cccc3OC)C2)c1O ZINC001180801138 1122017266 /nfs/dbraw/zinc/01/72/66/1122017266.db2.gz FVAYXYPNELUIRP-UHFFFAOYSA-N 1 0 297.398 3.522 20 10 CHCDRO COc1cc(C)c(C[NH2+]C[C@@H]2CCC[C@H](C)[C@@H]2C)c(O)c1 ZINC001181235335 1122044562 /nfs/dbraw/zinc/04/45/62/1122044562.db2.gz UZFPSOQBGXDIKQ-QEJZJMRPSA-N 1 0 291.435 3.871 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2CCC[C@H]2C(C)C)c1 ZINC001181544820 1122062253 /nfs/dbraw/zinc/06/22/53/1122062253.db2.gz ZTQIRMUAAVETIN-NOLJZWGESA-N 1 0 277.408 3.876 20 10 CHCDRO COc1cc(C)c(C[NH2+]C[C@H]2CCCC2(C)C)c(O)c1 ZINC001181972902 1122103273 /nfs/dbraw/zinc/10/32/73/1122103273.db2.gz VRZZLMWDRGWQJR-CYBMUJFWSA-N 1 0 277.408 3.625 20 10 CHCDRO CSC[C@@H]1CCC[N@H+](Cc2ccc(Cl)cc2O)C1 ZINC001182044231 1122105917 /nfs/dbraw/zinc/10/59/17/1122105917.db2.gz VZWOWCMHJFVGIB-LLVKDONJSA-N 1 0 285.840 3.621 20 10 CHCDRO C[C@H]1CC[N@H+](Cc2cc(F)ccc2O)CC12CCC2 ZINC000779604090 1129031876 /nfs/dbraw/zinc/03/18/76/1129031876.db2.gz FZJVDMOJJWWKRB-LBPRGKRZSA-N 1 0 263.356 3.543 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1ccc2c(c1)OCO2)c1ccccc1O ZINC000192750328 1129033877 /nfs/dbraw/zinc/03/38/77/1129033877.db2.gz CECMRCFHFWYCPS-IUODEOHRSA-N 1 0 299.370 3.923 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc2c(n1)CCCC2)c1ccccc1O ZINC000774446005 1122165552 /nfs/dbraw/zinc/16/55/52/1122165552.db2.gz SKLBOFBGCQLPHQ-KRWDZBQOSA-N 1 0 296.414 3.907 20 10 CHCDRO CC[C@H]1C[NH+](Cc2cc(C(C)C)ccc2O)C[C@H](CC)O1 ZINC001182461950 1122165990 /nfs/dbraw/zinc/16/59/90/1122165990.db2.gz MREREULEKOYZOC-IRXDYDNUSA-N 1 0 291.435 3.905 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccccc1N(C)C)c1ccccc1O ZINC000271758385 1122174230 /nfs/dbraw/zinc/17/42/30/1122174230.db2.gz ZAXMZFYYTJPUJB-MRXNPFEDSA-N 1 0 284.403 3.699 20 10 CHCDRO COc1ccc2c(NCc3ccccc3O)cc[nH+]c2c1 ZINC000774524394 1122180518 /nfs/dbraw/zinc/18/05/18/1122180518.db2.gz RYJISVFKDIOVTN-UHFFFAOYSA-N 1 0 280.327 3.561 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCOC2(CCCCC2)C1)c1ccccc1O ZINC000272815059 1122213968 /nfs/dbraw/zinc/21/39/68/1122213968.db2.gz DWQNSLDNMFTGDS-LSDHHAIUSA-N 1 0 289.419 3.925 20 10 CHCDRO COc1cccc2c1CC[C@H]([NH2+][C@H](C)c1ccccc1O)C2 ZINC001183355720 1122218167 /nfs/dbraw/zinc/21/81/67/1122218167.db2.gz RYJXTUAELIBQFI-HIFRSBDPSA-N 1 0 297.398 3.609 20 10 CHCDRO CC1=CCC[C@@H](C)[C@H]1C[N@@H+]1Cc2cccc(O)c2C1 ZINC001183454573 1122224045 /nfs/dbraw/zinc/22/40/45/1122224045.db2.gz MHLFGBRQEDGYBA-HIFRSBDPSA-N 1 0 257.377 3.700 20 10 CHCDRO COc1ccc(O)c(C[NH+]2CC([C@@H]3CCC[C@@H](C)C3)C2)c1 ZINC001183442194 1122224202 /nfs/dbraw/zinc/22/42/02/1122224202.db2.gz CTDPVKTWHYGMID-ZIAGYGMSSA-N 1 0 289.419 3.659 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCO[C@H](C)C1)c1cc(Cl)ccc1O ZINC000273347901 1122229011 /nfs/dbraw/zinc/22/90/11/1122229011.db2.gz BBCFRRYUCUGDAT-IJLUTSLNSA-N 1 0 283.799 3.511 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(Cl)nc2)c(O)c1C ZINC000273387104 1122230111 /nfs/dbraw/zinc/23/01/11/1122230111.db2.gz JUWJWPOMUCSLCA-GFCCVEGCSA-N 1 0 290.794 3.908 20 10 CHCDRO CCOc1ccc(C[NH2+][C@H](C)c2cc(C)ccc2O)cc1 ZINC000273384815 1122230128 /nfs/dbraw/zinc/23/01/28/1122230128.db2.gz JBOKNFLFMQBHIV-CQSZACIVSA-N 1 0 285.387 3.950 20 10 CHCDRO C[C@@H]([NH2+]CC1CCSCC1)c1cc(Cl)ccc1O ZINC000273359619 1122230244 /nfs/dbraw/zinc/23/02/44/1122230244.db2.gz AFMDAMZIXLPNDN-SNVBAGLBSA-N 1 0 285.840 3.839 20 10 CHCDRO C=C/C=C\CC[NH2+]Cc1cc(Br)cc(C)c1O ZINC001183582271 1122230683 /nfs/dbraw/zinc/23/06/83/1122230683.db2.gz KOZARXJZQZRRJN-PLNGDYQASA-N 1 0 296.208 3.685 20 10 CHCDRO COCC[C@H]([NH2+][C@H](C)c1cc(C)ccc1O)c1ccco1 ZINC000273413964 1122232126 /nfs/dbraw/zinc/23/21/26/1122232126.db2.gz IIGZGODMWFLOON-HIFRSBDPSA-N 1 0 289.375 3.722 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H](C)c2nccs2)c(O)c1C ZINC000273471413 1122235137 /nfs/dbraw/zinc/23/51/37/1122235137.db2.gz SAYTWTQZCZBJED-AAEUAGOBSA-N 1 0 290.432 3.920 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCO[C@@H](C(C)C)C2)c(O)c1 ZINC000273503712 1122236644 /nfs/dbraw/zinc/23/66/44/1122236644.db2.gz QOVBBXDKOHDWGR-GRDNDAEWSA-N 1 0 277.408 3.555 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)[C@@H]1CCCCO1)c1cc(Cl)ccc1O ZINC000273505204 1122236825 /nfs/dbraw/zinc/23/68/25/1122236825.db2.gz QXAUBPBFKMCWEL-PGUXBMHVSA-N 1 0 283.799 3.654 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCc2c1cccc2O)c1cc(F)ccc1O ZINC000273562939 1122239263 /nfs/dbraw/zinc/23/92/63/1122239263.db2.gz IPYMCRLKEHMSCA-MEBBXXQBSA-N 1 0 287.334 3.575 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCc3c2cccc3O)c1 ZINC000273578147 1122240270 /nfs/dbraw/zinc/24/02/70/1122240270.db2.gz MFFWYQJZVKVKRG-WBMJQRKESA-N 1 0 283.371 3.744 20 10 CHCDRO Cc1nc(C)c(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)s1 ZINC000273623114 1122241503 /nfs/dbraw/zinc/24/15/03/1122241503.db2.gz ZRYQWACBPMDAJA-QMMMGPOBSA-N 1 0 296.823 3.970 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2C[C@H]3CSC[C@@]3(C)C2)c(Cl)c1 ZINC001184188489 1122257551 /nfs/dbraw/zinc/25/75/51/1122257551.db2.gz MQQASHWUSKRQEM-XHDPSFHLSA-N 1 0 297.851 3.539 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(F)ccc1OC)c1ccccc1O ZINC000183331071 1129045258 /nfs/dbraw/zinc/04/52/58/1129045258.db2.gz LCFWQVUSXNLTNU-HNNXBMFYSA-N 1 0 289.350 3.781 20 10 CHCDRO C[C@@H](CC1CCCCC1)[NH2+]Cc1cc2c(cc1O)OCO2 ZINC000775038876 1122400867 /nfs/dbraw/zinc/40/08/67/1122400867.db2.gz JVQZHMGTBTUEBO-LBPRGKRZSA-N 1 0 291.391 3.569 20 10 CHCDRO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1cc(Cl)ccc1O ZINC001203664383 1122432991 /nfs/dbraw/zinc/43/29/91/1122432991.db2.gz CHGPMEDKGCYMLY-LBPRGKRZSA-N 1 0 287.790 3.992 20 10 CHCDRO C[C@H]([NH2+]CCCSc1nccs1)c1ccccc1O ZINC000183520252 1129059092 /nfs/dbraw/zinc/05/90/92/1129059092.db2.gz WYJGATLVLNCTMG-NSHDSACASA-N 1 0 294.445 3.682 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@H](C)CC1(OC)CCC1 ZINC000775141177 1122440034 /nfs/dbraw/zinc/44/00/34/1122440034.db2.gz XNKGGTFQVHOVIB-OAHLLOKOSA-N 1 0 290.451 3.709 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(Cl)s2)c1 ZINC000071306637 1129055750 /nfs/dbraw/zinc/05/57/50/1129055750.db2.gz XTEDCAOYZHXDDU-SECBINFHSA-N 1 0 297.807 3.967 20 10 CHCDRO COc1cccc(O)c1C[N@H+](C)[C@H](C)Cc1ccccc1C ZINC000775203904 1122478680 /nfs/dbraw/zinc/47/86/80/1122478680.db2.gz KGOMTGIHBULVFG-OAHLLOKOSA-N 1 0 299.414 3.772 20 10 CHCDRO CCc1ccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)o1 ZINC000775365109 1122528567 /nfs/dbraw/zinc/52/85/67/1122528567.db2.gz SWXGAGWJXKVKFW-CYBMUJFWSA-N 1 0 272.392 3.759 20 10 CHCDRO COc1cccc(F)c1[C@H](C)[NH2+][C@@H](C)c1ccccc1O ZINC000183533418 1129061244 /nfs/dbraw/zinc/06/12/44/1129061244.db2.gz PSCRNVLYHKQOMX-RYUDHWBXSA-N 1 0 289.350 3.952 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](O)c1cc(C)cc(C)c1)c1ccccc1O ZINC000775413853 1122556548 /nfs/dbraw/zinc/55/65/48/1122556548.db2.gz CMECFDZGGQGXFH-PKOBYXMFSA-N 1 0 299.414 3.783 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCC[C@H]1OC)c1ccc(N(C)C)cc1 ZINC000775417160 1122557426 /nfs/dbraw/zinc/55/74/26/1122557426.db2.gz LTTBKMJKGULNQI-RYQLBKOJSA-N 1 0 290.451 3.608 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1CCCOC1)c1cccc(Cl)c1[O-] ZINC000287273715 1122570528 /nfs/dbraw/zinc/57/05/28/1122570528.db2.gz BCHPUROLZHMTPU-SMDDNHRTSA-N 1 0 283.799 3.513 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)[C@@H]1CCOC1)c1cc(Cl)ccc1O ZINC000775510016 1122629816 /nfs/dbraw/zinc/62/98/16/1122629816.db2.gz WZMBVZLHOFAZJI-WDMOLILDSA-N 1 0 283.799 3.511 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)CSC)c1cc(Cl)ccc1O ZINC000775508620 1122629950 /nfs/dbraw/zinc/62/99/50/1122629950.db2.gz DNOAAHOFQUQIDA-CABZTGNLSA-N 1 0 273.829 3.838 20 10 CHCDRO CC[C@@H]([NH2+]CC[C@@H](C)OC)c1cc(Cl)ccc1O ZINC000775502532 1122630795 /nfs/dbraw/zinc/63/07/95/1122630795.db2.gz XGOQMAQCLLBVEV-ZWNOBZJWSA-N 1 0 271.788 3.511 20 10 CHCDRO CC[C@H]([NH2+]C[C@]1(C)CCOC1)c1cc(Cl)ccc1O ZINC000775503170 1122631228 /nfs/dbraw/zinc/63/12/28/1122631228.db2.gz CTMBRQHLBZTILS-ZFWWWQNUSA-N 1 0 283.799 3.513 20 10 CHCDRO CC[C@H]([NH2+][C@@H](COC)C(C)C)c1cc(Cl)ccc1O ZINC000775510283 1122631371 /nfs/dbraw/zinc/63/13/71/1122631371.db2.gz ZQZQDEKWBMMKBS-KBPBESRZSA-N 1 0 285.815 3.757 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccn(C)c1)c1cc(Cl)ccc1O ZINC000775513379 1122632774 /nfs/dbraw/zinc/63/27/74/1122632774.db2.gz YXRRLHRIKMLKGE-AWEZNQCLSA-N 1 0 278.783 3.625 20 10 CHCDRO CC[C@@H]([NH2+]CCN1CCC[C@@H]1C)c1cc(Cl)ccc1O ZINC000775509610 1122633321 /nfs/dbraw/zinc/63/33/21/1122633321.db2.gz STDVXJOOFSFBTI-SWLSCSKDSA-N 1 0 296.842 3.571 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1CCCS1)c1cc(Cl)ccc1O ZINC000775512316 1122633717 /nfs/dbraw/zinc/63/37/17/1122633717.db2.gz JBJKVQJMYYZUHB-DGCLKSJQSA-N 1 0 285.840 3.982 20 10 CHCDRO CC[C@H](C[C@H](C)CO)[NH2+][C@@H](CC)c1cc(Cl)ccc1O ZINC000775513274 1122633727 /nfs/dbraw/zinc/63/37/27/1122633727.db2.gz PLVVRBQJFXNPCX-LNSITVRQSA-N 1 0 299.842 3.883 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CC[C@@H](CO)CC1)c1cc(Cl)ccc1O ZINC000775511857 1122633865 /nfs/dbraw/zinc/63/38/65/1122633865.db2.gz DOUDYVVVFQQAEA-OSAQELSMSA-N 1 0 297.826 3.637 20 10 CHCDRO CC[C@@H]([NH2+]C1CCC(O)(CC)CC1)c1ccccc1O ZINC000775518589 1122637629 /nfs/dbraw/zinc/63/76/29/1122637629.db2.gz DIIZQKVTWMDBPR-GNHJJJEISA-N 1 0 277.408 3.517 20 10 CHCDRO CC[C@H]([NH2+]C1CCC(O)(CC)CC1)c1ccccc1O ZINC000775518590 1122637804 /nfs/dbraw/zinc/63/78/04/1122637804.db2.gz DIIZQKVTWMDBPR-GULBITTBSA-N 1 0 277.408 3.517 20 10 CHCDRO CC[C@@H]([NH2+]CC1(CCOC)CC1)c1cc(Cl)ccc1O ZINC000775521954 1122638771 /nfs/dbraw/zinc/63/87/71/1122638771.db2.gz GDRMEKUHSCMOLR-CQSZACIVSA-N 1 0 297.826 3.903 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@@H](C)CCCC(F)(F)F)c1 ZINC000775523301 1122639940 /nfs/dbraw/zinc/63/99/40/1122639940.db2.gz HYRJAZJSYAIMAM-JTQLQIEISA-N 1 0 291.313 3.612 20 10 CHCDRO CC[C@H]([NH2+]CC(C)(C)C[C@@H](C)O)c1cc(Cl)ccc1O ZINC000775527716 1122644684 /nfs/dbraw/zinc/64/46/84/1122644684.db2.gz SQLCFLJYCFDGOR-RISCZKNCSA-N 1 0 299.842 3.883 20 10 CHCDRO CC[C@@H]1CC[C@@H](C)[N@@H+]1Cc1ccc(N(C)C)c(C)c1 ZINC001192645508 1122654840 /nfs/dbraw/zinc/65/48/40/1122654840.db2.gz NRIOPXPZMKGLTH-GDBMZVCRSA-N 1 0 260.425 3.824 20 10 CHCDRO CC[C@H]1CC[C@H](C)[N@@H+]1Cc1ccc(N(C)C)c(C)c1 ZINC001192645510 1122654894 /nfs/dbraw/zinc/65/48/94/1122654894.db2.gz NRIOPXPZMKGLTH-HOCLYGCPSA-N 1 0 260.425 3.824 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)[C@@H]1CCCOC1)c1cc(Cl)ccc1O ZINC000775548486 1122658879 /nfs/dbraw/zinc/65/88/79/1122658879.db2.gz SZETVYNIHMMDIJ-JMSVASOKSA-N 1 0 297.826 3.901 20 10 CHCDRO CC[C@@H]([NH2+]CC[C@@H]1CCOC1)c1cc(Cl)ccc1O ZINC000775552471 1122662035 /nfs/dbraw/zinc/66/20/35/1122662035.db2.gz VQSLIALKKNTYBG-BXUZGUMPSA-N 1 0 283.799 3.513 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1cncs1 ZINC000775580920 1122680570 /nfs/dbraw/zinc/68/05/70/1122680570.db2.gz DOMOUONRXNMYET-NWDGAFQWSA-N 1 0 275.421 3.621 20 10 CHCDRO CC(C)C[C@@H]1C[C@@H]([NH2+][C@H]2CCc3cccc(O)c32)CCO1 ZINC000296800251 1122778619 /nfs/dbraw/zinc/77/86/19/1122778619.db2.gz LMSXLKQUJIULNX-XHSDSOJGSA-N 1 0 289.419 3.563 20 10 CHCDRO CCOC(C)(C)C[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C ZINC000159253300 1122800564 /nfs/dbraw/zinc/80/05/64/1122800564.db2.gz XEDUIJLKMHKUQR-QWHCGFSZSA-N 1 0 277.408 3.654 20 10 CHCDRO Cc1ccccc1C[N@@H+](C)Cc1cccc(Cl)c1[O-] ZINC000775641677 1122849898 /nfs/dbraw/zinc/84/98/98/1122849898.db2.gz DAWOOLDQAKDYOQ-UHFFFAOYSA-N 1 0 275.779 3.986 20 10 CHCDRO Cc1cccc(C[N@H+](C)Cc2cccc(Cl)c2)c1O ZINC000775642361 1122850428 /nfs/dbraw/zinc/85/04/28/1122850428.db2.gz FXBUUWGTGFLPES-UHFFFAOYSA-N 1 0 275.779 3.986 20 10 CHCDRO CCOc1ccc(C[N@H+](C)Cc2cccc(C)c2O)cc1 ZINC000775642935 1122851276 /nfs/dbraw/zinc/85/12/76/1122851276.db2.gz PSDVCIYSXZAPLK-UHFFFAOYSA-N 1 0 285.387 3.731 20 10 CHCDRO CC[N@H+](Cc1ccc(C)cc1)Cc1cc(OC)ccc1O ZINC000775652968 1122868141 /nfs/dbraw/zinc/86/81/41/1122868141.db2.gz XQPZSCJWRGQFHA-UHFFFAOYSA-N 1 0 285.387 3.731 20 10 CHCDRO C[N@@H+](Cc1cc(Cl)cc(F)c1[O-])CC1CCCC1 ZINC000775665445 1122874930 /nfs/dbraw/zinc/87/49/30/1122874930.db2.gz BRSVFGAIJWOGIU-UHFFFAOYSA-N 1 0 271.763 3.807 20 10 CHCDRO Cc1occc1C[N@@H+](C)Cc1cc(Cl)cc(C)c1O ZINC000775662566 1122875794 /nfs/dbraw/zinc/87/57/94/1122875794.db2.gz YLGPHECDWSDDLN-UHFFFAOYSA-N 1 0 279.767 3.887 20 10 CHCDRO Cc1cc(Cl)cc(C[NH+]2C[C@@H](C)S[C@H](C)C2)c1O ZINC000775664274 1122876897 /nfs/dbraw/zinc/87/68/97/1122876897.db2.gz JWCWWVNNGDDERM-GHMZBOCLSA-N 1 0 285.840 3.680 20 10 CHCDRO Cc1cc(Cl)cc(C[NH+]2C[C@H](C)S[C@@H](C)C2)c1O ZINC000775664278 1122877143 /nfs/dbraw/zinc/87/71/43/1122877143.db2.gz JWCWWVNNGDDERM-QWRGUYRKSA-N 1 0 285.840 3.680 20 10 CHCDRO Cc1cccc(C[N@@H+]2CC[C@@H](c3ccccc3F)C2)c1O ZINC000775686555 1122908299 /nfs/dbraw/zinc/90/82/99/1122908299.db2.gz KLHMLAHHZHEZQG-CQSZACIVSA-N 1 0 285.362 3.829 20 10 CHCDRO Cc1cccc(C[N@@H+]2CC[C@H](c3ccc(F)cc3)C2)c1O ZINC000775690578 1122911064 /nfs/dbraw/zinc/91/10/64/1122911064.db2.gz PQIAOWKWFNUTCJ-HNNXBMFYSA-N 1 0 285.362 3.829 20 10 CHCDRO Cc1cccc(C[N@@H+]2[C@H](C)C[C@H]3CCCC[C@@H]32)c1O ZINC000775701319 1122912156 /nfs/dbraw/zinc/91/21/56/1122912156.db2.gz KICDQJHAJIBREY-FMKPAKJESA-N 1 0 259.393 3.854 20 10 CHCDRO Oc1c(Cl)cccc1CNc1ccc(-n2ccnc2)cc1 ZINC000775745735 1122935157 /nfs/dbraw/zinc/93/51/57/1122935157.db2.gz DGGPIRLGGMYDKV-UHFFFAOYSA-N 1 0 299.761 3.843 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2C[C@@H](C)CC2(C)C)cc1 ZINC001197360111 1122954280 /nfs/dbraw/zinc/95/42/80/1122954280.db2.gz UWZNKLBMLFQNAF-AWEZNQCLSA-N 1 0 260.425 3.763 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]C(C)(C)CC(F)(F)F ZINC000840939672 1122973297 /nfs/dbraw/zinc/97/32/97/1122973297.db2.gz PBKSLTLGRDKHHQ-UHFFFAOYSA-N 1 0 288.357 3.882 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)c(C)n1 ZINC000775837395 1122985851 /nfs/dbraw/zinc/98/58/51/1122985851.db2.gz SBRKWXZHCRGWCE-CQSZACIVSA-N 1 0 283.419 3.615 20 10 CHCDRO C[C@@H]1CC[C@H]([NH2+]Cc2ccc(N3CCSCC3)cc2)C1 ZINC001199376883 1123028844 /nfs/dbraw/zinc/02/88/44/1123028844.db2.gz QXIJKYGOPSBKAI-ZBFHGGJFSA-N 1 0 290.476 3.518 20 10 CHCDRO C[C@H](c1ccccc1)[N@@H+](Cc1ccccc1O)C[C@H](C)CO ZINC000776002605 1123035088 /nfs/dbraw/zinc/03/50/88/1123035088.db2.gz GGWQZZKIGGHXHD-JKSUJKDBSA-N 1 0 299.414 3.584 20 10 CHCDRO C[C@H]1[C@@H](C(F)(F)F)CCC[N@@H+]1Cc1cc(F)ccc1O ZINC000776012506 1123035941 /nfs/dbraw/zinc/03/59/41/1123035941.db2.gz HFNQRRYJXWAIKQ-CABZTGNLSA-N 1 0 291.288 3.694 20 10 CHCDRO Cc1cccc(C[NH2+]Cc2ccc([C@@H]3C[C@H]3C)o2)c1O ZINC000776024909 1123041196 /nfs/dbraw/zinc/04/11/96/1123041196.db2.gz ZVDBXACNYQXJJY-IUODEOHRSA-N 1 0 271.360 3.707 20 10 CHCDRO Cc1cccc(C[NH2+]C2CC(C)(c3ccccc3)C2)c1O ZINC000776167649 1123099602 /nfs/dbraw/zinc/09/96/02/1123099602.db2.gz DVDZQXRCCDTKDC-UHFFFAOYSA-N 1 0 281.399 3.911 20 10 CHCDRO C[C@@H](COc1ccccc1)[NH2+]Cc1c(O)cccc1Cl ZINC000776174398 1123101369 /nfs/dbraw/zinc/10/13/69/1123101369.db2.gz KYVCUQIATCOVTC-LBPRGKRZSA-N 1 0 291.778 3.603 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+]C(C)(C)C2CC2)c1O ZINC000776176756 1123102643 /nfs/dbraw/zinc/10/26/43/1123102643.db2.gz DWONFPRJAPGSTD-UHFFFAOYSA-N 1 0 253.773 3.632 20 10 CHCDRO CC[C@@H]1CCC[C@H]1[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC001201449606 1123106293 /nfs/dbraw/zinc/10/62/93/1123106293.db2.gz IMOOAJWKJNVNMW-MYOVTOPRSA-N 1 0 272.436 3.934 20 10 CHCDRO CCOCc1cc(C[NH2+][C@@H](C)CC(C)C)ccc1OC ZINC001201594787 1123129347 /nfs/dbraw/zinc/12/93/47/1123129347.db2.gz LDFKQONVESHZJZ-AWEZNQCLSA-N 1 0 279.424 3.756 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2ccc[nH]2)cc1 ZINC001201833483 1123153997 /nfs/dbraw/zinc/15/39/97/1123153997.db2.gz QMRWAQAPPQYSHT-AWEZNQCLSA-N 1 0 271.408 3.712 20 10 CHCDRO C[C@@H](C[NH2+]Cc1ccc2c(c1)CCCO2)c1ccccc1 ZINC001201929350 1123157880 /nfs/dbraw/zinc/15/78/80/1123157880.db2.gz LUSRVDMGVNERFK-HNNXBMFYSA-N 1 0 281.399 3.905 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CC23CCCC3)c(O)c1C ZINC000760040836 1123181011 /nfs/dbraw/zinc/18/10/11/1123181011.db2.gz LUMGYWUOOIJEES-UKRRQHHQSA-N 1 0 259.393 3.992 20 10 CHCDRO Cc1cccc(C[NH2+]CC2(Cc3ccc(F)cc3)CC2)c1O ZINC000776257007 1123188790 /nfs/dbraw/zinc/18/87/90/1123188790.db2.gz VMFOZRFKTGBAAR-UHFFFAOYSA-N 1 0 299.389 3.952 20 10 CHCDRO COc1cccc(C[NH2+]C[C@@H](c2ccccc2)C(C)C)c1O ZINC000237210621 1123194392 /nfs/dbraw/zinc/19/43/92/1123194392.db2.gz ALRHNCCSVZMYAK-QGZVFWFLSA-N 1 0 299.414 3.930 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)C[C@@H]2CCCOC2)cc1C(C)C ZINC000107671976 1123225610 /nfs/dbraw/zinc/22/56/10/1123225610.db2.gz BUIPCDCQXWGIOZ-HNNXBMFYSA-N 1 0 291.435 3.682 20 10 CHCDRO C[C@]1(C[NH2+]Cc2ccc(N3CCCCC3)cc2)CC1(F)F ZINC000850378939 1123260641 /nfs/dbraw/zinc/26/06/41/1123260641.db2.gz BKEIAVNFRRVFNV-MRXNPFEDSA-N 1 0 294.389 3.812 20 10 CHCDRO c1csc(SCCC[NH2+][C@@H]2CCCC23CC3)n1 ZINC000850438655 1123267245 /nfs/dbraw/zinc/26/72/45/1123267245.db2.gz YNYAHCAGTGFKFM-LLVKDONJSA-N 1 0 268.451 3.548 20 10 CHCDRO C[C@@H](C[NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1ccccn1 ZINC000850481496 1123273106 /nfs/dbraw/zinc/27/31/06/1123273106.db2.gz HJKFRANJFGJNHC-GJZGRUSLSA-N 1 0 283.419 3.602 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](C)c2ccccn2)c(O)c1C ZINC000850482019 1123273685 /nfs/dbraw/zinc/27/36/85/1123273685.db2.gz MAIZCGBUWFTVBX-DZGCQCFKSA-N 1 0 284.403 3.858 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](C)c1ccccn1)c1ccc(N(C)C)cc1 ZINC000850482904 1123274385 /nfs/dbraw/zinc/27/43/85/1123274385.db2.gz SIBVLBGLDDYTEM-CRAIPNDOSA-N 1 0 297.446 3.992 20 10 CHCDRO CC[C@@H](COCC1CC1)[NH2+][C@@H](CC)c1ccccc1O ZINC000850494120 1123274861 /nfs/dbraw/zinc/27/48/61/1123274861.db2.gz MZONSUVYKCQHGF-HOCLYGCPSA-N 1 0 277.408 3.638 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCN(C(C)(C)C)C1)c1cc(Cl)ccc1O ZINC000850494847 1123275317 /nfs/dbraw/zinc/27/53/17/1123275317.db2.gz SXTPXMFCOHXCHT-AAEUAGOBSA-N 1 0 296.842 3.569 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1cscn1)c1ccc(C)cc1O ZINC000850511708 1123277883 /nfs/dbraw/zinc/27/78/83/1123277883.db2.gz LRDYUYQLOMRFSK-DGCLKSJQSA-N 1 0 276.405 3.959 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@@H]2Cc3ccccc3[C@@H]2C)c1O ZINC000850517907 1123279168 /nfs/dbraw/zinc/27/91/68/1123279168.db2.gz HKTSKHMGJJOGCC-OGHNNQOOSA-N 1 0 297.398 3.780 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2C[C@H](O)c3ccccc32)c(O)c1 ZINC000850526968 1123281673 /nfs/dbraw/zinc/28/16/73/1123281673.db2.gz DHKSXDYRNMWKJG-IWEFOYFVSA-N 1 0 283.371 3.530 20 10 CHCDRO C[C@H]1C[C@@H]([NH2+]CCCOC(C)(C)C)c2c1c(F)ccc2O ZINC000850527227 1123282071 /nfs/dbraw/zinc/28/20/71/1123282071.db2.gz VNKCWFZHJCHVBN-WCQYABFASA-N 1 0 295.398 3.874 20 10 CHCDRO COCc1csc(C[NH2+][C@H](C)c2ccc(C)cc2O)c1 ZINC000850533339 1123285898 /nfs/dbraw/zinc/28/58/98/1123285898.db2.gz WEKCIBBABLBZNH-GFCCVEGCSA-N 1 0 291.416 3.759 20 10 CHCDRO C[C@H]([NH2+]CC[C@]1(C)CC1(F)F)c1cc(F)ccc1O ZINC000850537675 1123287962 /nfs/dbraw/zinc/28/79/62/1123287962.db2.gz WYNBJRCTVCRKBD-TVQRCGJNSA-N 1 0 273.298 3.617 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CC[C@@]2(C)CC2(F)F)c1 ZINC000850537580 1123288392 /nfs/dbraw/zinc/28/83/92/1123288392.db2.gz WBXRGXRTVIHKFM-FZMZJTMJSA-N 1 0 269.335 3.787 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2c(C3CCC3)cnn2C)c(O)c1 ZINC000850552804 1123289976 /nfs/dbraw/zinc/28/99/76/1123289976.db2.gz YWCQRYWBCBUEPT-ZDUSSCGKSA-N 1 0 299.418 3.552 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+]CC2CCC(O)CC2)c1O ZINC000850553349 1123289980 /nfs/dbraw/zinc/28/99/80/1123289980.db2.gz WJAUCAZDRKGHQV-DCBWTQNWSA-N 1 0 297.826 3.556 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1C(C)(C)C1(F)F)c1ccc(N(C)C)cc1 ZINC000850552666 1123290228 /nfs/dbraw/zinc/29/02/28/1123290228.db2.gz PHPNQAXRFJTJJG-FZMZJTMJSA-N 1 0 282.378 3.695 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H](O)[C@@H](C)c2ccccc2)c1 ZINC000850572769 1123294976 /nfs/dbraw/zinc/29/49/76/1123294976.db2.gz GEIZFIHDVANASM-YZVOILCLSA-N 1 0 299.414 3.516 20 10 CHCDRO COc1cccc(C[NH2+][C@@H](C)c2cc(C)ccc2O)c1C ZINC000850578520 1123296542 /nfs/dbraw/zinc/29/65/42/1123296542.db2.gz MOKIASPGJMWAHH-AWEZNQCLSA-N 1 0 285.387 3.868 20 10 CHCDRO CCN(CC[NH2+][C@@H](C)c1ccccc1O)c1ccccc1C ZINC000783504238 1123313107 /nfs/dbraw/zinc/31/31/07/1123313107.db2.gz WREKOILZSSVOCW-INIZCTEOSA-N 1 0 298.430 3.878 20 10 CHCDRO Cc1nc(C[N@H+](Cc2ccccc2O)C2CCCC2)co1 ZINC000851771573 1123379488 /nfs/dbraw/zinc/37/94/88/1123379488.db2.gz JBFVAKRDAWXQHO-UHFFFAOYSA-N 1 0 286.375 3.633 20 10 CHCDRO C[N@H+](CCOc1ccccc1Cl)Cc1ccccc1O ZINC000111235159 1123432461 /nfs/dbraw/zinc/43/24/61/1123432461.db2.gz NWGUHOCLYFECAQ-UHFFFAOYSA-N 1 0 291.778 3.556 20 10 CHCDRO Oc1ccc2ccncc2c1C[N@@H+]1CCC[C@H](CCF)C1 ZINC000853564206 1123444211 /nfs/dbraw/zinc/44/42/11/1123444211.db2.gz KNTAGFFXMLIZMP-CYBMUJFWSA-N 1 0 288.366 3.512 20 10 CHCDRO CC[N@H+](CCc1cccs1)Cc1ccc(N(C)C)cc1 ZINC000729542449 1123486120 /nfs/dbraw/zinc/48/61/20/1123486120.db2.gz GDCBFAOLFMLNOH-UHFFFAOYSA-N 1 0 288.460 3.879 20 10 CHCDRO COCC1CC[NH+](Cc2cc(C(C)C)c(C)cc2O)CC1 ZINC000112332028 1123488789 /nfs/dbraw/zinc/48/87/89/1123488789.db2.gz LMUNYPAXOSSQFT-UHFFFAOYSA-N 1 0 291.435 3.682 20 10 CHCDRO Oc1c(C[NH2+]Cc2cc(C3CC3)no2)ccc2ccccc21 ZINC000895765176 1123512650 /nfs/dbraw/zinc/51/26/50/1123512650.db2.gz KNBMBVTYQPBJML-UHFFFAOYSA-N 1 0 294.354 3.701 20 10 CHCDRO C[C@H]([NH2+]Cc1ccccc1O)c1ccc2ncsc2c1 ZINC000776807414 1123514675 /nfs/dbraw/zinc/51/46/75/1123514675.db2.gz HQJMIWWWXQTBBG-NSHDSACASA-N 1 0 284.384 3.853 20 10 CHCDRO Cc1nc(C)c(C[NH2+][C@H](C)c2ccc(C)cc2O)s1 ZINC000273597431 1129126639 /nfs/dbraw/zinc/12/66/39/1129126639.db2.gz RABXNUKNRAJAIG-SNVBAGLBSA-N 1 0 276.405 3.625 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)[C@H]1COc2ccccc2C1)c1ccccc1O ZINC000895851040 1123521165 /nfs/dbraw/zinc/52/11/65/1123521165.db2.gz IIJUPZQVTPKIFR-IIAWOOMASA-N 1 0 297.398 3.683 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2nc(C(C)(C)C)cs2)c1 ZINC000113337805 1123521652 /nfs/dbraw/zinc/52/16/52/1123521652.db2.gz QEEXSGSRLYOSJJ-UHFFFAOYSA-N 1 0 290.432 3.744 20 10 CHCDRO Cc1cc([C@@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)c(C)o1 ZINC000113330327 1123521729 /nfs/dbraw/zinc/52/17/29/1123521729.db2.gz WPJCWTZICSUPAD-GFCCVEGCSA-N 1 0 290.382 3.952 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]CCc2c[nH]c3cc(F)ccc23)c1 ZINC000113331358 1123521953 /nfs/dbraw/zinc/52/19/53/1123521953.db2.gz NFSGKWSXCBGKHE-UHFFFAOYSA-N 1 0 298.361 3.653 20 10 CHCDRO Cc1[nH]c2ccccc2c1CC[NH2+]Cc1cc(C)ccc1O ZINC000113333494 1123522023 /nfs/dbraw/zinc/52/20/23/1123522023.db2.gz UCYVMNXUBQNAES-UHFFFAOYSA-N 1 0 294.398 3.823 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H]2CCc3c2cccc3F)c1O ZINC000895854352 1123522545 /nfs/dbraw/zinc/52/25/45/1123522545.db2.gz KGVFOFWOGXKFBP-MRXNPFEDSA-N 1 0 271.335 3.617 20 10 CHCDRO CCCc1ccc(C[NH2+]Cc2ccc(OC)cc2O)s1 ZINC000857041178 1123580851 /nfs/dbraw/zinc/58/08/51/1123580851.db2.gz JRLYVEFSRXYVMH-UHFFFAOYSA-N 1 0 291.416 3.705 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2ccc3c(c2)CC(C)(C)O3)c1 ZINC000858237616 1123639380 /nfs/dbraw/zinc/63/93/80/1123639380.db2.gz NGVNQSJOMRKQNZ-UHFFFAOYSA-N 1 0 297.398 3.704 20 10 CHCDRO COc1ccc2ccc(O)c(C[N@H+](C)C3CCCC3)c2c1 ZINC000194571952 1129135287 /nfs/dbraw/zinc/13/52/87/1129135287.db2.gz IVHBEGIYUZNMNQ-UHFFFAOYSA-N 1 0 285.387 3.928 20 10 CHCDRO CCC[C@@H](C[NH2+][C@@H](C)c1c(C)cc(C)cc1O)OCC ZINC000858450478 1123655292 /nfs/dbraw/zinc/65/52/92/1123655292.db2.gz DONXQFQLHMZNGL-GJZGRUSLSA-N 1 0 279.424 3.865 20 10 CHCDRO CO[C@H]1C[C@@H](C[NH2+][C@H](C)c2ccc3ccccc3c2O)C1 ZINC000858592546 1123665527 /nfs/dbraw/zinc/66/55/27/1123665527.db2.gz FSIFLZODDJTPGK-NFAWXSAZSA-N 1 0 285.387 3.621 20 10 CHCDRO CCC[N@H+](Cc1cnc(C2CC2)o1)Cc1ccccc1O ZINC000862236872 1123794149 /nfs/dbraw/zinc/79/41/49/1123794149.db2.gz FNOQJGWOJIULGG-UHFFFAOYSA-N 1 0 286.375 3.670 20 10 CHCDRO Oc1cccc(Br)c1C[N@@H+]1CCC[C@@H]1C1CC1 ZINC000862239193 1123794681 /nfs/dbraw/zinc/79/46/81/1123794681.db2.gz YRSKCCXCBCZWBM-CYBMUJFWSA-N 1 0 296.208 3.529 20 10 CHCDRO COCC1([NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)CC1 ZINC000777237120 1123795984 /nfs/dbraw/zinc/79/59/84/1123795984.db2.gz GINQBUAEBGDAJI-OAHLLOKOSA-N 1 0 288.435 3.507 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CCC(F)(F)C2)cc1 ZINC000777240901 1123796051 /nfs/dbraw/zinc/79/60/51/1123796051.db2.gz FERBNARPYRHRIH-GXTWGEPZSA-N 1 0 282.378 3.981 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(C)c(C)n1)c1ccc(C)cc1O ZINC000840782727 1123796700 /nfs/dbraw/zinc/79/67/00/1123796700.db2.gz FAOBVOZDUWTAMI-KRWDZBQOSA-N 1 0 284.403 3.953 20 10 CHCDRO Oc1cccc(Br)c1C[N@@H+]1CCCC2(CC2)C1 ZINC000862328190 1123799989 /nfs/dbraw/zinc/79/99/89/1123799989.db2.gz MCLARKRKPITBBO-UHFFFAOYSA-N 1 0 296.208 3.531 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H](C)CCC(F)(F)F)c1 ZINC000862475989 1123812559 /nfs/dbraw/zinc/81/25/59/1123812559.db2.gz DPDQXEOSFCMUPG-SNVBAGLBSA-N 1 0 261.287 3.521 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH+]1CC(Cc2cccs2)C1 ZINC000862538943 1123817816 /nfs/dbraw/zinc/81/78/16/1123817816.db2.gz WGADCAXEQYUCCN-UHFFFAOYSA-N 1 0 293.819 3.782 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](C)CCOC)c1cc(Cl)ccc1O ZINC000840836225 1123838366 /nfs/dbraw/zinc/83/83/66/1123838366.db2.gz VWEFAKUCUYVICX-SMDDNHRTSA-N 1 0 285.815 3.759 20 10 CHCDRO CC(=O)[C@H]1CC[N@H+](Cc2cc(C)n(-c3ccccc3)c2C)C1 ZINC001137859021 1123855189 /nfs/dbraw/zinc/85/51/89/1123855189.db2.gz FLBIGBFEHBMDSW-KRWDZBQOSA-N 1 0 296.414 3.505 20 10 CHCDRO Cc1cccc(OCC[NH2+]Cc2c(O)cccc2Cl)c1 ZINC000083551483 1129150971 /nfs/dbraw/zinc/15/09/71/1129150971.db2.gz AKAIYYARHLMMDQ-UHFFFAOYSA-N 1 0 291.778 3.523 20 10 CHCDRO CC[C@@H]([NH2+]CC(C)(C)OCC1CC1)c1ccc(C)cc1O ZINC000840876498 1123901286 /nfs/dbraw/zinc/90/12/86/1123901286.db2.gz NOANBCBFNNPEPT-MRXNPFEDSA-N 1 0 291.435 3.947 20 10 CHCDRO CCc1cccc(C[NH+]2CCC(CCF)CC2)c1O ZINC000864050740 1123914235 /nfs/dbraw/zinc/91/42/35/1123914235.db2.gz PLDTVRARRNJDQJ-UHFFFAOYSA-N 1 0 265.372 3.526 20 10 CHCDRO COc1cc(C)ccc1C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000119822696 1123914640 /nfs/dbraw/zinc/91/46/40/1123914640.db2.gz POHJKBFWERDDTE-OAHLLOKOSA-N 1 0 298.430 3.920 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCOC(C)(C)C2)c(O)c1C ZINC000120220359 1123945231 /nfs/dbraw/zinc/94/52/31/1123945231.db2.gz SXXMHFFRFLDXHK-KGLIPLIRSA-N 1 0 277.408 3.617 20 10 CHCDRO CC[C@H]([NH2+]CC1(O)CCCCCC1)c1ccc(C)cc1O ZINC000794801041 1123950593 /nfs/dbraw/zinc/95/05/93/1123950593.db2.gz HSSLBUVGKDMPFZ-INIZCTEOSA-N 1 0 291.435 3.827 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)CCSC)c1ccc(C)cc1O ZINC000794803726 1123953026 /nfs/dbraw/zinc/95/30/26/1123953026.db2.gz SOMGHMNDNNJYJS-GXTWGEPZSA-N 1 0 267.438 3.883 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](O)CC(C)(C)C)c1ccc(C)cc1O ZINC000794805586 1123953953 /nfs/dbraw/zinc/95/39/53/1123953953.db2.gz XTEHFXKUPWJUST-DZGCQCFKSA-N 1 0 279.424 3.538 20 10 CHCDRO CC[C@H](C)[C@@](C)(O)C[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000794809926 1123956312 /nfs/dbraw/zinc/95/63/12/1123956312.db2.gz RXHXCVUTDUTWRC-QRTARXTBSA-N 1 0 279.424 3.538 20 10 CHCDRO CC[C@H]([NH2+]CCOCC1CCC1)c1ccc(C)cc1O ZINC000794812706 1123957261 /nfs/dbraw/zinc/95/72/61/1123957261.db2.gz FCWKVIQAKDTFHP-INIZCTEOSA-N 1 0 277.408 3.558 20 10 CHCDRO CCOC[C@@H]([NH2+][C@H](CC)c1ccc(C)cc1O)C(C)C ZINC000794812481 1123958889 /nfs/dbraw/zinc/95/88/89/1123958889.db2.gz DQKSPTYWGONIBA-HZPDHXFCSA-N 1 0 279.424 3.802 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CC)c1ccc(N(C)C)cc1)[C@@H](O)C(C)C ZINC000840884153 1123996102 /nfs/dbraw/zinc/99/61/02/1123996102.db2.gz ZUCHOABMWLUFTE-KSZLIROESA-N 1 0 292.467 3.589 20 10 CHCDRO Cc1c2ccccc2n(C)c1CNc1[nH+]ccn1C1CC1 ZINC000840886615 1123997205 /nfs/dbraw/zinc/99/72/05/1123997205.db2.gz JDFJATJSQUYBLO-UHFFFAOYSA-N 1 0 280.375 3.630 20 10 CHCDRO CC(C)(C)c1ccc(C[NH2+]Cc2ccccc2O)o1 ZINC000865814986 1124017052 /nfs/dbraw/zinc/01/70/52/1124017052.db2.gz RAQHBBFGVHHWEB-UHFFFAOYSA-N 1 0 259.349 3.573 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+](C)[C@H](C)c1ccncc1 ZINC000840938337 1124030940 /nfs/dbraw/zinc/03/09/40/1124030940.db2.gz BUZLUEWECXVWEB-OAHLLOKOSA-N 1 0 283.419 3.649 20 10 CHCDRO Cc1ccoc1C[NH2+]Cc1c(O)cc(C)cc1Cl ZINC000840950691 1124035858 /nfs/dbraw/zinc/03/58/58/1124035858.db2.gz QTMLTQQALYUCDA-UHFFFAOYSA-N 1 0 265.740 3.545 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]Cc2csc(C)c2C)c1O ZINC000866428760 1124065398 /nfs/dbraw/zinc/06/53/98/1124065398.db2.gz GARQRYRENLMQNX-LLVKDONJSA-N 1 0 291.416 3.930 20 10 CHCDRO Cc1ncc([C@H](C)[NH2+][C@H](C)c2ccccc2O)s1 ZINC000866455427 1124068109 /nfs/dbraw/zinc/06/81/09/1124068109.db2.gz LKTDKVKWHKGXKL-ZJUUUORDSA-N 1 0 262.378 3.569 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2cccc3c2CCOC3)c1 ZINC000866478727 1124070239 /nfs/dbraw/zinc/07/02/39/1124070239.db2.gz KOVWWSQDDUPOHA-CQSZACIVSA-N 1 0 297.398 3.624 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H](C)CC2CCC2)c1O ZINC000866487165 1124071698 /nfs/dbraw/zinc/07/16/98/1124071698.db2.gz VJAWIXJCANBHAR-NEPJUHHUSA-N 1 0 263.381 3.630 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@H](C)CC2CCC2)c1O ZINC000866487168 1124072042 /nfs/dbraw/zinc/07/20/42/1124072042.db2.gz VJAWIXJCANBHAR-VXGBXAGGSA-N 1 0 263.381 3.630 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@@H](CF)c1ccc(F)cc1)CC2 ZINC000866596991 1124086106 /nfs/dbraw/zinc/08/61/06/1124086106.db2.gz MRNZWNMWJSSEBG-CABCVRRESA-N 1 0 289.325 3.819 20 10 CHCDRO C[NH2+]Cc1cccc(NCc2c(O)cc(C)cc2Cl)c1 ZINC000841041685 1124112508 /nfs/dbraw/zinc/11/25/08/1124112508.db2.gz DYPDZZWSUFQDHD-UHFFFAOYSA-N 1 0 290.794 3.686 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]CCCC2CCC2)c1 ZINC000689040498 1129174357 /nfs/dbraw/zinc/17/43/57/1129174357.db2.gz SCGNRUMRACDQTF-GFCCVEGCSA-N 1 0 263.381 3.632 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCc2ccc(F)cc21 ZINC000122741255 1124529861 /nfs/dbraw/zinc/52/98/61/1124529861.db2.gz MJEQAKRKYKBLIK-IBGZPJMESA-N 1 0 298.405 3.977 20 10 CHCDRO CCN(C)c1ccc([C@H](C)NCc2ncc(C)s2)cc1 ZINC000122884436 1124543991 /nfs/dbraw/zinc/54/39/91/1124543991.db2.gz ASXAVKXZOQKKFU-ZDUSSCGKSA-N 1 0 289.448 3.758 20 10 CHCDRO C[C@H]([NH2+]CC1(O)CCCCC1)c1ccc2ccccc2c1O ZINC000123318337 1124583452 /nfs/dbraw/zinc/58/34/52/1124583452.db2.gz ZCBFQZAXYQSLEH-AWEZNQCLSA-N 1 0 299.414 3.891 20 10 CHCDRO Cc1cc(F)ccc1[C@@H](C)[NH2+]Cc1ccc(N)cc1 ZINC001120371546 1131274786 /nfs/dbraw/zinc/27/47/86/1131274786.db2.gz IPXJWXDYNIZSPJ-GFCCVEGCSA-N 1 0 258.340 3.567 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H]2C[C@@H]3CCC[C@@H]3O2)c(O)c1 ZINC000872106852 1124685311 /nfs/dbraw/zinc/68/53/11/1124685311.db2.gz IKRHMVKEMNOEDC-JKQORVJESA-N 1 0 289.419 3.617 20 10 CHCDRO CC[C@H]([NH2+]CC1(OC(C)C)CCC1)c1ccccc1O ZINC000872116559 1124687764 /nfs/dbraw/zinc/68/77/64/1124687764.db2.gz SHKBNHHAHZRCCT-HNNXBMFYSA-N 1 0 277.408 3.781 20 10 CHCDRO Cc1nccnc1[C@H](C)[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000872132362 1124691922 /nfs/dbraw/zinc/69/19/22/1124691922.db2.gz FFJWYZHNCOFLNA-ONGXEEELSA-N 1 0 291.782 3.556 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CC)c1ccccc1O)[C@H](O)c1ccccc1 ZINC000872133526 1124692413 /nfs/dbraw/zinc/69/24/13/1124692413.db2.gz QOEUUTXYIRUSSI-YQVWRLOYSA-N 1 0 299.414 3.945 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1ccccc1O)[C@@H](O)c1ccccc1 ZINC000872134420 1124692562 /nfs/dbraw/zinc/69/25/62/1124692562.db2.gz WCJZVVWXUDRNIQ-OWQGQXMQSA-N 1 0 285.387 3.555 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](C)c2nccnc2C)cc1 ZINC000872133190 1124692605 /nfs/dbraw/zinc/69/26/05/1124692605.db2.gz LLUBFNSDTKJVQP-HIFRSBDPSA-N 1 0 298.434 3.653 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1nccnc1C)c1ccc(N(C)C)cc1 ZINC000872135037 1124694048 /nfs/dbraw/zinc/69/40/48/1124694048.db2.gz UUKZYYPWJJBMEO-PBHICJAKSA-N 1 0 298.434 3.653 20 10 CHCDRO C[C@H]1CCC[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000124296766 1124733213 /nfs/dbraw/zinc/73/32/13/1124733213.db2.gz HDRIOQCMHDMENF-HNNXBMFYSA-N 1 0 258.409 3.661 20 10 CHCDRO CCCOc1ccc(C[NH2+]Cc2cccc(C)n2)cc1C ZINC000873016012 1124734825 /nfs/dbraw/zinc/73/48/25/1124734825.db2.gz BWKKDHJSZJDYNH-UHFFFAOYSA-N 1 0 284.403 3.777 20 10 CHCDRO CCCOc1ccc(C[NH2+]C2CCC(C)(O)CC2)cc1C ZINC000873069929 1124736423 /nfs/dbraw/zinc/73/64/23/1124736423.db2.gz SFCOROVOSXYJTI-UHFFFAOYSA-N 1 0 291.435 3.567 20 10 CHCDRO C[C@H]([NH2+]CC[C@H]1CNc2ccccc21)c1ccccc1O ZINC000873236878 1124753478 /nfs/dbraw/zinc/75/34/78/1124753478.db2.gz JYFASCWDWIXKLR-KBPBESRZSA-N 1 0 282.387 3.642 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccc(F)cc1)c1ccccc1O ZINC000019904139 1124766826 /nfs/dbraw/zinc/76/68/26/1124766826.db2.gz AFJPZMQZNCZHMP-INIZCTEOSA-N 1 0 273.351 3.815 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccccc1)c1ccccc1O ZINC000019919944 1124769977 /nfs/dbraw/zinc/76/99/77/1124769977.db2.gz OVTQFZICDDDVKP-INIZCTEOSA-N 1 0 255.361 3.676 20 10 CHCDRO C[C@@H]([NH2+]C1CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000020550935 1124850775 /nfs/dbraw/zinc/85/07/75/1124850775.db2.gz VVDGCXCZWFLNBF-GFCCVEGCSA-N 1 0 262.372 3.629 20 10 CHCDRO CCC(CC)[C@H](C[NH2+][C@@H](C)c1ccc(C)cc1O)N(C)C ZINC000021521145 1124932593 /nfs/dbraw/zinc/93/25/93/1124932593.db2.gz XHCKRADYTMRTNU-YOEHRIQHSA-N 1 0 292.467 3.718 20 10 CHCDRO COc1ccc([C@@H]([NH2+]Cc2ccc(C)cc2O)C2CC2)cc1 ZINC000876904867 1124988174 /nfs/dbraw/zinc/98/81/74/1124988174.db2.gz MJLMXPDYMSPNKP-IBGZPJMESA-N 1 0 297.398 3.950 20 10 CHCDRO CN(C)c1ccc(C[NH2+]Cc2cc3ccccc3n2C)cc1 ZINC000876906398 1124989885 /nfs/dbraw/zinc/98/98/85/1124989885.db2.gz YLKFENWVLMGTJI-UHFFFAOYSA-N 1 0 293.414 3.534 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]Cc1ccc(OC(C)C)cc1 ZINC000876925647 1124990273 /nfs/dbraw/zinc/99/02/73/1124990273.db2.gz AOBXQVSLXXWFOA-UHFFFAOYSA-N 1 0 285.387 3.778 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](c2ccccc2)[C@@H]2CCCO2)c(O)c1 ZINC000876976497 1124995541 /nfs/dbraw/zinc/99/55/41/1124995541.db2.gz QLXHYCMXEIMKHP-RBUKOAKNSA-N 1 0 297.398 3.711 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H]2CCCOc3ccccc32)c(O)c1 ZINC000876999788 1124996736 /nfs/dbraw/zinc/99/67/36/1124996736.db2.gz YVWBSKZDMRNRMM-MRXNPFEDSA-N 1 0 283.371 3.704 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H]2CSc3ccccc32)c(O)c1 ZINC000877047794 1125004310 /nfs/dbraw/zinc/00/43/10/1125004310.db2.gz DJDREGNHVHXHAZ-CQSZACIVSA-N 1 0 271.385 3.637 20 10 CHCDRO Cc1csc([C@H]([NH2+]Cc2ccc(C)cc2O)C2CC2)n1 ZINC000877066821 1125005796 /nfs/dbraw/zinc/00/57/96/1125005796.db2.gz UXTWUETVRORQFA-OAHLLOKOSA-N 1 0 288.416 3.706 20 10 CHCDRO Cc1cccc(O)c1C[NH2+][C@H]1CCOC2(CCCCC2)C1 ZINC000877087439 1125008665 /nfs/dbraw/zinc/00/86/65/1125008665.db2.gz LYKGGFGUSKPVFG-HNNXBMFYSA-N 1 0 289.419 3.672 20 10 CHCDRO Cc1ccc(C[NH2+][C@H]2COc3ccc(Cl)cc32)c(O)c1 ZINC000877090649 1125009079 /nfs/dbraw/zinc/00/90/79/1125009079.db2.gz WTWSUUNFMFLIRF-AWEZNQCLSA-N 1 0 289.762 3.577 20 10 CHCDRO C[C@@H]([NH2+]Cc1cc(Cl)ccc1O)C1CC(F)(F)C1 ZINC000529619400 1125019648 /nfs/dbraw/zinc/01/96/48/1125019648.db2.gz XHFXRULPWHDAKZ-MRVPVSSYSA-N 1 0 275.726 3.569 20 10 CHCDRO Cc1ccc(C[N@@H+]2C[C@H](C)C[C@H]2c2cccnc2)c(O)c1 ZINC000877343168 1125023364 /nfs/dbraw/zinc/02/33/64/1125023364.db2.gz VXDAANLUIBIBSB-PBHICJAKSA-N 1 0 282.387 3.679 20 10 CHCDRO Cc1cccc(O)c1C[NH2+][C@@H]1CCO[C@H](c2ccccc2)C1 ZINC000877376540 1125024273 /nfs/dbraw/zinc/02/42/73/1125024273.db2.gz JLMJIBWXKHVIMQ-APWZRJJASA-N 1 0 297.398 3.711 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]Cc1ccc(C(F)F)cc1 ZINC000877376597 1125024902 /nfs/dbraw/zinc/02/49/02/1125024902.db2.gz VCFMYBPNHYVBEX-UHFFFAOYSA-N 1 0 277.314 3.928 20 10 CHCDRO Cc1ccc(C[N@@H+]2C[C@H](C)C[C@@H]2c2cccnc2)c(O)c1 ZINC000877343170 1125024957 /nfs/dbraw/zinc/02/49/57/1125024957.db2.gz VXDAANLUIBIBSB-RHSMWYFYSA-N 1 0 282.387 3.679 20 10 CHCDRO Cc1ccc(C[NH2+]C(C)(C)CC(F)(F)F)c(O)c1 ZINC000877461027 1125029891 /nfs/dbraw/zinc/02/98/91/1125029891.db2.gz WOTILASSUXYKBN-UHFFFAOYSA-N 1 0 261.287 3.521 20 10 CHCDRO CCCN(Cc1nc2ccccc2o1)c1ccc(C[NH3+])cc1 ZINC000877477597 1125032047 /nfs/dbraw/zinc/03/20/47/1125032047.db2.gz FLHCGBBBVSHDGT-UHFFFAOYSA-N 1 0 295.386 3.703 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]C[C@H]1CC[C@@H](c2ccccc2)O1 ZINC000877539748 1125041136 /nfs/dbraw/zinc/04/11/36/1125041136.db2.gz RXLXVWOPBWUCHE-APWZRJJASA-N 1 0 297.398 3.711 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(C)cc2F)c1 ZINC000877532399 1125041258 /nfs/dbraw/zinc/04/12/58/1125041258.db2.gz FVLPHUVYVWQPIH-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+]1CC(C)(C)[C@H]1c1ccncc1 ZINC000877548694 1125042479 /nfs/dbraw/zinc/04/24/79/1125042479.db2.gz RIUVIMCIOMSHFK-QGZVFWFLSA-N 1 0 282.387 3.679 20 10 CHCDRO CSC1CC[NH+](Cc2cc(Cl)c(C)cc2O)CC1 ZINC000877663261 1125061512 /nfs/dbraw/zinc/06/15/12/1125061512.db2.gz MSNXXFSTWFFGEK-UHFFFAOYSA-N 1 0 285.840 3.681 20 10 CHCDRO CC(C)O[C@H](C[N@@H+]1Cc2cccc(O)c2C1)c1ccccc1 ZINC000877703205 1125066272 /nfs/dbraw/zinc/06/62/72/1125066272.db2.gz WDJCZMFFBDAWIR-LJQANCHMSA-N 1 0 297.398 3.874 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H](C)c2ccccc2O)cc1Cl ZINC000877755816 1125073397 /nfs/dbraw/zinc/07/33/97/1125073397.db2.gz NPQONMHKHXQIGX-LLVKDONJSA-N 1 0 291.778 3.910 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc([C@H]2C[C@H]2C)o1)c1ccccc1O ZINC000877756602 1125074204 /nfs/dbraw/zinc/07/42/04/1125074204.db2.gz XJIHRHBKAQPLPK-JMSVASOKSA-N 1 0 271.360 3.959 20 10 CHCDRO CC(C)c1ncc(C[NH2+][C@@H](C)c2ccccc2O)s1 ZINC000877757381 1125075042 /nfs/dbraw/zinc/07/50/42/1125075042.db2.gz VQLWZLUFNHZION-NSHDSACASA-N 1 0 276.405 3.823 20 10 CHCDRO C[C@@H]([NH2+]Cc1cnc(C2CC2)s1)c1ccccc1O ZINC000877756579 1125075535 /nfs/dbraw/zinc/07/55/35/1125075535.db2.gz VCHZDZNJXKVMJW-SNVBAGLBSA-N 1 0 274.389 3.577 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@H]2CC[C@@H](c3ccccc3)C2)c1 ZINC000127330722 1125177691 /nfs/dbraw/zinc/17/76/91/1125177691.db2.gz XPRABYWNKBOFEB-WBVHZDCISA-N 1 0 297.398 3.827 20 10 CHCDRO COc1cccc(C[N@@H+]2C[C@@H](c3ccccc3)C[C@H]2C)c1O ZINC000127579174 1125202509 /nfs/dbraw/zinc/20/25/09/1125202509.db2.gz LVSXDCKMRQSJHT-PBHICJAKSA-N 1 0 297.398 3.779 20 10 CHCDRO C[C@@H]([NH2+]CCCCOC(C)(C)C)c1ccccc1O ZINC000879649524 1125222123 /nfs/dbraw/zinc/22/21/23/1125222123.db2.gz VMIXUFRXGGXACN-CYBMUJFWSA-N 1 0 265.397 3.638 20 10 CHCDRO CCN(C)c1ccc(C[NH2+][C@H](C)c2ccccc2O)cc1 ZINC000879649553 1125222826 /nfs/dbraw/zinc/22/28/26/1125222826.db2.gz VYGBBRCLSQCFHR-CQSZACIVSA-N 1 0 284.403 3.699 20 10 CHCDRO CC[C@H](C[NH2+][C@@H](C)c1ccccc1O)CC(F)F ZINC000879650182 1125224003 /nfs/dbraw/zinc/22/40/03/1125224003.db2.gz NJOOWTNSLUIKRK-QWRGUYRKSA-N 1 0 257.324 3.724 20 10 CHCDRO C[C@H]([NH2+]Cc1cc(C(F)(F)F)co1)c1ccccc1O ZINC000879650328 1125224542 /nfs/dbraw/zinc/22/45/42/1125224542.db2.gz UXLDOOHTEJBBSK-VIFPVBQESA-N 1 0 285.265 3.855 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)c2ccccc2O)nc1Cl ZINC000879650176 1125224691 /nfs/dbraw/zinc/22/46/91/1125224691.db2.gz NDHGPXVLXSGCOB-LLVKDONJSA-N 1 0 276.767 3.600 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+][C@@H]2CCCC[C@H]2C)c1O ZINC000228669747 1125250548 /nfs/dbraw/zinc/25/05/48/1125250548.db2.gz GCLKTHRNRQOHNM-ZWNOBZJWSA-N 1 0 283.799 3.723 20 10 CHCDRO CCc1cccc(C[NH2+][C@@]2(C)CCOc3ccccc32)c1O ZINC000897386136 1125280870 /nfs/dbraw/zinc/28/08/70/1125280870.db2.gz RNSRLXDASMOXPO-IBGZPJMESA-N 1 0 297.398 3.742 20 10 CHCDRO COc1ccc([C@@H](C)[NH2+]Cc2cc(C)ccc2O)cc1C ZINC000897417077 1125319490 /nfs/dbraw/zinc/31/94/90/1125319490.db2.gz BXKYNKOANIKQJZ-CQSZACIVSA-N 1 0 285.387 3.868 20 10 CHCDRO Cc1ccc(O)c(C[N@H+]2C[C@@H](c3ccccc3)OC[C@@H]2C)c1 ZINC000130667632 1125366107 /nfs/dbraw/zinc/36/61/07/1125366107.db2.gz CZCYRQQWZGTWTL-KXBFYZLASA-N 1 0 297.398 3.663 20 10 CHCDRO COc1cccc(C[N@H+](C)[C@H](C)c2ccc(C)cc2)c1O ZINC000130808483 1125369187 /nfs/dbraw/zinc/36/91/87/1125369187.db2.gz JJSIZSUGHFRTIP-CQSZACIVSA-N 1 0 285.387 3.902 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(SC)o2)c1 ZINC000883156408 1125374291 /nfs/dbraw/zinc/37/42/91/1125374291.db2.gz NIPOUJXIVVBDEY-SNVBAGLBSA-N 1 0 293.388 3.567 20 10 CHCDRO C[C@H]([NH2+]CC(C)(C)CC(F)F)c1cc(F)ccc1O ZINC000883259501 1125387214 /nfs/dbraw/zinc/38/72/14/1125387214.db2.gz OOKUFTKYLDYBFH-VIFPVBQESA-N 1 0 275.314 3.863 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CC[C@H]2CCCC2(F)F)c1O ZINC000883274542 1125390641 /nfs/dbraw/zinc/39/06/41/1125390641.db2.gz NTJGONBEOLYEPG-VXGBXAGGSA-N 1 0 299.361 3.877 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CC[C@@H]2CCCC2(F)F)c1O ZINC000883274541 1125390870 /nfs/dbraw/zinc/39/08/70/1125390870.db2.gz NTJGONBEOLYEPG-RYUDHWBXSA-N 1 0 299.361 3.877 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(C)nc2Cl)c1 ZINC000883301966 1125392660 /nfs/dbraw/zinc/39/26/60/1125392660.db2.gz NKFATYXWJFAVSB-LBPRGKRZSA-N 1 0 290.794 3.908 20 10 CHCDRO CC[C@H]([NH2+][C@H]1C[C@@H](COC)C1)c1cc(Cl)ccc1O ZINC000883319426 1125395711 /nfs/dbraw/zinc/39/57/11/1125395711.db2.gz BIDNMOBSGIHWET-SUHUHFCYSA-N 1 0 283.799 3.511 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2cc(O)ccc2Cl)c1 ZINC000883326193 1125396881 /nfs/dbraw/zinc/39/68/81/1125396881.db2.gz VDLBGXXUYWGEPV-NSHDSACASA-N 1 0 291.778 3.910 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CC)c1ccc(C)cc1O)[C@@H]1CCCOC1 ZINC000883353278 1125400448 /nfs/dbraw/zinc/40/04/48/1125400448.db2.gz RNIGAGAPSNQZEG-OIISXLGYSA-N 1 0 291.435 3.947 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCC2(CCC2)O1)c1cc(Cl)ccc1O ZINC000883357961 1125401275 /nfs/dbraw/zinc/40/12/75/1125401275.db2.gz YKHJOTCSVMHVIV-YPMHNXCESA-N 1 0 295.810 3.798 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H]2c3ccccc3CC[C@@H]2F)c1 ZINC000883383090 1125406773 /nfs/dbraw/zinc/40/67/73/1125406773.db2.gz SSXNJFOEZHXEHZ-FUHWJXTLSA-N 1 0 285.362 3.816 20 10 CHCDRO COC[C@@H](C)[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000131950506 1125412354 /nfs/dbraw/zinc/41/23/54/1125412354.db2.gz TYNOMWQJQPAKCD-HZPDHXFCSA-N 1 0 290.451 3.753 20 10 CHCDRO CC[C@H](C)[C@H](C)[NH2+]CCCSc1nccs1 ZINC000132160831 1125415126 /nfs/dbraw/zinc/41/51/26/1125415126.db2.gz CUVNTRXMBRZUNJ-QWRGUYRKSA-N 1 0 258.456 3.650 20 10 CHCDRO C[C@@H]([NH2+]CCCSc1nccs1)c1ccco1 ZINC000132254146 1125416658 /nfs/dbraw/zinc/41/66/58/1125416658.db2.gz CXKSSOAXNXMRIE-SNVBAGLBSA-N 1 0 268.407 3.569 20 10 CHCDRO C[C@H]1CCCCC[C@@H]1[NH2+]Cc1ccc(N(C)C)cc1 ZINC000088507840 1129206964 /nfs/dbraw/zinc/20/69/64/1129206964.db2.gz UUNSVBQXCUHFSS-YOEHRIQHSA-N 1 0 260.425 3.811 20 10 CHCDRO Cc1ccc(O)c(C[N@H+]2C[C@H](c3ccccc3)OC[C@H]2C)c1 ZINC000245700140 1129218966 /nfs/dbraw/zinc/21/89/66/1129218966.db2.gz CZCYRQQWZGTWTL-DNVCBOLYSA-N 1 0 297.398 3.663 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]Cc1ccccc1Cl)CC2 ZINC000296036763 1129220647 /nfs/dbraw/zinc/22/06/47/1129220647.db2.gz QKACMYNNYUHZLU-AWEZNQCLSA-N 1 0 273.763 3.823 20 10 CHCDRO COc1ccccc1[C@H](C)[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000296095482 1129220820 /nfs/dbraw/zinc/22/08/20/1129220820.db2.gz UCKQXESTYMORDI-SWLSCSKDSA-N 1 0 283.371 3.739 20 10 CHCDRO CC(F)(F)CCC[NH2+]Cc1c(O)cccc1Cl ZINC000296027944 1129220829 /nfs/dbraw/zinc/22/08/29/1129220829.db2.gz NAIRDGAPOWQXKK-UHFFFAOYSA-N 1 0 263.715 3.571 20 10 CHCDRO Cc1cc(C[N@@H+]2CCc3ccccc3C2)ccc1N(C)C ZINC001139670129 1131359213 /nfs/dbraw/zinc/35/92/13/1131359213.db2.gz XHFAMOAORKOACP-UHFFFAOYSA-N 1 0 280.415 3.619 20 10 CHCDRO C[C@H]([NH2+]CCCC(C)(F)F)c1ccc(N(C)C)cc1 ZINC000297368661 1129225180 /nfs/dbraw/zinc/22/51/80/1129225180.db2.gz QJEBZVVKFUPLLF-LBPRGKRZSA-N 1 0 270.367 3.839 20 10 CHCDRO Cc1cccc(C[N@H+]2C[C@H](C)O[C@@H](c3ccccc3)C2)c1O ZINC000245871439 1129230529 /nfs/dbraw/zinc/23/05/29/1129230529.db2.gz RQYPLEIQMWUURB-MAUKXSAKSA-N 1 0 297.398 3.663 20 10 CHCDRO COCc1ccccc1C[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000037762739 1129266404 /nfs/dbraw/zinc/26/64/04/1129266404.db2.gz QLWRKGVHEJTIAL-AWEZNQCLSA-N 1 0 285.387 3.698 20 10 CHCDRO Cc1ccccc1C[C@H](C)[NH2+][C@@H](C)c1ccccc1O ZINC000037776898 1129268877 /nfs/dbraw/zinc/26/88/77/1129268877.db2.gz SOQUKHBTNJJRKI-GJZGRUSLSA-N 1 0 269.388 3.982 20 10 CHCDRO COc1cccc(C[NH2+]Cc2cccc3ccccc32)c1O ZINC000378882025 1129284437 /nfs/dbraw/zinc/28/44/37/1129284437.db2.gz HYEVHCDAONJHFW-UHFFFAOYSA-N 1 0 293.366 3.844 20 10 CHCDRO Cc1ncc([C@@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)s1 ZINC000090406431 1129287780 /nfs/dbraw/zinc/28/77/80/1129287780.db2.gz ZIZLPENOHVMKEX-SNVBAGLBSA-N 1 0 293.411 3.507 20 10 CHCDRO Cc1ncc([C@@H](C)[NH2+]CCCSc2nccs2)s1 ZINC000090417496 1129289342 /nfs/dbraw/zinc/28/93/42/1129289342.db2.gz INVRPGJISVJDQM-SECBINFHSA-N 1 0 299.490 3.741 20 10 CHCDRO COc1cccc(C[NH2+]CC[C@H]2CCCC[C@H]2C)c1O ZINC000734005020 1129291307 /nfs/dbraw/zinc/29/13/07/1129291307.db2.gz OCEPZALUVOODLN-ZIAGYGMSSA-N 1 0 277.408 3.707 20 10 CHCDRO CN(C)c1ccc(C[NH+](C2CCC2)C2CCC2)cc1 ZINC000795469622 1129323187 /nfs/dbraw/zinc/32/31/87/1129323187.db2.gz CGPPBAAJXBGCPY-UHFFFAOYSA-N 1 0 258.409 3.660 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1ccc(N(C)CC)cc1)[C@H]1CCCO1 ZINC000090859400 1129332519 /nfs/dbraw/zinc/33/25/19/1129332519.db2.gz SGXMGMSAAIOPLD-JCGIZDLHSA-N 1 0 290.451 3.751 20 10 CHCDRO CS[C@H]1CCC[C@@H]([NH2+]Cc2ccc(N(C)C)c(F)c2)C1 ZINC000735324592 1129339179 /nfs/dbraw/zinc/33/91/79/1129339179.db2.gz 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/nfs/dbraw/zinc/42/11/40/1129421140.db2.gz QXGUYJRCLQFRBM-SJORKVTESA-N 1 0 291.435 3.644 20 10 CHCDRO C[C@@H](c1cccc(O)c1)[N@H+](C)Cc1cc(Cl)ccc1O ZINC000093315667 1129421579 /nfs/dbraw/zinc/42/15/79/1129421579.db2.gz CWMZJBJNVOWOIM-NSHDSACASA-N 1 0 291.778 3.944 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccccc1C)c1ccccc1O ZINC000094182981 1129441430 /nfs/dbraw/zinc/44/14/30/1129441430.db2.gz BQXARZSDLDXXOA-QGZVFWFLSA-N 1 0 269.388 3.984 20 10 CHCDRO CO[C@H](C)C[N@H+](C)Cc1cc2oc3ccccc3c2cc1O ZINC000795752556 1129446923 /nfs/dbraw/zinc/44/69/23/1129446923.db2.gz UGABURQZTGOABX-GFCCVEGCSA-N 1 0 299.370 3.758 20 10 CHCDRO C[C@@H]([NH2+]CCCc1ccccc1)c1cc(F)ccc1O ZINC000094616828 1129448346 /nfs/dbraw/zinc/44/83/46/1129448346.db2.gz NWIPSKQJXWVMHQ-CYBMUJFWSA-N 1 0 273.351 3.815 20 10 CHCDRO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1cc2c(cc1O)CCC2 ZINC000742159867 1129468756 /nfs/dbraw/zinc/46/87/56/1129468756.db2.gz TYUQQUQCXMJCJH-CQSZACIVSA-N 1 0 293.410 3.828 20 10 CHCDRO CCCCC[C@@H](CCC)[NH2+]Cc1ccc(O)cc1O ZINC001258664165 1129472561 /nfs/dbraw/zinc/47/25/61/1129472561.db2.gz GRRKZXMLBICOKG-CQSZACIVSA-N 1 0 265.397 3.936 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H](C)COc2ccccc2)cc1C ZINC000742369710 1129474901 /nfs/dbraw/zinc/47/49/01/1129474901.db2.gz OWIAXELLRJQIFE-HNNXBMFYSA-N 1 0 285.387 3.566 20 10 CHCDRO CCOc1ccc(C[NH2+][C@@H]2CC[C@H]3CCC[C@H]3C2)c(O)c1 ZINC000742378730 1129476195 /nfs/dbraw/zinc/47/61/95/1129476195.db2.gz LIXKBBCSGYQMNB-IJEWVQPXSA-N 1 0 289.419 3.849 20 10 CHCDRO CC[N@H+](Cc1c(O)ccc2ccncc21)[C@@H](C)C(C)C ZINC000742549994 1129487438 /nfs/dbraw/zinc/48/74/38/1129487438.db2.gz JWAVMOJGXPFTQW-ZDUSSCGKSA-N 1 0 272.392 3.807 20 10 CHCDRO Oc1ccccc1C[N@H+](CCC1CC1)C1CCCC1 ZINC000743848403 1129539128 /nfs/dbraw/zinc/53/91/28/1129539128.db2.gz OGHVYMBKBZPEKW-UHFFFAOYSA-N 1 0 259.393 3.937 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C[C@@H](OC)C(C)(C)C)cc1 ZINC000744448472 1129578031 /nfs/dbraw/zinc/57/80/31/1129578031.db2.gz JTOJTLJJPVCVNC-QGZVFWFLSA-N 1 0 292.467 3.684 20 10 CHCDRO CCCCCC[N@@H+]1CCCN(c2ccc(OC)cc2)CC1 ZINC000303937755 1129581996 /nfs/dbraw/zinc/58/19/96/1129581996.db2.gz YBCHXVMLXYKDRC-UHFFFAOYSA-N 1 0 290.451 3.788 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CCC[C@@H](C)[C@H]2C)c1O ZINC000252871511 1129599895 /nfs/dbraw/zinc/59/98/95/1129599895.db2.gz UOJRBWXJCDTQKG-GHMZBOCLSA-N 1 0 283.799 3.675 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)c1ccccc1 ZINC000746047181 1129623265 /nfs/dbraw/zinc/62/32/65/1129623265.db2.gz JSBKYYNQTMRWNK-HNNXBMFYSA-N 1 0 268.404 3.912 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]CCc2nc3ccccc3s2)c1 ZINC000746404001 1129656485 /nfs/dbraw/zinc/65/64/85/1129656485.db2.gz HRKIIBLXALSZEY-UHFFFAOYSA-N 1 0 298.411 3.643 20 10 CHCDRO CC[C@H](C[C@H](C)CO)[NH2+][C@@H](C)c1ccc(N(C)CC)cc1 ZINC000766361412 1129660253 /nfs/dbraw/zinc/66/02/53/1129660253.db2.gz VQBBGWIOFZKTFP-YQQAZPJKSA-N 1 0 292.467 3.590 20 10 CHCDRO Cc1ccc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)nc1 ZINC000746449054 1129665316 /nfs/dbraw/zinc/66/53/16/1129665316.db2.gz GWFHQZUYHRURGS-UHFFFAOYSA-N 1 0 297.446 3.867 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H](C)c1ccncc1)c1ccc(N(C)C)cc1 ZINC000766490983 1129669586 /nfs/dbraw/zinc/66/95/86/1129669586.db2.gz XMFNFMVDBYKEKB-HUUCEWRRSA-N 1 0 283.419 3.602 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1C[C@H](OC)C1(C)C)c1ccc(N(C)C)cc1 ZINC000766529443 1129684031 /nfs/dbraw/zinc/68/40/31/1129684031.db2.gz PVWVQYDPWGEOKR-BBWFWOEESA-N 1 0 290.451 3.607 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](O)[C@@H](C)c1ccccc1)c1ccccc1O ZINC000828687179 1131396290 /nfs/dbraw/zinc/39/62/90/1131396290.db2.gz GCAQSEAIYRPXCC-UCLAIMLFSA-N 1 0 299.414 3.598 20 10 CHCDRO CC(C)C[C@@H](Cc1ccccc1)[NH2+]Cc1cccc(O)c1O ZINC001169062018 1129694359 /nfs/dbraw/zinc/69/43/59/1129694359.db2.gz PSKSPDSXPQZTGB-KRWDZBQOSA-N 1 0 299.414 3.845 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CCOC(C)(C)C)cc1F ZINC000740004447 1129740061 /nfs/dbraw/zinc/74/00/61/1129740061.db2.gz NEHJWLAPHJWUFG-UHFFFAOYSA-N 1 0 296.430 3.577 20 10 CHCDRO C[C@H]1CSC[C@@H]1[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000796481218 1129741818 /nfs/dbraw/zinc/74/18/18/1129741818.db2.gz CPDZBNWHUZWOHS-GUYCJALGSA-N 1 0 299.439 3.900 20 10 CHCDRO C[C@@H]([NH2+]C[C@]1(C)CC1(Cl)Cl)c1ccccc1O ZINC000828655697 1131394723 /nfs/dbraw/zinc/39/47/23/1131394723.db2.gz GJTYXPGTSYWAQQ-SKDRFNHKSA-N 1 0 274.191 3.627 20 10 CHCDRO Cc1ccc([C@@H](O)[C@@H](C)[NH2+]Cc2cc(C)c(C)cc2O)cc1 ZINC000796484416 1129748518 /nfs/dbraw/zinc/74/85/18/1129748518.db2.gz YGZBPXYVAUNJHL-BEFAXECRSA-N 1 0 299.414 3.529 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)[C@@H](C)c2cnccn2)cc1 ZINC000767299406 1129785040 /nfs/dbraw/zinc/78/50/40/1129785040.db2.gz PVBFHJABKJBDAS-HNNXBMFYSA-N 1 0 298.434 3.516 20 10 CHCDRO CCOc1ccc(C[N@H+](C)Cc2cc(C)ccc2O)cc1 ZINC000768162733 1129837643 /nfs/dbraw/zinc/83/76/43/1129837643.db2.gz GVNMQNPPKVDGDG-UHFFFAOYSA-N 1 0 285.387 3.731 20 10 CHCDRO CC[N@H+](Cc1cccs1)Cc1ccc(N(C)C)c(F)c1 ZINC000768199139 1129839533 /nfs/dbraw/zinc/83/95/33/1129839533.db2.gz ZYMHGDHNLHZSTM-UHFFFAOYSA-N 1 0 292.423 3.975 20 10 CHCDRO CCOc1ccc(C[N@H+](CC)Cc2cccs2)c(O)c1 ZINC000768197779 1129843706 /nfs/dbraw/zinc/84/37/06/1129843706.db2.gz NRAPPMYJFISOOC-UHFFFAOYSA-N 1 0 291.416 3.875 20 10 CHCDRO CCOc1ccc(C[N@H+](C)[C@@H]2CCc3ccccc32)c(O)c1 ZINC000768232415 1129845069 /nfs/dbraw/zinc/84/50/69/1129845069.db2.gz AAKXEJMSIPHQHM-GOSISDBHSA-N 1 0 297.398 3.910 20 10 CHCDRO Cc1ccc(O)c(C[N@H+](C)Cc2ccc(F)cc2F)c1 ZINC000768233094 1129845616 /nfs/dbraw/zinc/84/56/16/1129845616.db2.gz KGDBEMQXRLXQDW-UHFFFAOYSA-N 1 0 277.314 3.611 20 10 CHCDRO Cc1ccc(O)c(C[N@H+](C)CCCc2ccccc2)c1 ZINC000768336007 1129850856 /nfs/dbraw/zinc/85/08/56/1129850856.db2.gz FGYXCOFVUCMBDR-UHFFFAOYSA-N 1 0 269.388 3.765 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1cc(C)ccc1O)[C@H]1CCCOC1 ZINC000723991087 1129851743 /nfs/dbraw/zinc/85/17/43/1129851743.db2.gz ZANHWFQCEXIXJZ-YCPHGPKFSA-N 1 0 277.408 3.556 20 10 CHCDRO C[C@H]([NH2+]Cc1ccccc1O)[C@H]1CC2CCC1CC2 ZINC000381987310 1129853760 /nfs/dbraw/zinc/85/37/60/1129853760.db2.gz XBLKXEAFJJSWKV-WLIAPVHPSA-N 1 0 259.393 3.697 20 10 CHCDRO C[C@@H]([NH2+]CC[C@H](C)F)c1cc(Br)ccc1O ZINC000382155175 1129854788 /nfs/dbraw/zinc/85/47/88/1129854788.db2.gz QZBJXBYRVGLUSW-DTWKUNHWSA-N 1 0 290.176 3.553 20 10 CHCDRO CCC[N@@H+](Cc1ccc(OCC)cc1O)CC(C)C ZINC000768480224 1129857513 /nfs/dbraw/zinc/85/75/13/1129857513.db2.gz ZRCGICPTJMPKOV-UHFFFAOYSA-N 1 0 265.397 3.659 20 10 CHCDRO COc1cc(C[N@@H+]2CCC[C@@H]2CC(C)C)c(O)cc1C ZINC000768446669 1129857581 /nfs/dbraw/zinc/85/75/81/1129857581.db2.gz ZOHAFGQMLYJRDB-OAHLLOKOSA-N 1 0 277.408 3.720 20 10 CHCDRO COc1cc(C[N@@H+]2C[C@H](C)[C@@H]2c2ccccc2)c(O)cc1C ZINC000768467095 1129858828 /nfs/dbraw/zinc/85/88/28/1129858828.db2.gz YKTUGBRXJYHJPN-IFXJQAMLSA-N 1 0 297.398 3.902 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC000800274136 1129861513 /nfs/dbraw/zinc/86/15/13/1129861513.db2.gz KCEHQMHGZLJCDY-JTQLQIEISA-N 1 0 289.753 3.961 20 10 CHCDRO COC[C@@H]1CCCC[N@H+](Cc2cc(Cl)cc(C)c2O)C1 ZINC000768541517 1129862582 /nfs/dbraw/zinc/86/25/82/1129862582.db2.gz ORSHMNSCFTWTLP-CYBMUJFWSA-N 1 0 297.826 3.603 20 10 CHCDRO C[N@H+](Cc1ccccc1O)Cc1ccnc2ccccc12 ZINC000768874010 1129877662 /nfs/dbraw/zinc/87/76/62/1129877662.db2.gz XVQIFQKBZULRAA-UHFFFAOYSA-N 1 0 278.355 3.572 20 10 CHCDRO CCc1ccc(C[N@H+](C)Cc2ccccc2O)s1 ZINC000768872116 1129877983 /nfs/dbraw/zinc/87/79/83/1129877983.db2.gz DDYCTSHAXTZRLI-UHFFFAOYSA-N 1 0 261.390 3.648 20 10 CHCDRO C[N@@H+](Cc1ccccc1O)C[C@H]1C[C@H]1c1ccccc1 ZINC000768873539 1129878232 /nfs/dbraw/zinc/87/82/32/1129878232.db2.gz PJSJDGDNUOMNRF-SJORKVTESA-N 1 0 267.372 3.628 20 10 CHCDRO CCSCCC[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000800492106 1129879604 /nfs/dbraw/zinc/87/96/04/1129879604.db2.gz BXSQCQSGCQTLTB-CMPLNLGQSA-N 1 0 283.412 3.812 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1Cc2ccc(Cl)cc2C1)c1ccccc1O ZINC000800496239 1129880482 /nfs/dbraw/zinc/88/04/82/1129880482.db2.gz UMPACILOIJIFRV-IAQYHMDHSA-N 1 0 287.790 3.864 20 10 CHCDRO CC(C)(C[NH2+]Cc1c(O)cccc1Cl)C(F)(F)F ZINC000800888491 1129896083 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CCOc1ccc(C[N@@H+]2CC[C@@H](CC(C)C)C2)c(O)c1 ZINC000769402110 1129905912 /nfs/dbraw/zinc/90/59/12/1129905912.db2.gz AXXRBNWDFNMIJL-AWEZNQCLSA-N 1 0 277.408 3.659 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CC[C@@H](CC(C)C)C2)c1 ZINC000769402551 1129906007 /nfs/dbraw/zinc/90/60/07/1129906007.db2.gz JIYSSPGJJUGDTD-AWEZNQCLSA-N 1 0 277.408 3.659 20 10 CHCDRO CCOc1cccc(C[N@@H+]2[C@H](C)C[C@@H]3CCCC[C@@H]32)c1O ZINC000769404053 1129906666 /nfs/dbraw/zinc/90/66/66/1129906666.db2.gz IGOVIEDRAPVRBZ-YCPHGPKFSA-N 1 0 289.419 3.944 20 10 CHCDRO CCS[C@H]1CCCC[N@H+](Cc2cc(C)ccc2O)C1 ZINC000769405459 1129906733 /nfs/dbraw/zinc/90/67/33/1129906733.db2.gz ZCAPFYGBFMWAFD-HNNXBMFYSA-N 1 0 279.449 3.808 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2[C@H](C)C[C@@H]3CCCC[C@@H]32)c1 ZINC000769404223 1129906858 /nfs/dbraw/zinc/90/68/58/1129906858.db2.gz KTDDPUSNTSQNNS-YCPHGPKFSA-N 1 0 259.393 3.854 20 10 CHCDRO CCS[C@@H]1CCCC[N@H+](Cc2cc(C)ccc2O)C1 ZINC000769405460 1129907077 /nfs/dbraw/zinc/90/70/77/1129907077.db2.gz ZCAPFYGBFMWAFD-OAHLLOKOSA-N 1 0 279.449 3.808 20 10 CHCDRO CCCN(CCC)c1ccc(C[N@H+](C)CC[C@@H](C)O)cc1 ZINC000769452444 1129910853 /nfs/dbraw/zinc/91/08/53/1129910853.db2.gz RPTJEFKCXNKKBT-MRXNPFEDSA-N 1 0 292.467 3.516 20 10 CHCDRO CCC[C@]1(C)CCC[N@H+](Cc2cccc(OC)c2O)C1 ZINC000769452571 1129910997 /nfs/dbraw/zinc/91/09/97/1129910997.db2.gz YAZWPVUSZPWBQE-QGZVFWFLSA-N 1 0 277.408 3.803 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CC[C@@H]2c2cccc(F)c2)cc1 ZINC000769506117 1129913647 /nfs/dbraw/zinc/91/36/47/1129913647.db2.gz ATUNICOOTKWKFA-GOSISDBHSA-N 1 0 284.378 3.839 20 10 CHCDRO COc1cccc(C[NH+]2CCC(C3CCCC3)CC2)c1O ZINC000769502802 1129913819 /nfs/dbraw/zinc/91/38/19/1129913819.db2.gz RKTVOTIIURPMHE-UHFFFAOYSA-N 1 0 289.419 3.803 20 10 CHCDRO C[N@H+](CCc1cccs1)Cc1c(O)cccc1Cl ZINC000769499326 1129913938 /nfs/dbraw/zinc/91/39/38/1129913938.db2.gz QFZSWGDBJAVOOT-UHFFFAOYSA-N 1 0 281.808 3.782 20 10 CHCDRO CCOc1ccc(O)c(C[NH+]2C3CCCC2CCC3)c1 ZINC000769500331 1129914167 /nfs/dbraw/zinc/91/41/67/1129914167.db2.gz WQRINQMGCOMTPS-UHFFFAOYSA-N 1 0 275.392 3.698 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CC[C@H]2c2cccc(F)c2)cc1 ZINC000769506118 1129914217 /nfs/dbraw/zinc/91/42/17/1129914217.db2.gz ATUNICOOTKWKFA-SFHVURJKSA-N 1 0 284.378 3.839 20 10 CHCDRO CCC[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1cccc(OC)c1O ZINC000769507486 1129914792 /nfs/dbraw/zinc/91/47/92/1129914792.db2.gz LXUUFHQTFWOPBG-DZGCQCFKSA-N 1 0 277.408 3.801 20 10 CHCDRO c1cc(N2CCCCC2)ccc1C[N@@H+]1CC[C@H](C2CC2)C1 ZINC000769516315 1129915073 /nfs/dbraw/zinc/91/50/73/1129915073.db2.gz SBVXAUHEQSBAHA-SFHVURJKSA-N 1 0 284.447 3.909 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](CC)C[C@H](C)CC)c1 ZINC000769537632 1129916359 /nfs/dbraw/zinc/91/63/59/1129916359.db2.gz NGGNLQCJSBGSQP-CYBMUJFWSA-N 1 0 265.397 3.659 20 10 CHCDRO CCC[C@@H](C)[C@@H]1CCC[N@@H+]1Cc1cccc(OC)c1O ZINC000769537598 1129916532 /nfs/dbraw/zinc/91/65/32/1129916532.db2.gz MSRKAEYMFXUEEJ-HIFRSBDPSA-N 1 0 277.408 3.801 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCc3c(F)cc(F)cc3C2)c1 ZINC000769534540 1129916568 /nfs/dbraw/zinc/91/65/68/1129916568.db2.gz VRUXZJCKFWIMMH-UHFFFAOYSA-N 1 0 289.325 3.537 20 10 CHCDRO CCCC[N@@H+](Cc1ccccc1O)C[C@@H](O)c1ccccc1 ZINC000801596602 1129931980 /nfs/dbraw/zinc/93/19/80/1129931980.db2.gz HCGUVCNPWBTHTH-LJQANCHMSA-N 1 0 299.414 3.728 20 10 CHCDRO CCCC[N@H+](CCCSC)Cc1ccccc1O ZINC000801596711 1129932269 /nfs/dbraw/zinc/93/22/69/1129932269.db2.gz LKFSWLRCBFFQET-UHFFFAOYSA-N 1 0 267.438 3.747 20 10 CHCDRO C[C@@H]1C[C@@H](c2ccc(F)cc2)C[N@@H+]1Cc1ccccc1O ZINC000770510856 1129949333 /nfs/dbraw/zinc/94/93/33/1129949333.db2.gz SIXBAWJQQHFQHH-CZUORRHYSA-N 1 0 285.362 3.909 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)c(O)c1 ZINC000770739388 1129957667 /nfs/dbraw/zinc/95/76/67/1129957667.db2.gz AHKFFORCXGPSFT-NVXWUHKLSA-N 1 0 297.398 3.827 20 10 CHCDRO COc1cccc(C[NH2+][C@@H]2CC[C@H](c3ccccc3)C2)c1O ZINC000770740553 1129958632 /nfs/dbraw/zinc/95/86/32/1129958632.db2.gz JAKDNRVROOBBOU-DOTOQJQBSA-N 1 0 297.398 3.827 20 10 CHCDRO C[C@@H]([NH2+]CCC1C[C@@H](C)O[C@H](C)C1)c1cc(F)ccc1O ZINC000802309031 1129991301 /nfs/dbraw/zinc/99/13/01/1129991301.db2.gz MSTRTMKDKNWWCP-JHJVBQTASA-N 1 0 295.398 3.776 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CC[C@@H]2C[C@@H](C)O[C@@H](C)C2)c1 ZINC000802309998 1129991399 /nfs/dbraw/zinc/99/13/99/1129991399.db2.gz WRABUYRJEXOGDC-QKPAOTATSA-N 1 0 291.435 3.945 20 10 CHCDRO CCC[N@H+](CC)Cc1ccc(N2CCCCC2)cc1 ZINC000771934726 1129996391 /nfs/dbraw/zinc/99/63/91/1129996391.db2.gz DBXKNPJZZOSKPN-UHFFFAOYSA-N 1 0 260.425 3.909 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CC[C@H]2c2ccccc2)c1O ZINC000771938444 1129997210 /nfs/dbraw/zinc/99/72/10/1129997210.db2.gz LTJLQJIVBULNAO-INIZCTEOSA-N 1 0 283.371 3.738 20 10 CHCDRO Cc1ccncc1[C@@H](C)[NH2+]CCCSc1nccs1 ZINC000772454858 1130022032 /nfs/dbraw/zinc/02/20/32/1130022032.db2.gz VAJKHDOBWXTFJL-GFCCVEGCSA-N 1 0 293.461 3.680 20 10 CHCDRO CC1(C[N@H+](Cc2ccco2)Cc2ccccc2O)CC1 ZINC000787040423 1130127040 /nfs/dbraw/zinc/12/70/40/1130127040.db2.gz HMEOLYXCPDMIPN-UHFFFAOYSA-N 1 0 271.360 3.788 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CC[C@@H](C3CC3)O2)c(O)c1C ZINC000903250693 1130137063 /nfs/dbraw/zinc/13/70/63/1130137063.db2.gz CHDQPUMPHWUBFQ-LXZKKBNFSA-N 1 0 289.419 3.617 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCO[C@H]1C1CC1)c1ccc2ccccc2c1O ZINC000903264879 1130139270 /nfs/dbraw/zinc/13/92/70/1130139270.db2.gz ILJUUQFEJJHNEW-LLSQANQASA-N 1 0 297.398 3.764 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCOC12CCCCC2)c1ccccc1O ZINC000903274196 1130142776 /nfs/dbraw/zinc/14/27/76/1130142776.db2.gz JPDFFQUFANDSPR-CJNGLKHVSA-N 1 0 275.392 3.535 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2cncs2)c(O)c1 ZINC000903312554 1130152146 /nfs/dbraw/zinc/15/21/46/1130152146.db2.gz WQNPKOAFJZZDTO-MNOVXSKESA-N 1 0 262.378 3.569 20 10 CHCDRO CC[C@H]([NH2+][C@@H](c1ncccn1)C1CC1)c1ccc(C)cc1O ZINC000903321656 1130154388 /nfs/dbraw/zinc/15/43/88/1130154388.db2.gz BVTZBPPWDQHXRP-DOTOQJQBSA-N 1 0 297.402 3.683 20 10 CHCDRO C[C@H]([NH2+][C@H](c1ccccn1)C1CC1)c1ccccc1O ZINC000903337541 1130161596 /nfs/dbraw/zinc/16/15/96/1130161596.db2.gz DUOHKGNOIDCJOT-SJCJKPOMSA-N 1 0 268.360 3.589 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@H](c1ccccn1)C1CC1)CC2 ZINC000903336506 1130161627 /nfs/dbraw/zinc/16/16/27/1130161627.db2.gz ZOBFKWQQPDZTQY-KSSFIOAISA-N 1 0 280.371 3.515 20 10 CHCDRO CC[C@H]([NH2+]CCC(O)(CC)CC)c1ccc(N(C)C)cc1 ZINC000788264662 1130180036 /nfs/dbraw/zinc/18/00/36/1130180036.db2.gz ZWRLLTHOUOSTRM-KRWDZBQOSA-N 1 0 292.467 3.735 20 10 CHCDRO Cc1ccc([C@@H](O)C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)cc1 ZINC000788562950 1130194881 /nfs/dbraw/zinc/19/48/81/1130194881.db2.gz MJPILEKUWZENAW-YJBOKZPZSA-N 1 0 299.414 3.702 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CCO[C@H](C(C)C)C2)c(O)c1 ZINC000788652983 1130197734 /nfs/dbraw/zinc/19/77/34/1130197734.db2.gz UREWTZPVQNENES-UXLLHSPISA-N 1 0 291.435 3.863 20 10 CHCDRO CC(C)[C@@H]([NH2+][C@@H](C)c1ccccc1O)[C@H](O)c1ccccc1 ZINC000788624882 1130199265 /nfs/dbraw/zinc/19/92/65/1130199265.db2.gz HCUKQVYEZQNOBK-GDIGMMSISA-N 1 0 299.414 3.801 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2CCC23CCCC3)cc1F ZINC000788989927 1130223354 /nfs/dbraw/zinc/22/33/54/1130223354.db2.gz YCQOOVDPXKVQNH-MRXNPFEDSA-N 1 0 276.399 3.704 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]CCCCOC(C)(C)C)c1 ZINC000789360527 1130247004 /nfs/dbraw/zinc/24/70/04/1130247004.db2.gz DBFDZZVFEXEAMP-ZDUSSCGKSA-N 1 0 295.423 3.647 20 10 CHCDRO CCc1ccc([C@H](O)C[NH2+][C@@H](CC)c2ccccc2O)cc1 ZINC000789363047 1130247437 /nfs/dbraw/zinc/24/74/37/1130247437.db2.gz RJXLQQOVVBVARS-PKOBYXMFSA-N 1 0 299.414 3.729 20 10 CHCDRO CCOC[C@H]([NH2+]Cc1cc(Cl)cc(C)c1O)C(C)C ZINC000789590334 1130262352 /nfs/dbraw/zinc/26/23/52/1130262352.db2.gz XNEWYKWKWMLEIN-AWEZNQCLSA-N 1 0 285.815 3.505 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)c1 ZINC000749129205 1130266474 /nfs/dbraw/zinc/26/64/74/1130266474.db2.gz NLZQCRFNUZYZAX-HNNXBMFYSA-N 1 0 298.430 3.920 20 10 CHCDRO CC(C)(C)N1CC[C@@H]1C[NH2+]Cc1ccc2ccccc2c1O ZINC000826791027 1130282629 /nfs/dbraw/zinc/28/26/29/1130282629.db2.gz QLNBJHJWYCZCOP-MRXNPFEDSA-N 1 0 298.430 3.508 20 10 CHCDRO C[C@@H](C[NH2+]Cc1ccc2c(c1)CCO2)c1ccc(F)cc1 ZINC001649176256 1130320482 /nfs/dbraw/zinc/32/04/82/1130320482.db2.gz ZGWBKUALPNAUQC-ZDUSSCGKSA-N 1 0 285.362 3.654 20 10 CHCDRO CC1(C)CCC[N@@H+]1Cc1c([O-])ccc(Cl)c1F ZINC000792166362 1130434660 /nfs/dbraw/zinc/43/46/60/1130434660.db2.gz ZGGNXCNGLVPHMQ-UHFFFAOYSA-N 1 0 257.736 3.559 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CCc3cc(C)ccc3C2)c(O)c1 ZINC000792182272 1130436954 /nfs/dbraw/zinc/43/69/54/1130436954.db2.gz ZVRVIKLQLYZTPT-UHFFFAOYSA-N 1 0 297.398 3.658 20 10 CHCDRO CCC[N@H+](Cc1cc(C)ccn1)Cc1ccccc1O ZINC000792232464 1130438803 /nfs/dbraw/zinc/43/88/03/1130438803.db2.gz LYCITPOJYVPHCY-UHFFFAOYSA-N 1 0 270.376 3.508 20 10 CHCDRO CN1CCC(C)(C)c2cc(C=C3CC[NH2+]CC3)ccc21 ZINC001240879270 1130500800 /nfs/dbraw/zinc/50/08/00/1130500800.db2.gz NGJVHQBFLCNKIQ-UHFFFAOYSA-N 1 0 270.420 3.571 20 10 CHCDRO CC1CCN(c2ccc(C[NH2+]CC3(F)CC3)cc2)CC1 ZINC000792976019 1130508388 /nfs/dbraw/zinc/50/83/88/1130508388.db2.gz KISRUEAVRXBOAO-UHFFFAOYSA-N 1 0 276.399 3.515 20 10 CHCDRO CN(C)c1ccc(C[NH2+]CCC2CC2)c(C(F)(F)F)c1 ZINC000793003924 1130511463 /nfs/dbraw/zinc/51/14/63/1130511463.db2.gz HZSYKUAZLYRQPM-UHFFFAOYSA-N 1 0 286.341 3.661 20 10 CHCDRO CSc1ccccc1C[N@H+](C)Cc1cc(F)ccc1O ZINC000793232262 1130533220 /nfs/dbraw/zinc/53/32/20/1130533220.db2.gz KUHLLDZKLPILTL-UHFFFAOYSA-N 1 0 291.391 3.885 20 10 CHCDRO [O-]c1c(Cl)cccc1C[N@H+](CC1CC1)C1CCC1 ZINC000793396481 1130553390 /nfs/dbraw/zinc/55/33/90/1130553390.db2.gz PLPWEWSOBQFOFX-UHFFFAOYSA-N 1 0 265.784 3.810 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CC(C)(C)[C@@H]2CCCCO2)cc1C ZINC000758496091 1130613686 /nfs/dbraw/zinc/61/36/86/1130613686.db2.gz ALYQBJWICMHYDU-KRWDZBQOSA-N 1 0 291.435 3.694 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CC3(CCC3)[C@H]2C2CC2)cc1 ZINC000811513746 1130619973 /nfs/dbraw/zinc/61/99/73/1130619973.db2.gz OGQZJNJMFGVINQ-QGZVFWFLSA-N 1 0 270.420 3.517 20 10 CHCDRO COc1cc(C)cc(C[N@@H+]2CC[C@H](C)C(C)(C)C2)c1O ZINC000759000127 1130632987 /nfs/dbraw/zinc/63/29/87/1130632987.db2.gz NBJMECMCHOOKJU-ZDUSSCGKSA-N 1 0 277.408 3.577 20 10 CHCDRO CC[C@@H](C)[N@H+](C)Cc1c(O)ccc2ccc(OC)cc21 ZINC001234525872 1130654430 /nfs/dbraw/zinc/65/44/30/1130654430.db2.gz MIZWOWHOWYHADT-GFCCVEGCSA-N 1 0 273.376 3.784 20 10 CHCDRO CCC[N@H+](CCc1ncc(C)cc1C)Cc1ccccc1O ZINC000827959152 1130682800 /nfs/dbraw/zinc/68/28/00/1130682800.db2.gz MJJVVCOQDUUFNL-UHFFFAOYSA-N 1 0 298.430 3.859 20 10 CHCDRO CCOC(C)(C)C[NH2+]Cc1ccc(N(CC)CC)c(F)c1 ZINC000780583426 1130684421 /nfs/dbraw/zinc/68/44/21/1130684421.db2.gz QFOILHMZRMXSBE-UHFFFAOYSA-N 1 0 296.430 3.577 20 10 CHCDRO Cc1cccc(C[N@@H+]2CC[C@@H](COc3ccccc3)C2)c1O ZINC000780788828 1130692440 /nfs/dbraw/zinc/69/24/40/1130692440.db2.gz DATWYTVLTOXSPS-MRXNPFEDSA-N 1 0 297.398 3.602 20 10 CHCDRO CC1(C)COCC[N@@H+]1Cc1cccc(-c2ccccc2)c1O ZINC001234996548 1130700834 /nfs/dbraw/zinc/70/08/34/1130700834.db2.gz IZDUKBBCCKIRIA-UHFFFAOYSA-N 1 0 297.398 3.670 20 10 CHCDRO Oc1c(C[NH+]2CCSCC2)cccc1-c1ccccc1 ZINC001235001431 1130700924 /nfs/dbraw/zinc/70/09/24/1130700924.db2.gz MYSLOTNVWCXPIE-UHFFFAOYSA-N 1 0 285.412 3.608 20 10 CHCDRO CO[C@](C)(C[NH2+][C@H](C)c1cc(Cl)cc(C)c1O)C1CC1 ZINC000812734885 1130709931 /nfs/dbraw/zinc/70/99/31/1130709931.db2.gz UIXVXDAJTBWKFK-BDJLRTHQSA-N 1 0 297.826 3.820 20 10 CHCDRO Nc1ccc(C[NH+]2CCC3(CCc4ccccc43)CC2)cc1 ZINC001235153234 1130716343 /nfs/dbraw/zinc/71/63/43/1130716343.db2.gz QZWUNBGQQSQTMK-UHFFFAOYSA-N 1 0 292.426 3.749 20 10 CHCDRO CCSC1(C[NH2+][C@H](CC)c2ccccc2O)CC1 ZINC000691787633 1130717871 /nfs/dbraw/zinc/71/78/71/1130717871.db2.gz NTMOIRZSILNRPJ-CYBMUJFWSA-N 1 0 265.422 3.719 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2C[C@H]2c2ccccc2)c1 ZINC000812831654 1130720991 /nfs/dbraw/zinc/72/09/91/1130720991.db2.gz ULOXNRDAIYBAJR-XUWXXGDYSA-N 1 0 297.398 3.855 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2cc3oc4ccccc4c3cc2O)CCO1 ZINC000813169647 1130741076 /nfs/dbraw/zinc/74/10/76/1130741076.db2.gz QLUZLDWALBZKDS-GFCCVEGCSA-N 1 0 297.354 3.512 20 10 CHCDRO C[N@@H+](Cc1ccc(C(C)(C)C)cc1O)C[C@H]1CCCCO1 ZINC001235685410 1130768485 /nfs/dbraw/zinc/76/84/85/1130768485.db2.gz PTSKTMTVWBNOLC-MRXNPFEDSA-N 1 0 291.435 3.691 20 10 CHCDRO CC(C)[C@@H](CC(F)(F)F)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000782543282 1130782527 /nfs/dbraw/zinc/78/25/27/1130782527.db2.gz HZVHARYHQIOCTF-CYBMUJFWSA-N 1 0 287.325 3.688 20 10 CHCDRO c1cc(C[NH2+]Cc2ccc3c(c2)CCCC3)cc2c1OCC2 ZINC000813772011 1130783933 /nfs/dbraw/zinc/78/39/33/1130783933.db2.gz PFFOEMSBRHVUSK-UHFFFAOYSA-N 1 0 293.410 3.790 20 10 CHCDRO C[C@@H](COc1ccccc1)[NH2+][C@@H](C)c1ccccc1O ZINC000783505770 1130831077 /nfs/dbraw/zinc/83/10/77/1130831077.db2.gz QCMGONMUGBOLIF-KBPBESRZSA-N 1 0 271.360 3.510 20 10 CHCDRO CCC(=O)Nc1cccc(C[NH2+][C@@H](C)c2ccccc2O)c1 ZINC000783504787 1130831629 /nfs/dbraw/zinc/83/16/29/1130831629.db2.gz MRFHXSHLGCBRRH-ZDUSSCGKSA-N 1 0 298.386 3.592 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1ccccc1O)c1c(C)nn(C)c1C ZINC000783517996 1130832402 /nfs/dbraw/zinc/83/24/02/1130832402.db2.gz MJIKVBFCSKOSAX-NHYWBVRUSA-N 1 0 287.407 3.544 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)c1ccccc1O ZINC000783513860 1130833001 /nfs/dbraw/zinc/83/30/01/1130833001.db2.gz NSTXKZYXBLPDTL-AWEZNQCLSA-N 1 0 284.403 3.617 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CC3(CCC3)[C@@H]2C(C)C)c1 ZINC000814171444 1130832940 /nfs/dbraw/zinc/83/29/40/1130832940.db2.gz PAIQRFPIVPMFJK-KRWDZBQOSA-N 1 0 289.419 3.801 20 10 CHCDRO CCC(CC)(C[NH2+]Cc1cc(Cl)cc(C)c1O)OC ZINC000814177607 1130835084 /nfs/dbraw/zinc/83/50/84/1130835084.db2.gz IFQAALXSNKPSQF-UHFFFAOYSA-N 1 0 285.815 3.649 20 10 CHCDRO CCCCn1cc(C[NH2+][C@@H](C)c2ccccc2O)c(C)n1 ZINC000783525650 1130835294 /nfs/dbraw/zinc/83/52/94/1130835294.db2.gz MPJSQRMGINENDS-AWEZNQCLSA-N 1 0 287.407 3.548 20 10 CHCDRO CC[C@@H]1CC[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000814179604 1130836856 /nfs/dbraw/zinc/83/68/56/1130836856.db2.gz WBONCQNSFODFCM-MRXNPFEDSA-N 1 0 258.409 3.661 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2C[C@H](C)O[C@@H](C)[C@H]2C)cc1C(C)C ZINC000783546686 1130836979 /nfs/dbraw/zinc/83/69/79/1130836979.db2.gz SLLSXRTVRJWXLG-ZNMIVQPWSA-N 1 0 291.435 3.822 20 10 CHCDRO Cc1ccc(O)c(C[N@H+]2C[C@H](C)[C@@H]3CCCC[C@@H]32)c1 ZINC000783593530 1130842073 /nfs/dbraw/zinc/84/20/73/1130842073.db2.gz VPXYHHVXVDHGJR-BPUTZDHNSA-N 1 0 259.393 3.711 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@@H+]2CC(C)(C)[C@@H]2c2ccncc2)c1 ZINC000814229670 1130849605 /nfs/dbraw/zinc/84/96/05/1130849605.db2.gz COSOPAKDFPFZAI-SFHVURJKSA-N 1 0 296.414 3.987 20 10 CHCDRO C[C@H]1C[N@H+](Cc2c(O)ccc3ccncc32)CC(C)(C)C1 ZINC000784007599 1130868042 /nfs/dbraw/zinc/86/80/42/1130868042.db2.gz JNGZJHQAXZVBAE-CYBMUJFWSA-N 1 0 284.403 3.808 20 10 CHCDRO CCCC[C@H]1CN(Cc2cc3ccccc3cc2O)CC[NH2+]1 ZINC001236141735 1130874145 /nfs/dbraw/zinc/87/41/45/1130874145.db2.gz KZUCNFWSPUXSSO-SFHVURJKSA-N 1 0 298.430 3.509 20 10 CHCDRO COc1cccc([C@H]2CCC[N@H+](Cc3ccc(N)cc3)C2)c1 ZINC001236335668 1130915591 /nfs/dbraw/zinc/91/55/91/1130915591.db2.gz QTLXQPXAXGUABC-KRWDZBQOSA-N 1 0 296.414 3.657 20 10 CHCDRO CCc1cnccc1[C@@H](C)[NH2+]Cc1ccc(N(C)C)c(C)c1 ZINC000815091211 1130954453 /nfs/dbraw/zinc/95/44/53/1130954453.db2.gz OBJKDSJDDCDNRS-OAHLLOKOSA-N 1 0 297.446 3.869 20 10 CHCDRO Cc1cc(C[N@H+](Cc2ccccn2)C2CC2)ccc1N(C)C ZINC000815079354 1130955852 /nfs/dbraw/zinc/95/58/52/1130955852.db2.gz RGVBFANJJFINNA-UHFFFAOYSA-N 1 0 295.430 3.621 20 10 CHCDRO C[C@H]([NH2+][C@H]1CSC[C@@H]1C)c1cc2c(cc1O)CCCC2 ZINC000797066663 1130958878 /nfs/dbraw/zinc/95/88/78/1130958878.db2.gz UIRDSXAKLJYBLE-MKBNYLNASA-N 1 0 291.460 3.673 20 10 CHCDRO Cc1cc(C[N@@H+]2CCCC[C@@H]2c2cc[nH]n2)ccc1N(C)C ZINC000815116439 1130958865 /nfs/dbraw/zinc/95/88/65/1130958865.db2.gz NHZXZAJHOHMOQC-GOSISDBHSA-N 1 0 298.434 3.511 20 10 CHCDRO CCOC1(C)CC[NH+](Cc2ccc(N(C)CC)cc2)CC1 ZINC000815119362 1130958929 /nfs/dbraw/zinc/95/89/29/1130958929.db2.gz VLBBCQJDMOUOHU-UHFFFAOYSA-N 1 0 290.451 3.534 20 10 CHCDRO CCn1ccc(C[N@H+](C)Cc2ccc(N(C)C)c(C)c2)c1 ZINC000815101424 1130961997 /nfs/dbraw/zinc/96/19/97/1130961997.db2.gz YWKSGWCNSSLKLG-UHFFFAOYSA-N 1 0 285.435 3.514 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CC[C@H]1C)c1cc2c(cc1O)CCCC2 ZINC000797129505 1130964301 /nfs/dbraw/zinc/96/43/01/1130964301.db2.gz MFVJAJLILUFGCT-BFQNTYOBSA-N 1 0 259.393 3.720 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CC[C@@H]1C)c1cc2c(cc1O)CCCC2 ZINC000797129511 1130964412 /nfs/dbraw/zinc/96/44/12/1130964412.db2.gz MFVJAJLILUFGCT-MQIPJXDCSA-N 1 0 259.393 3.720 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C2CC(C(C)(C)C)C2)cc1 ZINC000815146162 1130966919 /nfs/dbraw/zinc/96/69/19/1130966919.db2.gz BLCFSXNQFUSBMP-UHFFFAOYSA-N 1 0 260.425 3.667 20 10 CHCDRO C[C@H](F)CC[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000815148758 1130967193 /nfs/dbraw/zinc/96/71/93/1130967193.db2.gz JDVFHGQXDOEBKA-ZDUSSCGKSA-N 1 0 273.351 3.897 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)CN(C)C(C)C)c1cc(Cl)ccc1O ZINC000810245116 1130980804 /nfs/dbraw/zinc/98/08/04/1130980804.db2.gz RTIFDRZAWXYXEA-WFASDCNBSA-N 1 0 298.858 3.815 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CCOc2ccccc2)c(O)c1 ZINC000815553860 1130998070 /nfs/dbraw/zinc/99/80/70/1130998070.db2.gz LUVLXCGSRBQKRR-OAHLLOKOSA-N 1 0 285.387 3.739 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CCc2ccsc2)c(O)c1 ZINC000815556155 1130999390 /nfs/dbraw/zinc/99/93/90/1130999390.db2.gz OVIZJJAAJSPIEV-ZDUSSCGKSA-N 1 0 275.417 3.964 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2ccn(C(C)C)n2)c(O)c1 ZINC000815582561 1131002230 /nfs/dbraw/zinc/00/22/30/1131002230.db2.gz JQCXFDHNQRLIAQ-AWEZNQCLSA-N 1 0 287.407 3.637 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2cc(C(C)C)no2)c(O)c1 ZINC000815580148 1131003040 /nfs/dbraw/zinc/00/30/40/1131003040.db2.gz DAXOTGAEGIMNKD-CYBMUJFWSA-N 1 0 288.391 3.971 20 10 CHCDRO CCc1ccc(C[N@@H+]2CCC[C@H]3CCC[C@H]32)c(O)c1 ZINC001236787235 1131005903 /nfs/dbraw/zinc/00/59/03/1131005903.db2.gz APSULZJHMJSYTI-GDBMZVCRSA-N 1 0 259.393 3.719 20 10 CHCDRO CCc1ccc(C[N@H+](C)Cc2ccc(F)cc2)c(O)c1 ZINC001236783960 1131006157 /nfs/dbraw/zinc/00/61/57/1131006157.db2.gz QCFLRAMHLKVCGB-UHFFFAOYSA-N 1 0 273.351 3.726 20 10 CHCDRO CCc1ccc(C[N@@H+]2CCC[C@](C)(F)CC2)c(O)c1 ZINC001236784336 1131006798 /nfs/dbraw/zinc/00/67/98/1131006798.db2.gz UYGCCFPFUWBDIX-INIZCTEOSA-N 1 0 265.372 3.669 20 10 CHCDRO CCc1ccc(C[NH+]2CCC(C(F)(F)F)CC2)c(O)c1 ZINC001236784227 1131007580 /nfs/dbraw/zinc/00/75/80/1131007580.db2.gz SAMOIOUTAMIZCL-UHFFFAOYSA-N 1 0 287.325 3.729 20 10 CHCDRO CCc1ccc(C[N@@H+]2CCO[C@@H](c3ccccc3)C2)c(O)c1 ZINC001236793031 1131007976 /nfs/dbraw/zinc/00/79/76/1131007976.db2.gz VMDCBAAYEJHRAT-LJQANCHMSA-N 1 0 297.398 3.528 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+][C@@H](C)Cc2ccc(O)cc2)c(O)c1 ZINC000815576439 1131008227 /nfs/dbraw/zinc/00/82/27/1131008227.db2.gz QHXNNJRSJXABJR-LSDHHAIUSA-N 1 0 299.414 3.996 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CCC[C@@H]3CCC[C@H]32)c(Cl)c1 ZINC001236802016 1131010884 /nfs/dbraw/zinc/01/08/84/1131010884.db2.gz GFMNMJULXWFSTC-XHDPSFHLSA-N 1 0 295.810 3.819 20 10 CHCDRO COc1cc(C)c(C[N@@H+]2CC[C@@H]2c2ccccc2)c(O)c1 ZINC001236812016 1131011208 /nfs/dbraw/zinc/01/12/08/1131011208.db2.gz XVFITVLNJXMSKE-QGZVFWFLSA-N 1 0 283.371 3.656 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[NH2+][C@@H]1CC[C@@H]1C1CC1 ZINC000797905581 1131014037 /nfs/dbraw/zinc/01/40/37/1131014037.db2.gz NJMLXSAOYAWIPT-QZTJIDSGSA-N 1 0 270.420 3.565 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[NH2+][C@@H]1CC[C@H]1C1CC1 ZINC000797905584 1131014396 /nfs/dbraw/zinc/01/43/96/1131014396.db2.gz NJMLXSAOYAWIPT-ZWKOTPCHSA-N 1 0 270.420 3.565 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+]CC[C@H](C)F)c1O ZINC000815645451 1131014922 /nfs/dbraw/zinc/01/49/22/1131014922.db2.gz FYWUYUWNKMITBP-UWVGGRQHSA-N 1 0 259.752 3.753 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](CO)C2CCCCC2)c(O)c1 ZINC000815648135 1131017060 /nfs/dbraw/zinc/01/70/60/1131017060.db2.gz FKTGCNKSYMXWRN-ZBFHGGJFSA-N 1 0 291.435 3.540 20 10 CHCDRO Oc1cc2ccccc2cc1C[N@H+](CC1CC1)C1CC1 ZINC001236835244 1131019384 /nfs/dbraw/zinc/01/93/84/1131019384.db2.gz FMPVNHLNLJTUIR-UHFFFAOYSA-N 1 0 267.372 3.920 20 10 CHCDRO CC[N@H+](Cc1ccccn1)Cc1cc2ccccc2cc1O ZINC001236834112 1131019637 /nfs/dbraw/zinc/01/96/37/1131019637.db2.gz UVTQLKGHMXJVOL-UHFFFAOYSA-N 1 0 292.382 3.963 20 10 CHCDRO CCO[C@H]1CCC[N@H+](Cc2cc3ccccc3cc2O)C1 ZINC001236842068 1131020268 /nfs/dbraw/zinc/02/02/68/1131020268.db2.gz SYBMYPKVKKVRRL-KRWDZBQOSA-N 1 0 285.387 3.546 20 10 CHCDRO CC1(C)C[N@H+](Cc2cc3ccccc3cc2O)CCCO1 ZINC001236841428 1131020459 /nfs/dbraw/zinc/02/04/59/1131020459.db2.gz JXQAJHIHYBWVCR-UHFFFAOYSA-N 1 0 285.387 3.546 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2C[C@H](c3ccccc3)C2)c1 ZINC000797999553 1131020669 /nfs/dbraw/zinc/02/06/69/1131020669.db2.gz WOZUOOQMUKDHRM-BPUTZDHNSA-N 1 0 297.398 3.998 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CC[C@H]3CCCC[C@H]3C2)c(O)c1 ZINC001237043452 1131038377 /nfs/dbraw/zinc/03/83/77/1131038377.db2.gz OGPCHRFQGRITHB-CABCVRRESA-N 1 0 289.419 3.803 20 10 CHCDRO Cc1ccccc1[C@H]1C[C@H]([NH2+]Cc2ccccc2O)C1 ZINC000798502155 1131038745 /nfs/dbraw/zinc/03/87/45/1131038745.db2.gz WOVZWPPIAGYQFC-WKILWMFISA-N 1 0 267.372 3.736 20 10 CHCDRO CC[N@H+](Cc1ccncc1)Cc1ccc(C(C)C)cc1O ZINC001237048461 1131039264 /nfs/dbraw/zinc/03/92/64/1131039264.db2.gz RYSHYDRZYBUXLM-UHFFFAOYSA-N 1 0 284.403 3.933 20 10 CHCDRO CCCC[N@H+](C)Cc1ccc(OCC(F)(F)F)cc1O ZINC001237051176 1131041080 /nfs/dbraw/zinc/04/10/80/1131041080.db2.gz IFGLXQGLJAQRAE-UHFFFAOYSA-N 1 0 291.313 3.565 20 10 CHCDRO Oc1ccc(F)c(Cl)c1C[NH+]1CCC2(CCC2)CC1 ZINC001237125037 1131055965 /nfs/dbraw/zinc/05/59/65/1131055965.db2.gz VHUQRULMEDTASK-UHFFFAOYSA-N 1 0 283.774 3.951 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](CO)CC2CCCC2)c(O)c1 ZINC000798938541 1131062833 /nfs/dbraw/zinc/06/28/33/1131062833.db2.gz YQEKCCGPTWOUDK-ZBFHGGJFSA-N 1 0 291.435 3.540 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]C[C@@H](C)CC(C)C)c1 ZINC000799158257 1131073464 /nfs/dbraw/zinc/07/34/64/1131073464.db2.gz ZQXCTBSWRJKGHD-QWHCGFSZSA-N 1 0 265.397 3.734 20 10 CHCDRO COc1ccc(C[NH2+]CCc2ccc3[nH]ccc3c2)cc1C ZINC000799348611 1131082608 /nfs/dbraw/zinc/08/26/08/1131082608.db2.gz IRKMEJCYUWGTQK-UHFFFAOYSA-N 1 0 294.398 3.817 20 10 CHCDRO CC[N@@H+](Cc1ccc2ccccc2c1O)C[C@H]1CCCO1 ZINC000816495627 1131100597 /nfs/dbraw/zinc/10/05/97/1131100597.db2.gz CUQWDGJLHOKSMB-MRXNPFEDSA-N 1 0 285.387 3.546 20 10 CHCDRO COc1ccc([C@@H](C)[N@H+](C)Cc2c(C)cccc2O)cc1 ZINC001237487377 1131104298 /nfs/dbraw/zinc/10/42/98/1131104298.db2.gz IFRYMNGHPBAQLB-CQSZACIVSA-N 1 0 285.387 3.902 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+]1Cc2ccccc2C(C)(C)C1 ZINC001237492077 1131104374 /nfs/dbraw/zinc/10/43/74/1131104374.db2.gz OGVYLTXROLCEPD-UHFFFAOYSA-N 1 0 281.399 3.994 20 10 CHCDRO Cc1ccc(CC[NH2+]Cc2ccc3ccccc3c2O)o1 ZINC000816535104 1131105130 /nfs/dbraw/zinc/10/51/30/1131105130.db2.gz FMKASUFDWCNUEZ-UHFFFAOYSA-N 1 0 281.355 3.779 20 10 CHCDRO C[C@H]1CCCCN1CC[NH2+]Cc1ccc2ccccc2c1O ZINC000816535762 1131105236 /nfs/dbraw/zinc/10/52/36/1131105236.db2.gz YXIKRHUTGIQAMH-HNNXBMFYSA-N 1 0 298.430 3.509 20 10 CHCDRO Cc1ccc(CC[NH2+]Cc2ccc3ccccc3c2O)cn1 ZINC000816550854 1131106609 /nfs/dbraw/zinc/10/66/09/1131106609.db2.gz FMXOMVMUDVASBD-UHFFFAOYSA-N 1 0 292.382 3.581 20 10 CHCDRO Oc1c(C[NH2+]CC2CCSCC2)ccc2ccccc21 ZINC000816549617 1131106792 /nfs/dbraw/zinc/10/67/92/1131106792.db2.gz UCKCLFXKSIBLIY-UHFFFAOYSA-N 1 0 287.428 3.778 20 10 CHCDRO CN(CC[NH2+]Cc1ccc2ccccc2c1O)C1CCCC1 ZINC000816547755 1131106877 /nfs/dbraw/zinc/10/68/77/1131106877.db2.gz IAMCACWKFBOYEC-UHFFFAOYSA-N 1 0 298.430 3.509 20 10 CHCDRO C[C@@H]1CSCC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816591980 1131109891 /nfs/dbraw/zinc/10/98/91/1131109891.db2.gz TUTFWQGTCUIMPL-ZDUSSCGKSA-N 1 0 287.428 3.730 20 10 CHCDRO C[C@H]1C[N@H+](Cc2ccc3ccccc3c2O)C[C@H](C2CC2)O1 ZINC000816594518 1131110326 /nfs/dbraw/zinc/11/03/26/1131110326.db2.gz HBVIFPMINIQMRZ-SCLBCKFNSA-N 1 0 297.398 3.545 20 10 CHCDRO Oc1c(C[NH2+]CCCc2nccs2)ccc2ccccc21 ZINC000816563469 1131111771 /nfs/dbraw/zinc/11/17/71/1131111771.db2.gz ZABZPFAVKSJYAF-UHFFFAOYSA-N 1 0 298.411 3.724 20 10 CHCDRO Oc1c(C[NH2+]C[C@H]2CCCCS2)ccc2ccccc21 ZINC000816567367 1131113300 /nfs/dbraw/zinc/11/33/00/1131113300.db2.gz YSZZVQKMUBGEJM-OAHLLOKOSA-N 1 0 287.428 3.921 20 10 CHCDRO CC1(CC[NH2+]Cc2ccc3ccccc3c2O)CC1 ZINC000816594831 1131113806 /nfs/dbraw/zinc/11/38/06/1131113806.db2.gz PZKCFOFLUQYZMV-UHFFFAOYSA-N 1 0 255.361 3.825 20 10 CHCDRO COc1cccc(C[NH2+][C@H]2CCCC23CCCC3)c1O ZINC000816610547 1131115130 /nfs/dbraw/zinc/11/51/30/1131115130.db2.gz ORFKILZAZQYCFH-HNNXBMFYSA-N 1 0 275.392 3.603 20 10 CHCDRO CCC(CC)(C[NH2+]Cc1ccc2ccccc2c1O)OC ZINC000816617424 1131115526 /nfs/dbraw/zinc/11/55/26/1131115526.db2.gz YTZHAXGLNXNNDA-UHFFFAOYSA-N 1 0 287.403 3.840 20 10 CHCDRO Cc1cc(Br)cc(C[NH2+]C2(C(C)C)CC2)c1O ZINC000816644331 1131117990 /nfs/dbraw/zinc/11/79/90/1131117990.db2.gz JRHMMZGMWSOTSM-UHFFFAOYSA-N 1 0 298.224 3.741 20 10 CHCDRO COc1cc(C[NH+]2CCCCCCCC2)c(O)c(OC)c1 ZINC001237682804 1131126754 /nfs/dbraw/zinc/12/67/54/1131126754.db2.gz DHRYMGBNCXIBLR-UHFFFAOYSA-N 1 0 293.407 3.566 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2CC[C@](C)(CF)C2)c1O ZINC001237682078 1131126824 /nfs/dbraw/zinc/12/68/24/1131126824.db2.gz XIZYAZCLNPDMNR-CQSZACIVSA-N 1 0 271.763 3.536 20 10 CHCDRO CC[C@@H]1CCC[N@@H+]1Cc1cc(Br)c(C)cc1O ZINC001237678561 1131127016 /nfs/dbraw/zinc/12/70/16/1131127016.db2.gz JITCQOHYKIVBJE-GFCCVEGCSA-N 1 0 298.224 3.838 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+]2CCC[C@@H]2C(C)C)c1O ZINC001237689884 1131128125 /nfs/dbraw/zinc/12/81/25/1131128125.db2.gz RIOREIJSKPZVIS-CQSZACIVSA-N 1 0 267.800 3.974 20 10 CHCDRO CCCC[N@H+](CC)Cc1ccc(N2CCCC2)cc1 ZINC001116438592 1131145456 /nfs/dbraw/zinc/14/54/56/1131145456.db2.gz ITNWQRVVHXYKJL-UHFFFAOYSA-N 1 0 260.425 3.909 20 10 CHCDRO C[C@H]1C[NH+](Cc2ccc(N3CCCC3)cc2)C[C@H](C)S1 ZINC001116442439 1131146534 /nfs/dbraw/zinc/14/65/34/1131146534.db2.gz WUQJZCVIAQSIAQ-GJZGRUSLSA-N 1 0 290.476 3.613 20 10 CHCDRO C[C@H]1CC[N@H+](Cc2cc(F)c(Cl)cc2[O-])[C@@H](C)C1 ZINC001237936580 1131152635 /nfs/dbraw/zinc/15/26/35/1131152635.db2.gz KPBCSRGMOGNYDQ-UWVGGRQHSA-N 1 0 271.763 3.805 20 10 CHCDRO C[N@H+](Cc1cccs1)Cc1cc(F)c(Cl)cc1[O-] ZINC001237937750 1131154087 /nfs/dbraw/zinc/15/40/87/1131154087.db2.gz UPMDUKNZKSSMES-UHFFFAOYSA-N 1 0 285.771 3.878 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]C[C@@H]1CC12CCSCC2 ZINC000817411840 1131160742 /nfs/dbraw/zinc/16/07/42/1131160742.db2.gz WYTKFXXPTKDGSB-LBPRGKRZSA-N 1 0 297.851 3.669 20 10 CHCDRO Cc1cc(F)cc(C[N@H+](C)CCc2ccccc2)c1O ZINC001238059022 1131165263 /nfs/dbraw/zinc/16/52/63/1131165263.db2.gz YBFJJKBAGSXYJW-UHFFFAOYSA-N 1 0 273.351 3.514 20 10 CHCDRO Cc1cc(F)cc(C[N@H+]2CC[C@@H](C)C(F)(F)CC2)c1O ZINC001238057402 1131165737 /nfs/dbraw/zinc/16/57/37/1131165737.db2.gz KPJKTCICHCTCAT-LLVKDONJSA-N 1 0 287.325 3.707 20 10 CHCDRO Cc1cc(F)cc(C[N@@H+]2CCC(F)(F)C(C)(C)C2)c1O ZINC001238059356 1131166468 /nfs/dbraw/zinc/16/64/68/1131166468.db2.gz CFIJXDOPNNRCTM-UHFFFAOYSA-N 1 0 287.325 3.707 20 10 CHCDRO C[C@H]([NH2+]CCCC1(O)CCC1)c1ccc2ccccc2c1O ZINC000817585268 1131173151 /nfs/dbraw/zinc/17/31/51/1131173151.db2.gz DWNHKLUKERTABC-AWEZNQCLSA-N 1 0 299.414 3.891 20 10 CHCDRO CS[C@H](C)C[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2C ZINC000168851419 1131186526 /nfs/dbraw/zinc/18/65/26/1131186526.db2.gz FQNYBHXAYCWJAG-TUAOUCFPSA-N 1 0 265.422 3.590 20 10 CHCDRO Nc1ccc(CC[NH2+][C@H]2CCSc3ccccc32)cc1 ZINC000817955684 1131190386 /nfs/dbraw/zinc/19/03/86/1131190386.db2.gz FITGHRWOAWXMJU-INIZCTEOSA-N 1 0 284.428 3.638 20 10 CHCDRO CC(C)Oc1ccc([C@H](C)[NH2+]CCc2ccc(N)cc2)cc1 ZINC000817955901 1131190490 /nfs/dbraw/zinc/19/04/90/1131190490.db2.gz KNNCVZUJOACSEF-HNNXBMFYSA-N 1 0 298.430 3.949 20 10 CHCDRO Cc1ccc(C[C@H]([NH2+]CCc2ccc(N)cc2)C2CC2)cc1 ZINC000817955425 1131190505 /nfs/dbraw/zinc/19/05/05/1131190505.db2.gz AKNKJUBNBCABSH-FQEVSTJZSA-N 1 0 294.442 3.731 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccc(N)cc1)c1ccc2c(c1)CCC2 ZINC000817955791 1131190672 /nfs/dbraw/zinc/19/06/72/1131190672.db2.gz HUHHWKSDWIJHHY-CQSZACIVSA-N 1 0 280.415 3.651 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccc(N)cc1)c1cc(C)ccc1OC ZINC000817955848 1131190675 /nfs/dbraw/zinc/19/06/75/1131190675.db2.gz JEZOBGDYQNKPBB-SFHVURJKSA-N 1 0 298.430 3.869 20 10 CHCDRO C[C@H]([NH2+]CCc1ccc(N)cc1)c1ccc(Cl)s1 ZINC000817955492 1131190736 /nfs/dbraw/zinc/19/07/36/1131190736.db2.gz CCAWGCPMLQOKAB-JTQLQIEISA-N 1 0 280.824 3.877 20 10 CHCDRO Cc1ccc2c(c1)[C@@H]([NH2+]CCc1ccc(N)cc1)CCCO2 ZINC000817956166 1131190995 /nfs/dbraw/zinc/19/09/95/1131190995.db2.gz SJCXTMHDPVPDLL-SFHVURJKSA-N 1 0 296.414 3.623 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccc(N)cc1)c1cccc(C)c1 ZINC000817958157 1131191249 /nfs/dbraw/zinc/19/12/49/1131191249.db2.gz SMENKRRRBLNPJA-GOSISDBHSA-N 1 0 268.404 3.861 20 10 CHCDRO Nc1ccc(CC[NH2+][C@@H]2CCCc3sccc32)cc1 ZINC000817956319 1131191415 /nfs/dbraw/zinc/19/14/15/1131191415.db2.gz WIUNFXGBKVMECU-OAHLLOKOSA-N 1 0 272.417 3.540 20 10 CHCDRO COc1cc(C)c([C@@H](C)[NH2+]CCc2ccc(N)cc2)cc1C ZINC000817958180 1131191418 /nfs/dbraw/zinc/19/14/18/1131191418.db2.gz SRLDBNSCRPRDDU-OAHLLOKOSA-N 1 0 298.430 3.788 20 10 CHCDRO Nc1ccc(CC[NH2+][C@@H]2CCc3c2cccc3Cl)cc1 ZINC000817956243 1131191498 /nfs/dbraw/zinc/19/14/98/1131191498.db2.gz USHWKOOQROPQEV-QGZVFWFLSA-N 1 0 286.806 3.742 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cccc2c1CCCN2)c1ccccc1O ZINC000817975706 1131194117 /nfs/dbraw/zinc/19/41/17/1131194117.db2.gz QEUHVRFBZXCREN-QGZVFWFLSA-N 1 0 296.414 3.991 20 10 CHCDRO CCn1ccnc1[C@H](C)[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2C ZINC001117831515 1131203741 /nfs/dbraw/zinc/20/37/41/1131203741.db2.gz PGMXPGMBCWMETE-IHRRRGAJSA-N 1 0 299.418 3.816 20 10 CHCDRO Oc1ccc(-c2ccccc2)cc1C[NH2+][C@@H]1CC12CC2 ZINC000818229967 1131206012 /nfs/dbraw/zinc/20/60/12/1131206012.db2.gz JYCQNRGNXKAGHS-QGZVFWFLSA-N 1 0 265.356 3.701 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1CCN(c2ccc(OC)cc2)C1)C(C)C ZINC000818345426 1131209819 /nfs/dbraw/zinc/20/98/19/1131209819.db2.gz UOVYLWLZBFIJBA-MAUKXSAKSA-N 1 0 290.451 3.546 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1C[C@H]2C[C@H]2C1)c1ccc(N(C)C)cc1 ZINC000818359325 1131211681 /nfs/dbraw/zinc/21/16/81/1131211681.db2.gz IXYYPKFWZZKAQP-IVSAIRAKSA-N 1 0 258.409 3.592 20 10 CHCDRO [NH3+]CCCCCCCOc1ccc(N2CCCC2)cc1 ZINC000818619657 1131218501 /nfs/dbraw/zinc/21/85/01/1131218501.db2.gz IKYQTLMWZLMQHO-UHFFFAOYSA-N 1 0 276.424 3.575 20 10 CHCDRO Cc1cc(C[N@@H+](C)C2CCOCC2)c(C)n1-c1ccccc1 ZINC001137854224 1131424494 /nfs/dbraw/zinc/42/44/94/1131424494.db2.gz NOYAWMFSSXTFHP-UHFFFAOYSA-N 1 0 298.430 3.705 20 10 CHCDRO CC[N@H+](CCOC)Cc1cc(C)n(-c2ccccc2)c1C ZINC001137854098 1131424554 /nfs/dbraw/zinc/42/45/54/1131424554.db2.gz IKIFJEWATUCHJH-UHFFFAOYSA-N 1 0 286.419 3.562 20 10 CHCDRO CCCN(Cc1cc2cccnc2o1)c1ccc(C[NH3+])cc1 ZINC000824291215 1131461810 /nfs/dbraw/zinc/46/18/10/1131461810.db2.gz CNFWPGBYRYNREX-UHFFFAOYSA-N 1 0 295.386 3.703 20 10 CHCDRO COc1ccc(O)c(C[NH2+]CC[C@@H]2CCc3ccccc32)c1 ZINC000824548724 1131473089 /nfs/dbraw/zinc/47/30/89/1131473089.db2.gz NGXOMCCENYPESE-HNNXBMFYSA-N 1 0 297.398 3.611 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H]2C[C@@H](C)Oc3ccccc32)c1 ZINC000824650349 1131477546 /nfs/dbraw/zinc/47/75/46/1131477546.db2.gz MKMMZEQGZFUNOV-CZUORRHYSA-N 1 0 283.371 3.703 20 10 CHCDRO Cc1c(C[NH+]2CCC(C)CC2)c2ccccc2n1C ZINC001138252531 1131482414 /nfs/dbraw/zinc/48/24/14/1131482414.db2.gz KDTJZZSWZDNRBD-UHFFFAOYSA-N 1 0 256.393 3.719 20 10 CHCDRO Cc1c(C[N@H+](C)CCc2ccncc2)c2ccccc2n1C ZINC001138256674 1131483110 /nfs/dbraw/zinc/48/31/10/1131483110.db2.gz GHPMVKJYYSWDLA-UHFFFAOYSA-N 1 0 293.414 3.556 20 10 CHCDRO Cc1cc(C[N@@H+]2[C@@H](C)CCC2(C)C)ccc1N(C)C ZINC001171078716 1131504252 /nfs/dbraw/zinc/50/42/52/1131504252.db2.gz RLQPONKCIQFLQF-AWEZNQCLSA-N 1 0 260.425 3.824 20 10 CHCDRO CS[C@@H]1CC[C@H]([NH2+]Cc2cc(Cl)c(C)cc2O)C1 ZINC000825320945 1131506640 /nfs/dbraw/zinc/50/66/40/1131506640.db2.gz QPISMYVCNIKGHP-NWDGAFQWSA-N 1 0 285.840 3.728 20 10 CHCDRO CC[C@H](CSC)[NH2+]Cc1cc(Cl)c(C)cc1O ZINC000825401377 1131510204 /nfs/dbraw/zinc/51/02/04/1131510204.db2.gz VEBIPRPLYNOMCY-LLVKDONJSA-N 1 0 273.829 3.585 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2C[C@H]3[C@@H](C2)C3(F)F)cc1C(C)C ZINC000844753169 1131595443 /nfs/dbraw/zinc/59/54/43/1131595443.db2.gz VFGPBJVBRBVAMH-OKILXGFUSA-N 1 0 281.346 3.521 20 10 CHCDRO CC[N@H+](Cc1ccc2ccn(C)c2c1)Cc1ccccc1O ZINC001139206610 1131596040 /nfs/dbraw/zinc/59/60/40/1131596040.db2.gz GMVWQJGDUMJGHC-UHFFFAOYSA-N 1 0 294.398 3.906 20 10 CHCDRO CCOc1ccc(C)cc1C[N@H+](C)Cc1ccccc1O ZINC001139607598 1131621493 /nfs/dbraw/zinc/62/14/93/1131621493.db2.gz XCXAZJKQDQIIBD-UHFFFAOYSA-N 1 0 285.387 3.731 20 10 CHCDRO Cc1cc(C[NH+]2CC3CCC(CC3)C2)ccc1N(C)C ZINC001139673374 1131628062 /nfs/dbraw/zinc/62/80/62/1131628062.db2.gz FVGGPOXLRMJXOU-UHFFFAOYSA-N 1 0 272.436 3.683 20 10 CHCDRO COc1cc(C[NH2+]C2(C)CC=CC2)c(O)c(C(C)(C)C)c1 ZINC001202993869 1131656847 /nfs/dbraw/zinc/65/68/47/1131656847.db2.gz SNWKJKPSJIPDBC-UHFFFAOYSA-N 1 0 289.419 3.897 20 10 CHCDRO COc1c(Cl)cccc1C[N@H+](C)Cc1ccccc1O ZINC001140062281 1131661681 /nfs/dbraw/zinc/66/16/81/1131661681.db2.gz QOWHCWVGAJFCCH-UHFFFAOYSA-N 1 0 291.778 3.686 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCC[C@H]3CCC[C@H]32)c1O ZINC001140182551 1131674323 /nfs/dbraw/zinc/67/43/23/1131674323.db2.gz VDNOVTYOURTYFE-GDBMZVCRSA-N 1 0 259.393 3.774 20 10 CHCDRO Cc1ccc(C)c(C[N@H+](C)CCc2cccs2)c1O ZINC001140182518 1131674642 /nfs/dbraw/zinc/67/46/42/1131674642.db2.gz UDRRKYGJRLBFNM-UHFFFAOYSA-N 1 0 275.417 3.745 20 10 CHCDRO Oc1ccc(Br)cc1C[N@@H+]1CCC12CCCC2 ZINC000846000143 1131676408 /nfs/dbraw/zinc/67/64/08/1131676408.db2.gz NIFWISLFKYKTBL-UHFFFAOYSA-N 1 0 296.208 3.673 20 10 CHCDRO Cc1ccccc1C1([NH2+]Cc2ccccc2O)CCC1 ZINC000845994687 1131679097 /nfs/dbraw/zinc/67/90/97/1131679097.db2.gz ILDOJVOYSKXTOJ-UHFFFAOYSA-N 1 0 267.372 3.870 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@H]1CSCc3ccccc31)CC2 ZINC000834545327 1131682784 /nfs/dbraw/zinc/68/27/84/1131682784.db2.gz YETYRCYXXDWMES-HOTGVXAUSA-N 1 0 297.423 3.957 20 10 CHCDRO CN(C)c1ccc(C[NH+]2CCC3(CC3(F)F)CC2)cc1F ZINC000846054259 1131685270 /nfs/dbraw/zinc/68/52/70/1131685270.db2.gz JJRZFWQHDCWFLL-UHFFFAOYSA-N 1 0 298.352 3.513 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)cc1C)c1ccncc1 ZINC000834590140 1131685775 /nfs/dbraw/zinc/68/57/75/1131685775.db2.gz RGVHMJGRGQCWBU-GOSISDBHSA-N 1 0 283.419 3.697 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]CC1(c3cccc(F)c3)CC1)CC2 ZINC000834598602 1131686429 /nfs/dbraw/zinc/68/64/29/1131686429.db2.gz RGJMKLKKGPYUKT-MRXNPFEDSA-N 1 0 297.373 3.840 20 10 CHCDRO Cc1ccc2c(c1)[C@@H]([NH2+][C@@H]1CCc3cccc(O)c31)CC2 ZINC000834639751 1131689917 /nfs/dbraw/zinc/68/99/17/1131689917.db2.gz ASQRMYFGIKFAKU-DLBZAZTESA-N 1 0 279.383 3.965 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1cccc(OC)c1O)c1ccncc1 ZINC000846148604 1131691247 /nfs/dbraw/zinc/69/12/47/1131691247.db2.gz RQLGMIHBHIXEOG-DOMZBBRYSA-N 1 0 286.375 3.598 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CCc2c(C)cccc2C)c1O ZINC000846152711 1131691859 /nfs/dbraw/zinc/69/18/59/1131691859.db2.gz CQHYPZNRJPXOCV-OAHLLOKOSA-N 1 0 299.414 3.911 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H]2C[C@H]2Cc2ccccc2)c1O ZINC000846155981 1131691956 /nfs/dbraw/zinc/69/19/56/1131691956.db2.gz RIUVCNGIYRAMAI-YSVLISHTSA-N 1 0 297.398 3.683 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]C2CCC(F)(F)CC2)c1O ZINC000846158340 1131691986 /nfs/dbraw/zinc/69/19/86/1131691986.db2.gz WREQSFOKEIGRAR-JTQLQIEISA-N 1 0 285.334 3.629 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CCc2ccc(C)cc2)c1O ZINC000846153343 1131692012 /nfs/dbraw/zinc/69/20/12/1131692012.db2.gz XCXBSODYBZICRI-CQSZACIVSA-N 1 0 285.387 3.603 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]C2CCC3(CC3)CC2)c1O ZINC000846167093 1131692804 /nfs/dbraw/zinc/69/28/04/1131692804.db2.gz SWPWUPAELUJDNZ-GFCCVEGCSA-N 1 0 275.392 3.774 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]C[C@H]2CCC[C@H]2C2CC2)c1O ZINC000846168655 1131693083 /nfs/dbraw/zinc/69/30/83/1131693083.db2.gz LKIQERSVBCLMHD-BJJXKVORSA-N 1 0 289.419 3.878 20 10 CHCDRO CC(C)(C[NH2+][C@H]1CCc2cccc(O)c21)[C@@H]1CCCCO1 ZINC000834680627 1131693238 /nfs/dbraw/zinc/69/32/38/1131693238.db2.gz CYDLMTYWJCUSEO-HOCLYGCPSA-N 1 0 289.419 3.564 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CC2CCC(F)CC2)c1O ZINC000846171178 1131693776 /nfs/dbraw/zinc/69/37/76/1131693776.db2.gz FDLCBXHLHYMHFZ-HIFPTAJRSA-N 1 0 281.371 3.580 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]C[C@@H](C)CC(F)(F)F)c1O ZINC000846172339 1131694164 /nfs/dbraw/zinc/69/41/64/1131694164.db2.gz LGFNNNKDFPIJRO-VHSXEESVSA-N 1 0 291.313 3.640 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]C[C@@H]2CCCCC2(F)F)c1O ZINC000846169356 1131694207 /nfs/dbraw/zinc/69/42/07/1131694207.db2.gz HEONUXDPSVWXKC-RYUDHWBXSA-N 1 0 299.361 3.877 20 10 CHCDRO CCc1ccccc1C[NH2+][C@@H](C)c1cccc(OC)c1O ZINC000846142818 1131695064 /nfs/dbraw/zinc/69/50/64/1131695064.db2.gz CVBMPHXTBQZZGD-ZDUSSCGKSA-N 1 0 285.387 3.814 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H]2CCC[C@H](SC)C2)c1O ZINC000846145107 1131695172 /nfs/dbraw/zinc/69/51/72/1131695172.db2.gz MVZSQWKVKJTURR-AVGNSLFASA-N 1 0 295.448 3.726 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C2(C3CCC3)CC2)c(O)c1C ZINC000846206570 1131696034 /nfs/dbraw/zinc/69/60/34/1131696034.db2.gz FNUJGDWTLKVXFE-CYBMUJFWSA-N 1 0 259.393 3.992 20 10 CHCDRO C[C@]1(F)CCCC[N@H+](Cc2c(O)cccc2Cl)C1 ZINC001140337871 1131702410 /nfs/dbraw/zinc/70/24/10/1131702410.db2.gz KFWGHIWJZVTFPP-AWEZNQCLSA-N 1 0 271.763 3.760 20 10 CHCDRO C[C@H]1CC[N@H+](Cc2c(O)cccc2Cl)CCC1(F)F ZINC001140337955 1131702783 /nfs/dbraw/zinc/70/27/83/1131702783.db2.gz OQISEOIQKKZMPA-JTQLQIEISA-N 1 0 289.753 3.913 20 10 CHCDRO C[C@@]1(F)CCC[N@H+](Cc2c(O)cccc2Cl)CC1 ZINC001140338127 1131702873 /nfs/dbraw/zinc/70/28/73/1131702873.db2.gz VYNGKGTYJDPFQP-CQSZACIVSA-N 1 0 271.763 3.760 20 10 CHCDRO Oc1cccc(Cl)c1C[NH+]1CC2CCC(CC2)C1 ZINC001140342246 1131703675 /nfs/dbraw/zinc/70/36/75/1131703675.db2.gz ZSHUTHQSILFHIJ-UHFFFAOYSA-N 1 0 265.784 3.668 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@H]1Cc3ccc(Cl)cc3C1)CC2 ZINC000834793989 1131706555 /nfs/dbraw/zinc/70/65/55/1131706555.db2.gz LOGGGDUKXSVCHI-HOTGVXAUSA-N 1 0 299.801 3.790 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCCC2CCOCC2)c(O)c1C ZINC000834819588 1131707529 /nfs/dbraw/zinc/70/75/29/1131707529.db2.gz YBDVYEFZKUEIEG-OAHLLOKOSA-N 1 0 291.435 3.866 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccnc(C)c1)c1cc(Cl)ccc1O ZINC000834860112 1131713064 /nfs/dbraw/zinc/71/30/64/1131713064.db2.gz ONBJDOZUHBUXHB-HNNXBMFYSA-N 1 0 290.794 3.990 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)CCCCO)c1cc(Cl)ccc1O ZINC000834877171 1131716421 /nfs/dbraw/zinc/71/64/21/1131716421.db2.gz HCQUJFHAHJZINH-RISCZKNCSA-N 1 0 285.815 3.637 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCO[C@H](C(C)C)C2)c1 ZINC000834887229 1131719752 /nfs/dbraw/zinc/71/97/52/1131719752.db2.gz ZXLCPPUPWRXTGL-MPGHIAIKSA-N 1 0 291.435 3.802 20 10 CHCDRO CC[C@H]([NH2+][C@H]1C[C@@H](C)n2ccnc21)c1ccc(N(C)C)cc1 ZINC000834897578 1131721603 /nfs/dbraw/zinc/72/16/03/1131721603.db2.gz UQFYEPDNMQAGCR-COXVUDFISA-N 1 0 298.434 3.696 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1C[C@@H](C)n2ccnc21)c1ccc(C)cc1O ZINC000834895982 1131721655 /nfs/dbraw/zinc/72/16/55/1131721655.db2.gz RVIDWFLDJIOEBP-VHDGCEQUSA-N 1 0 285.391 3.644 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2C[C@H](C)n3ccnc32)c(O)c1C ZINC000834896493 1131722051 /nfs/dbraw/zinc/72/20/51/1131722051.db2.gz WRWXYOVYEQFNDR-WHOFXGATSA-N 1 0 285.391 3.562 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](C)[C@H](OC)C2CC2)cc1 ZINC000834904441 1131726405 /nfs/dbraw/zinc/72/64/05/1131726405.db2.gz OEBQLHBVZGMQPP-DEYYWGMASA-N 1 0 290.451 3.607 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCC2CC(F)(F)C2)c1 ZINC000834907869 1131728361 /nfs/dbraw/zinc/72/83/61/1131728361.db2.gz DZKXEKNVUQATRY-NSHDSACASA-N 1 0 269.335 3.787 20 10 CHCDRO CCO[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1cc(F)cc(F)c1[O-] ZINC000834915389 1131733270 /nfs/dbraw/zinc/73/32/70/1131733270.db2.gz YICIBOACOWUCCE-COLVAYQJSA-N 1 0 299.361 3.669 20 10 CHCDRO CCO[C@@H]1CCC[C@H]1[NH2+][C@H](C)c1ccc(N(C)CC)cc1 ZINC000834915326 1131733872 /nfs/dbraw/zinc/73/38/72/1131733872.db2.gz XGHWZDGBAWGJKH-ZTFGCOKTSA-N 1 0 290.451 3.751 20 10 CHCDRO C[N@H+](Cc1cccc(F)c1)Cc1ccc(Cl)cc1O ZINC001140461066 1131746849 /nfs/dbraw/zinc/74/68/49/1131746849.db2.gz DDBPARQYANLEMR-UHFFFAOYSA-N 1 0 279.742 3.817 20 10 CHCDRO COc1cccc(C[N@H+](C)Cc2ccc(Cl)cc2O)c1 ZINC001140465103 1131750151 /nfs/dbraw/zinc/75/01/51/1131750151.db2.gz IDJRHGLGEJKNQE-UHFFFAOYSA-N 1 0 291.778 3.686 20 10 CHCDRO C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(Cl)cc2O)C1 ZINC001140464252 1131750925 /nfs/dbraw/zinc/75/09/25/1131750925.db2.gz IOKNLQFAHVTCOC-PHIMTYICSA-N 1 0 253.773 3.524 20 10 CHCDRO C[N@@H+](Cc1ccc(Cl)cc1O)C[C@@H]1CC1(C)C ZINC001140465661 1131751209 /nfs/dbraw/zinc/75/12/09/1131751209.db2.gz QGUQCMFSGZQFBB-NSHDSACASA-N 1 0 253.773 3.524 20 10 CHCDRO CC(C)[N@H+](C/C=C\c1ccc(N(C)C)cc1)C1CC1 ZINC000835026002 1131759495 /nfs/dbraw/zinc/75/94/95/1131759495.db2.gz PTSXBCFOEUXNBR-WAYWQWQTSA-N 1 0 258.409 3.639 20 10 CHCDRO CN(C)c1ccc(/C=C/C[N@H+](C)Cc2ccc(O)cc2)cc1 ZINC000835054764 1131766119 /nfs/dbraw/zinc/76/61/19/1131766119.db2.gz YBCPJKYAEZJENJ-SNAWJCMRSA-N 1 0 296.414 3.603 20 10 CHCDRO Cc1ccncc1C[N@@H+](C)C/C=C/c1ccc(N(C)C)cc1 ZINC000835051084 1131766348 /nfs/dbraw/zinc/76/63/48/1131766348.db2.gz CDOPRNWTPCUROO-AATRIKPKSA-N 1 0 295.430 3.601 20 10 CHCDRO C[N@H+](Cc1ccc(Cl)cc1)Cc1c([O-])cc(F)cc1F ZINC001140583798 1131806748 /nfs/dbraw/zinc/80/67/48/1131806748.db2.gz SQUIFGPAKCGIMQ-UHFFFAOYSA-N 1 0 297.732 3.956 20 10 CHCDRO Cc1cccc(C[N@@H+](C)Cc2c([O-])cc(F)cc2F)c1 ZINC001140582411 1131807666 /nfs/dbraw/zinc/80/76/66/1131807666.db2.gz ILQSGLKWFWBOLQ-UHFFFAOYSA-N 1 0 277.314 3.611 20 10 CHCDRO Cc1ccc2c(c1)CC[N@@H+](Cc1ccc(N(C)C)c(C)c1)C2 ZINC001171330776 1131852477 /nfs/dbraw/zinc/85/24/77/1131852477.db2.gz FNSJBWUJDWSWSW-UHFFFAOYSA-N 1 0 294.442 3.928 20 10 CHCDRO Cc1c(O)ccc(C[N@H+](C)Cc2cccc(Cl)c2)c1O ZINC001140745945 1131905581 /nfs/dbraw/zinc/90/55/81/1131905581.db2.gz QJQFERGPWWTACE-UHFFFAOYSA-N 1 0 291.778 3.692 20 10 CHCDRO Cc1ncc([C@@H](C)[NH2+]Cc2ccc(N(C)C)c(C)c2)s1 ZINC000773000463 1131916158 /nfs/dbraw/zinc/91/61/58/1131916158.db2.gz PTQMEZHEUDGTLM-GFCCVEGCSA-N 1 0 289.448 3.677 20 10 CHCDRO CC[C@@H](C)CC[NH2+]Cc1c(O)cc(C)cc1Cl ZINC001203068660 1131933488 /nfs/dbraw/zinc/93/34/88/1131933488.db2.gz XBEWCDPBONCDMT-SNVBAGLBSA-N 1 0 255.789 3.880 20 10 CHCDRO Cc1ccc(C[N@@H+]2Cc3cccc(C)c3C2)c(O)c1 ZINC001140947875 1131969491 /nfs/dbraw/zinc/96/94/91/1131969491.db2.gz JEYRJNZSAPMMEP-UHFFFAOYSA-N 1 0 253.345 3.525 20 10 CHCDRO Cc1ccc(C[N@H+](C)Cc2nc3ccccc3s2)c(O)c1 ZINC001140947785 1131969557 /nfs/dbraw/zinc/96/95/57/1131969557.db2.gz FTIGNIIRKGWAGJ-UHFFFAOYSA-N 1 0 298.411 3.942 20 10 CHCDRO Cc1ccc(C[N@@H+]2CCC(F)(F)C(C)(C)C2)c(O)c1 ZINC001140948009 1131969947 /nfs/dbraw/zinc/96/99/47/1131969947.db2.gz PDRZCFIZEGQIQC-UHFFFAOYSA-N 1 0 269.335 3.568 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2CCc3c(F)cccc3C2)cc1 ZINC001171410748 1131978926 /nfs/dbraw/zinc/97/89/26/1131978926.db2.gz XSAMFFJTFMQOAD-MRXNPFEDSA-N 1 0 298.405 3.539 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CC12CC2)c1cc(Br)ccc1O ZINC000715222379 1131980594 /nfs/dbraw/zinc/98/05/94/1131980594.db2.gz IZYBXJQYLPJJEH-AAEUAGOBSA-N 1 0 296.208 3.748 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CC12CC2)c1cc(Br)ccc1O ZINC000715222396 1131981314 /nfs/dbraw/zinc/98/13/14/1131981314.db2.gz IZYBXJQYLPJJEH-YPMHNXCESA-N 1 0 296.208 3.748 20 10 CHCDRO Cc1cc(C[NH2+]Cc2ccco2)c(C)n1-c1ccccc1 ZINC000036923321 1131983230 /nfs/dbraw/zinc/98/32/30/1131983230.db2.gz RELIHNYTXKWTQQ-UHFFFAOYSA-N 1 0 280.371 3.977 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)Cc2cccs2)c1 ZINC000036992894 1131985191 /nfs/dbraw/zinc/98/51/91/1131985191.db2.gz REXXBAJHFPVKSL-NWDGAFQWSA-N 1 0 291.416 3.744 20 10 CHCDRO CC[C@H]([NH2+]Cc1cccc(OC)c1O)c1ccc(C)cc1 ZINC000037048169 1131990289 /nfs/dbraw/zinc/99/02/89/1131990289.db2.gz NAMHBBNBEDCFFN-INIZCTEOSA-N 1 0 285.387 3.950 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1ccns1)c1ccccc1O ZINC000715968774 1132000684 /nfs/dbraw/zinc/00/06/84/1132000684.db2.gz VKPYEYKNWFLKFY-ZYHUDNBSSA-N 1 0 262.378 3.651 20 10 CHCDRO COc1ccccc1C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000037195518 1132008828 /nfs/dbraw/zinc/00/88/28/1132008828.db2.gz YISGIWGLTWGGGR-CQSZACIVSA-N 1 0 284.403 3.612 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccccc1F)c1ccc(N(C)C)cc1 ZINC000037200094 1132008925 /nfs/dbraw/zinc/00/89/25/1132008925.db2.gz LTXJBQZJXJRDBY-CQSZACIVSA-N 1 0 286.394 3.785 20 10 CHCDRO Cc1cccc(C[NH2+]C2CC(OCc3ccccc3)C2)c1O ZINC000716213984 1132021913 /nfs/dbraw/zinc/02/19/13/1132021913.db2.gz ZNEBRNGHWWLYKO-UHFFFAOYSA-N 1 0 297.398 3.538 20 10 CHCDRO C[C@H](c1ccc(Cl)cc1)[N@H+](C)Cc1cc(O)ccc1O ZINC001141160556 1132031921 /nfs/dbraw/zinc/03/19/21/1132031921.db2.gz FAYXFMFLPVVVEV-LLVKDONJSA-N 1 0 291.778 3.944 20 10 CHCDRO Cc1ccc2c(c1)C[N@H+](Cc1ccc(N(C)C)cc1)CC2 ZINC001171815606 1132105241 /nfs/dbraw/zinc/10/52/41/1132105241.db2.gz RHORIECDHACHPC-UHFFFAOYSA-N 1 0 280.415 3.619 20 10 CHCDRO C[C@@H]1CC[C@H]([N@@H+]2CCc3cccc(O)c3C2)C[C@H]1C ZINC001172379575 1132170761 /nfs/dbraw/zinc/17/07/61/1132170761.db2.gz ORFCPCVCZOOULJ-NFAWXSAZSA-N 1 0 259.393 3.575 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C2CCC(C(F)F)CC2)c1 ZINC000839178796 1132187861 /nfs/dbraw/zinc/18/78/61/1132187861.db2.gz CNVCSOCNAHGLCI-UHFFFAOYSA-N 1 0 269.335 3.614 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]C2CCC(C(F)F)CC2)c1 ZINC000839179531 1132187911 /nfs/dbraw/zinc/18/79/11/1132187911.db2.gz KPCFIQUDLJOEMG-VOMCLLRMSA-N 1 0 299.361 3.875 20 10 CHCDRO CCC1(c2ccccc2)C[NH+](Cc2cccc(OC)c2O)C1 ZINC000839187654 1132188359 /nfs/dbraw/zinc/18/83/59/1132188359.db2.gz ZBUHDGZSTAZHSM-UHFFFAOYSA-N 1 0 297.398 3.564 20 10 CHCDRO CO[C@H]1C[C@@H]([NH2+]Cc2ccc3ccccc3c2O)C12CCC2 ZINC000839180776 1132188926 /nfs/dbraw/zinc/18/89/26/1132188926.db2.gz WRGXFFLBOFCVAZ-SJORKVTESA-N 1 0 297.398 3.593 20 10 CHCDRO CCOCc1cc(C[NH2+][C@]2(C)CC=CCC2)ccc1OC ZINC000839192142 1132189941 /nfs/dbraw/zinc/18/99/41/1132189941.db2.gz LLUWWNCNLFYHOW-GOSISDBHSA-N 1 0 289.419 3.820 20 10 CHCDRO CC[C@@H]1OCC[C@H]1[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000839190907 1132190096 /nfs/dbraw/zinc/19/00/96/1132190096.db2.gz CFFKZJXIBIQBJH-MJGOQNOKSA-N 1 0 297.398 3.716 20 10 CHCDRO CC(C)OCC[C@@H](C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001172434388 1132208861 /nfs/dbraw/zinc/20/88/61/1132208861.db2.gz PCEZQWZGOSAVHA-MRXNPFEDSA-N 1 0 290.451 3.580 20 10 CHCDRO CC(C)O[C@H]1C[C@@H]([NH2+][C@@H](C)c2cc(Cl)ccc2O)C1 ZINC000840763682 1132283602 /nfs/dbraw/zinc/28/36/02/1132283602.db2.gz JISZPLDAKFUTRF-WCFLWFBJSA-N 1 0 283.799 3.652 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2C[C@@H](OC(C)C)C2)c(O)c1C ZINC000840762385 1132284183 /nfs/dbraw/zinc/28/41/83/1132284183.db2.gz ABQDVTAQTBNWNN-SOUVJXGZSA-N 1 0 277.408 3.616 20 10 CHCDRO CC(C)O[C@H]1C[C@@H]([NH2+][C@H](C)c2cc(Cl)ccc2O)C1 ZINC000840763680 1132284313 /nfs/dbraw/zinc/28/43/13/1132284313.db2.gz JISZPLDAKFUTRF-RTXFEEFZSA-N 1 0 283.799 3.652 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C2CC(C)(C)OC(C)(C)C2)cc1 ZINC001172652410 1132288031 /nfs/dbraw/zinc/28/80/31/1132288031.db2.gz RLUCARAYSPLWET-UHFFFAOYSA-N 1 0 290.451 3.578 20 10 CHCDRO C[C@H]([NH2+][C@@H]1C[C@H]1c1ccccc1F)c1cc(F)ccc1O ZINC000840788792 1132288189 /nfs/dbraw/zinc/28/81/89/1132288189.db2.gz TUBSCVGNNAPDBU-JMPLFQLZSA-N 1 0 289.325 3.877 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1C[C@@H](OC)C12CCC2)c1ccc(C)cc1O ZINC000840807189 1132289244 /nfs/dbraw/zinc/28/92/44/1132289244.db2.gz RANLTACDSWUVBU-USXIJHARSA-N 1 0 289.419 3.699 20 10 CHCDRO COCC[C@@H](C)C[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000840835601 1132291711 /nfs/dbraw/zinc/29/17/11/1132291711.db2.gz OCMHHBVFHLKDEA-KGLIPLIRSA-N 1 0 291.435 3.594 20 10 CHCDRO CCn1ccc(C[NH2+][C@H](C)c2ccc3ccccc3c2O)n1 ZINC000840841529 1132291801 /nfs/dbraw/zinc/29/18/01/1132291801.db2.gz VMMSMVXASXUPCJ-CYBMUJFWSA-N 1 0 295.386 3.613 20 10 CHCDRO CO[C@H]1c2ccccc2C[C@H]1[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000840847849 1132293524 /nfs/dbraw/zinc/29/35/24/1132293524.db2.gz QMVCDAWSQAHGKZ-IRWQIABSSA-N 1 0 297.398 3.664 20 10 CHCDRO CO[C@@](C)([C@H](C)[NH2+][C@H](C)c1ccc(C)c(C)c1O)C1CC1 ZINC000840860569 1132295836 /nfs/dbraw/zinc/29/58/36/1132295836.db2.gz OHBRPUUEMLWHQU-GLJUWKHASA-N 1 0 291.435 3.863 20 10 CHCDRO C[C@H]([NH2+][C@H]1CS[C@H](C)C1)c1cc2c(cc1O)CCCC2 ZINC000840858956 1132296362 /nfs/dbraw/zinc/29/63/62/1132296362.db2.gz FASPFGFTMBFYGK-TYNCELHUSA-N 1 0 291.460 3.816 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCCC[C@H]1F)c1ccc(N(C)C)cc1 ZINC000840876401 1132298740 /nfs/dbraw/zinc/29/87/40/1132298740.db2.gz PVSYEEYAGDRYKA-DAXOMENPSA-N 1 0 264.388 3.684 20 10 CHCDRO CC[C@@H]([NH2+]C1CCC(COC)CC1)c1ccc(C)cc1O ZINC000840875922 1132299970 /nfs/dbraw/zinc/29/99/70/1132299970.db2.gz KXMHZZGOVKZBIQ-VMBOVVBDSA-N 1 0 291.435 3.947 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](C)C2(OC)CCC2)cc1 ZINC000840884073 1132302734 /nfs/dbraw/zinc/30/27/34/1132302734.db2.gz IRLMOUCZDIZXDN-GJZGRUSLSA-N 1 0 290.451 3.751 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCC[C@@H](CO)C1)c1cc(Cl)ccc1O ZINC000840893281 1132305648 /nfs/dbraw/zinc/30/56/48/1132305648.db2.gz FSDZKGRFEWRTDQ-ZLDLUXBVSA-N 1 0 297.826 3.637 20 10 CHCDRO CC[N@H+](CCc1ccccn1)Cc1ccc(N(C)C)cc1C ZINC000840912045 1132307602 /nfs/dbraw/zinc/30/76/02/1132307602.db2.gz ZCCNZNMDSHNANN-UHFFFAOYSA-N 1 0 297.446 3.521 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H]2CCC(F)(F)C2)c(Cl)c1 ZINC000840908543 1132308175 /nfs/dbraw/zinc/30/81/75/1132308175.db2.gz FBAUYJKBSIGTLB-SECBINFHSA-N 1 0 275.726 3.631 20 10 CHCDRO CS[C@@H]1CC[C@@H]([NH2+]Cc2c(O)cc(C)cc2Cl)C1 ZINC000840906177 1132308363 /nfs/dbraw/zinc/30/83/63/1132308363.db2.gz VUBZQPUFMKRIKF-GHMZBOCLSA-N 1 0 285.840 3.728 20 10 CHCDRO CCc1cnccc1[C@H](C)[NH2+]Cc1ccc(N(C)C)cc1C ZINC000840936974 1132309472 /nfs/dbraw/zinc/30/94/72/1132309472.db2.gz PGISUVIEUAPSDI-HNNXBMFYSA-N 1 0 297.446 3.869 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH+]1CCC(C(F)F)CC1 ZINC000840918522 1132310024 /nfs/dbraw/zinc/31/00/24/1132310024.db2.gz UYZDLBGQGPXPJY-UHFFFAOYSA-N 1 0 282.378 3.538 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCC(F)(F)[C@H](C)C1 ZINC000840946168 1132311124 /nfs/dbraw/zinc/31/11/24/1132311124.db2.gz HJRNLQKYPYKCJV-CYBMUJFWSA-N 1 0 282.378 3.538 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@H]2CCCSC2)c(Cl)c1 ZINC000840945640 1132312191 /nfs/dbraw/zinc/31/21/91/1132312191.db2.gz RWNCDBKCZROORM-LLVKDONJSA-N 1 0 285.840 3.587 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CCCC(C)(F)F)c(Cl)c1 ZINC000840949553 1132312417 /nfs/dbraw/zinc/31/24/17/1132312417.db2.gz XIQRQMXZGVBXIS-UHFFFAOYSA-N 1 0 277.742 3.879 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)Cc2ccc(O)cc2)c(Cl)c1 ZINC000840948943 1132312504 /nfs/dbraw/zinc/31/25/04/1132312504.db2.gz NBSHYBAUMAZHAO-UHFFFAOYSA-N 1 0 291.778 3.692 20 10 CHCDRO Cc1cccc(C[N@H+]2CC[C@H](C)C(F)(F)CC2)c1O ZINC001231591165 1132316767 /nfs/dbraw/zinc/31/67/67/1132316767.db2.gz VDLGDXMVWBXYMZ-LBPRGKRZSA-N 1 0 269.335 3.568 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]CC(C)(C)c1cccnc1 ZINC000840976364 1132317094 /nfs/dbraw/zinc/31/70/94/1132317094.db2.gz VHGGQVCSOGCBSB-UHFFFAOYSA-N 1 0 297.446 3.523 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CCCC[C@@H](F)C1 ZINC001231588825 1132318039 /nfs/dbraw/zinc/31/80/39/1132318039.db2.gz 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COc1cc(N(C)C)ccc1C[NH+]1[C@@H](C)CCC[C@@H]1C ZINC001231848672 1132379681 /nfs/dbraw/zinc/37/96/81/1132379681.db2.gz JTJIZPVBNISXPB-KBPBESRZSA-N 1 0 276.424 3.524 20 10 CHCDRO COC(C)(C)[C@H]1CCC[N@@H+]1Cc1cc(Cl)c(C)cc1O ZINC001231870937 1132383829 /nfs/dbraw/zinc/38/38/29/1132383829.db2.gz WOBUVZUACIRTFA-OAHLLOKOSA-N 1 0 297.826 3.743 20 10 CHCDRO CO[C@H](C[NH2+][C@H](C)c1ccc(C)c(C)c1O)CC(C)C ZINC000841754763 1132391258 /nfs/dbraw/zinc/39/12/58/1132391258.db2.gz DIUFOCPJQXXFLI-CABCVRRESA-N 1 0 279.424 3.721 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCC(C)(C)O1)c1ccc(Cl)cc1O ZINC000841751763 1132392849 /nfs/dbraw/zinc/39/28/49/1132392849.db2.gz IZISXESKBINDPY-JQWIXIFHSA-N 1 0 283.799 3.654 20 10 CHCDRO CC(C)C[NH+](Cc1cc(Cl)c(O)cc1O)CC(C)C ZINC001232258742 1132445117 /nfs/dbraw/zinc/44/51/17/1132445117.db2.gz MXTYKRDYYWZWCV-UHFFFAOYSA-N 1 0 285.815 3.865 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@H](C)CC(F)F)c(Cl)c1 ZINC000842728672 1132455569 /nfs/dbraw/zinc/45/55/69/1132455569.db2.gz HEZOLYGFTBHZLC-SECBINFHSA-N 1 0 277.742 3.735 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H](C)CC(F)F)c1cc(Cl)ccc1O ZINC000842889894 1132474665 /nfs/dbraw/zinc/47/46/65/1132474665.db2.gz IHQGFFBBGPGGLU-DTWKUNHWSA-N 1 0 277.742 3.988 20 10 CHCDRO C[C@@H]1CCC[N@H+](Cc2cccc(C(C)(C)C)c2O)C1 ZINC001143102144 1132501525 /nfs/dbraw/zinc/50/15/25/1132501525.db2.gz ZTLYRKHCCJBPNB-CYBMUJFWSA-N 1 0 261.409 3.922 20 10 CHCDRO CC1CC[NH+](Cc2cccc(C(C)(C)C)c2O)CC1 ZINC001143101249 1132502413 /nfs/dbraw/zinc/50/24/13/1132502413.db2.gz CVVZGNBCEVIXGX-UHFFFAOYSA-N 1 0 261.409 3.922 20 10 CHCDRO C[N@H+](Cc1ccccn1)Cc1cccc(C(C)(C)C)c1O ZINC001143103644 1132502688 /nfs/dbraw/zinc/50/26/88/1132502688.db2.gz IHZSZZUIGFAMFZ-UHFFFAOYSA-N 1 0 284.403 3.717 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC[C@H]3CCCC[C@@H]32)c(O)c1 ZINC001232840450 1132528609 /nfs/dbraw/zinc/52/86/09/1132528609.db2.gz XOSMRRLOCKPUFL-PBHICJAKSA-N 1 0 288.435 3.613 20 10 CHCDRO CN(C)c1ccc(C[NH+]2CCCCCCCC2)c(O)c1 ZINC001232841477 1132529389 /nfs/dbraw/zinc/52/93/89/1132529389.db2.gz IABZCVKHPMMNON-UHFFFAOYSA-N 1 0 276.424 3.614 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH+]2CC(C)(CC(F)F)C2)cc1 ZINC000843424600 1132532211 /nfs/dbraw/zinc/53/22/11/1132532211.db2.gz DDXSUBWKNHUFBM-SNAWJCMRSA-N 1 0 294.389 3.743 20 10 CHCDRO Cc1cc(O)c(C[NH+]2CC(C)(CC(F)F)C2)c(Cl)c1 ZINC000843424894 1132532795 /nfs/dbraw/zinc/53/27/95/1132532795.db2.gz PKYZFFJSPIOZTN-UHFFFAOYSA-N 1 0 289.753 3.831 20 10 CHCDRO COc1cccc(O)c1C[N@@H+]1CC2(CC=CC2)[C@H]1C(C)C ZINC000843432591 1132534019 /nfs/dbraw/zinc/53/40/19/1132534019.db2.gz ZERHMGQDIIBKLI-QGZVFWFLSA-N 1 0 287.403 3.577 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CCC23CCCCC3)c1O ZINC001233287735 1132596687 /nfs/dbraw/zinc/59/66/87/1132596687.db2.gz FWZGIHPJXMUUBX-UHFFFAOYSA-N 1 0 295.810 3.963 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CCC[C@@H](C)[C@H](C)C2)c1O ZINC001233287888 1132598110 /nfs/dbraw/zinc/59/81/10/1132598110.db2.gz LJLQVHFZKLLPGD-VXGBXAGGSA-N 1 0 297.826 3.922 20 10 CHCDRO CC[C@H]1CCC[N@@H+]1Cc1ccc(C(F)(F)F)cc1O ZINC001233454267 1132624464 /nfs/dbraw/zinc/62/44/64/1132624464.db2.gz NYICVVNSNBRAOF-LBPRGKRZSA-N 1 0 273.298 3.785 20 10 CHCDRO Oc1cc(C(F)(F)F)ccc1C[N@@H+]1CCC[C@@H](CF)C1 ZINC001233454395 1132625407 /nfs/dbraw/zinc/62/54/07/1132625407.db2.gz TVSAPSHVLCNQAJ-JTQLQIEISA-N 1 0 291.288 3.593 20 10 CHCDRO Nc1ccc(N(Cc2ccccc2)C2=C[NH2+]CCC2)cc1 ZINC001159714203 1132898421 /nfs/dbraw/zinc/89/84/21/1132898421.db2.gz YRXNEZUQJXFPBQ-UHFFFAOYSA-N 1 0 279.387 3.500 20 10 CHCDRO Cc1ccccc1OC1CC[NH+](Cc2ccccc2O)CC1 ZINC001203547487 1133338925 /nfs/dbraw/zinc/33/89/25/1133338925.db2.gz OUGYIDBLNOKAKS-UHFFFAOYSA-N 1 0 297.398 3.744 20 10 CHCDRO CC[N@H+](Cc1ccccc1F)Cc1cccc(OC)c1O ZINC001203596446 1133344540 /nfs/dbraw/zinc/34/45/40/1133344540.db2.gz CCEZOARJCOYZMH-UHFFFAOYSA-N 1 0 289.350 3.562 20 10 CHCDRO COc1ccc(C[N@@H+]2CCC[C@@H]2C2CCCCC2)c(O)c1 ZINC001203629254 1133346484 /nfs/dbraw/zinc/34/64/84/1133346484.db2.gz UMJUGSUOBZYNAQ-QGZVFWFLSA-N 1 0 289.419 3.946 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2cc(Br)ccc2O)C2(CC2)C1 ZINC001203649749 1133347303 /nfs/dbraw/zinc/34/73/03/1133347303.db2.gz FFJHHIXMEVRVGX-JTQLQIEISA-N 1 0 296.208 3.529 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@H+]1C[C@@H]2CC(F)(F)C[C@@H]2C1 ZINC001203651811 1133347477 /nfs/dbraw/zinc/34/74/77/1133347477.db2.gz XHGDRADRUDRHKJ-PHIMTYICSA-N 1 0 287.737 3.523 20 10 CHCDRO CC[N@H+](Cc1cccc(Cl)c1)Cc1ccc(O)c(O)c1 ZINC001203881198 1133378422 /nfs/dbraw/zinc/37/84/22/1133378422.db2.gz NGTZJBCJGGBRFC-UHFFFAOYSA-N 1 0 291.778 3.773 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCCC23CC3)cc1 ZINC001203937268 1133385724 /nfs/dbraw/zinc/38/57/24/1133385724.db2.gz SMNGBDBTTHCEQO-UHFFFAOYSA-N 1 0 258.409 3.661 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCCC[C@H]2COC)cc1 ZINC001203940789 1133386436 /nfs/dbraw/zinc/38/64/36/1133386436.db2.gz ZIEAWYUOYKXOES-SFHVURJKSA-N 1 0 290.451 3.534 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CC[C@@H](OC(C)C)C2)cc1 ZINC001203941594 1133387530 /nfs/dbraw/zinc/38/75/30/1133387530.db2.gz CLQARDGRHHCTEI-GOSISDBHSA-N 1 0 290.451 3.532 20 10 CHCDRO CCCCC1([NH2+]Cc2cc(F)c(N(C)C)cc2F)CC1 ZINC001203993052 1133394847 /nfs/dbraw/zinc/39/48/47/1133394847.db2.gz GDRYQFYLTFWJAC-UHFFFAOYSA-N 1 0 282.378 3.843 20 10 CHCDRO C[C@@H]1CC[C@@H](C)[N@H+](Cc2ccc(Cl)cc2O)C1 ZINC001204164130 1133411652 /nfs/dbraw/zinc/41/16/52/1133411652.db2.gz YNCPEHMOBPNXPL-GHMZBOCLSA-N 1 0 253.773 3.666 20 10 CHCDRO CO[C@@H]1CCC[N@H+](Cc2ccc(N(C)C)c3ccccc23)C1 ZINC001204233277 1133422726 /nfs/dbraw/zinc/42/27/26/1133422726.db2.gz PLXAVDFEOXBYMR-MRXNPFEDSA-N 1 0 298.430 3.517 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)Cc2ccno2)c2ccccc21 ZINC001204239895 1133424709 /nfs/dbraw/zinc/42/47/09/1133424709.db2.gz FJZZHZYAVFAWLF-UHFFFAOYSA-N 1 0 295.386 3.526 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2ccc(N3CCCC3)cc2)[C@@H](C)C1 ZINC001204321156 1133436389 /nfs/dbraw/zinc/43/63/89/1133436389.db2.gz HHQZIIRPZPFCKS-CVEARBPZSA-N 1 0 272.436 3.907 20 10 CHCDRO CCC[NH+](CCC)Cc1ccc(N2CCCC2)cc1 ZINC001204320179 1133436512 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Cc1cc(O)c(C[N@@H+]2CCC3(CCC3)C2)c(Cl)c1 ZINC001205590337 1133592497 /nfs/dbraw/zinc/59/24/97/1133592497.db2.gz XLQVKDQKZRHCFF-UHFFFAOYSA-N 1 0 265.784 3.730 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH+]1CC(C2CCCC2)C1 ZINC001206195020 1133669204 /nfs/dbraw/zinc/66/92/04/1133669204.db2.gz OFIVXOBKSRLESY-UHFFFAOYSA-N 1 0 272.436 3.683 20 10 CHCDRO Cc1cc(F)c(C[NH2+]Cc2cc(Cl)ccc2O)c(F)c1 ZINC001206516672 1133713282 /nfs/dbraw/zinc/71/32/82/1133713282.db2.gz BNLCWJJCOOWICR-UHFFFAOYSA-N 1 0 297.732 3.922 20 10 CHCDRO CS[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(N(C)C)cc1C ZINC001206523078 1133713874 /nfs/dbraw/zinc/71/38/74/1133713874.db2.gz CYZYNDBLALUNPK-IAGOWNOFSA-N 1 0 292.492 3.825 20 10 CHCDRO COc1cc(C)cc(C[N@H+](C)C[C@@H](C)C(C)(C)C)c1O ZINC001207476311 1133805538 /nfs/dbraw/zinc/80/55/38/1133805538.db2.gz SRXIXNYSZBGLGZ-CYBMUJFWSA-N 1 0 279.424 3.823 20 10 CHCDRO CC[N@H+](CCCc1cccnc1)Cc1ccc(N(C)C)cc1 ZINC001209184076 1133984727 /nfs/dbraw/zinc/98/47/27/1133984727.db2.gz JIMRKWJKYXOPBX-UHFFFAOYSA-N 1 0 297.446 3.602 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(CN(C)Cc2ccno2)cc1 ZINC001209520449 1134033698 /nfs/dbraw/zinc/03/36/98/1134033698.db2.gz XBGCGDCNWSOMAT-UHFFFAOYSA-N 1 0 295.386 3.714 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(C[N@@H+](C)CC2(C)COC2)cc1 ZINC001209517825 1134034135 /nfs/dbraw/zinc/03/41/35/1134034135.db2.gz KNTMWDOYIOUYCJ-UHFFFAOYSA-N 1 0 298.430 3.562 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(CN2CCC(=O)[C@H](C)C2)cc1 ZINC001209519448 1134034356 /nfs/dbraw/zinc/03/43/56/1134034356.db2.gz UWQHDFDGOVAQKG-CQSZACIVSA-N 1 0 296.414 3.505 20 10 CHCDRO CC[N@H+](Cc1c(C)[nH]c2ncccc12)Cc1ccccc1O ZINC001209592225 1134041705 /nfs/dbraw/zinc/04/17/05/1134041705.db2.gz DNWGHJMADABEAL-UHFFFAOYSA-N 1 0 295.386 3.599 20 10 CHCDRO CC[C@@H](C[NH2+]Cc1ccc(N(C)C)cc1)CC(F)(F)F ZINC000402506197 1134657729 /nfs/dbraw/zinc/65/77/29/1134657729.db2.gz BDQZQMCUHWHGJF-GFCCVEGCSA-N 1 0 288.357 3.821 20 10 CHCDRO CC[C@H](C[NH2+][C@@H]1CCc2cccc(O)c21)CC(F)(F)F ZINC000402657298 1134669876 /nfs/dbraw/zinc/66/98/76/1134669876.db2.gz JJSWRISMMWBODV-CMPLNLGQSA-N 1 0 287.325 3.948 20 10 CHCDRO CO[C@H](C[NH2+][C@@H](C)c1ccccc1O)c1ccc(F)cc1 ZINC000183613701 1134672667 /nfs/dbraw/zinc/67/26/67/1134672667.db2.gz WYNGLNAUEUXHML-YVEFUNNKSA-N 1 0 289.350 3.570 20 10 CHCDRO O=C1C=CC(=NNc2ccccc2)C(O[C@@H]2CCC[NH2+]C2)=C1 ZINC001217962844 1135032092 /nfs/dbraw/zinc/03/20/92/1135032092.db2.gz HIFLUEKSTTWBEI-FZFLATATSA-N 1 0 297.358 3.938 20 10 CHCDRO C[C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1Oc1ccc(N)cc1 ZINC001217967702 1135032377 /nfs/dbraw/zinc/03/23/77/1135032377.db2.gz UAGDOVWEJLHWBR-KXBFYZLASA-N 1 0 296.414 3.558 20 10 CHCDRO C[C@@H]1C[C@@H](Oc2ccc(NN=C3C=CC(=O)C=C3)cc2)C[NH2+]1 ZINC001218039523 1135047851 /nfs/dbraw/zinc/04/78/51/1135047851.db2.gz BJEBXWKUEDZQIS-SJKOYZFVSA-N 1 0 297.358 3.937 20 10 CHCDRO CCC[C@H](Oc1ccc(N2CC[NH2+]CC2)cc1)C(C)(C)C ZINC001218294022 1135080424 /nfs/dbraw/zinc/08/04/24/1135080424.db2.gz RDWJAZMTSULVSH-KRWDZBQOSA-N 1 0 290.451 3.690 20 10 CHCDRO O=C1C=CC=CC1=NNc1ccccc1O[C@H]1C=CC[NH2+]C1 ZINC001218330096 1135089839 /nfs/dbraw/zinc/08/98/39/1135089839.db2.gz ACSJMIRBXLTMFV-XEXOPBTESA-N 1 0 295.342 3.714 20 10 CHCDRO C[C@@H]1[NH2+]C[C@@H]1Oc1ccc(/N=N/c2ccccc2)cc1 ZINC001218389375 1135097736 /nfs/dbraw/zinc/09/77/36/1135097736.db2.gz VIFKTUNXHJFNLO-HCOTZBLQSA-N 1 0 267.332 3.841 20 10 CHCDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+][C@@H](CO)c1ccccc1 ZINC000318946864 1135181120 /nfs/dbraw/zinc/18/11/20/1135181120.db2.gz HXPGPUQQEXMJIB-BPUTZDHNSA-N 1 0 297.398 3.572 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H]2CCc3ccccc32)cc1 ZINC000020129633 171018177 /nfs/dbraw/zinc/01/81/77/171018177.db2.gz STXGDVUGZRHDKH-SFHVURJKSA-N 1 0 266.388 3.530 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H]2CCc3ccccc32)c1O ZINC000020129767 171018668 /nfs/dbraw/zinc/01/86/68/171018668.db2.gz HOPFTPJWVTZHOY-MRXNPFEDSA-N 1 0 283.371 3.568 20 10 CHCDRO COc1cccc(C[NH2+][C@@H]2CCCc3ccccc32)c1O ZINC000020133581 171021181 /nfs/dbraw/zinc/02/11/81/171021181.db2.gz OQMOFMJFLDMJHU-MRXNPFEDSA-N 1 0 283.371 3.568 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)CCc1ccco1)c1ccccc1O ZINC000020144728 171030451 /nfs/dbraw/zinc/03/04/51/171030451.db2.gz XJTOQXRKKKWXJF-QWHCGFSZSA-N 1 0 259.349 3.657 20 10 CHCDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]Cc1ccco1 ZINC000022146680 171356834 /nfs/dbraw/zinc/35/68/34/171356834.db2.gz MYTCQOLVZRPEPD-WCQYABFASA-N 1 0 257.333 3.632 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)Cc2cccs2)cc1C ZINC000035254060 172083120 /nfs/dbraw/zinc/08/31/20/172083120.db2.gz PQKTYIKHFSDJTM-CYBMUJFWSA-N 1 0 275.417 3.786 20 10 CHCDRO c1ccc(C[NH2+]Cc2ccc(N3CCCC3)cc2)cc1 ZINC000035275534 172095149 /nfs/dbraw/zinc/09/51/49/172095149.db2.gz YCJNPJVTROXMBY-UHFFFAOYSA-N 1 0 266.388 3.577 20 10 CHCDRO c1ccc(CC[NH2+]Cc2ccc(N3CCCC3)cc2)cc1 ZINC000035275561 172095197 /nfs/dbraw/zinc/09/51/97/172095197.db2.gz FTYPDVWBKBIFBQ-UHFFFAOYSA-N 1 0 280.415 3.619 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)c2cc(C)ccc2O)cc1 ZINC000035628710 172308504 /nfs/dbraw/zinc/30/85/04/172308504.db2.gz DUZBBNITNDGOQS-CQSZACIVSA-N 1 0 255.361 3.860 20 10 CHCDRO C[C@@H]([NH2+]CC1CCCCC1)c1ccc(N(C)C)cc1 ZINC000037255180 173066088 /nfs/dbraw/zinc/06/60/88/173066088.db2.gz OKXRATHNDRGMJH-CQSZACIVSA-N 1 0 260.425 3.984 20 10 CHCDRO COc1ccc(C[NH2+]Cc2ccccc2C)cc1C ZINC000037489239 173231079 /nfs/dbraw/zinc/23/10/79/173231079.db2.gz ITJWRUAZVKPURV-UHFFFAOYSA-N 1 0 255.361 3.602 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H](C)c2ccccc2C)c1 ZINC000071406416 176155742 /nfs/dbraw/zinc/15/57/42/176155742.db2.gz DOZOABBJCHYAGX-CQSZACIVSA-N 1 0 255.361 3.860 20 10 CHCDRO CC[C@@H](COC)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000079758236 260176383 /nfs/dbraw/zinc/17/63/83/260176383.db2.gz AXJILDIAQNQPLA-OCCSQVGLSA-N 1 0 273.376 3.621 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CC2(CCOC)CC2)cc1 ZINC000090537121 260462039 /nfs/dbraw/zinc/46/20/39/260462039.db2.gz RUMGKVKMIFKUEY-OAHLLOKOSA-N 1 0 290.451 3.610 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccco1)c1ccc(N(C)C)cc1 ZINC000152038537 261058607 /nfs/dbraw/zinc/05/86/07/261058607.db2.gz XQAGDJRHUAISCH-MRXNPFEDSA-N 1 0 258.365 3.587 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C2(c3cccc(F)c3)CC2)cc1 ZINC000152862560 261070774 /nfs/dbraw/zinc/07/07/74/261070774.db2.gz UBEOJPBBNSXIQI-UHFFFAOYSA-N 1 0 284.378 3.671 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)CC(C)(C)OC)c1ccccc1O ZINC000156052725 261112534 /nfs/dbraw/zinc/11/25/34/261112534.db2.gz SMOLYRDZQXHDDK-TZMCWYRMSA-N 1 0 265.397 3.637 20 10 CHCDRO CC[N@H+](Cc1scnc1C)Cc1ccc(N(C)C)cc1 ZINC000156848927 261133685 /nfs/dbraw/zinc/13/36/85/261133685.db2.gz WTALKJGHZMAQFM-UHFFFAOYSA-N 1 0 289.448 3.540 20 10 CHCDRO COc1cccc(C[N@@H+]2CCC[C@H]2c2cccs2)c1O ZINC000162703436 261291503 /nfs/dbraw/zinc/29/15/03/261291503.db2.gz SNCCVICAGOQUOK-ZDUSSCGKSA-N 1 0 289.400 3.799 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C2CCSCC2)cc1 ZINC000180513031 261863991 /nfs/dbraw/zinc/86/39/91/261863991.db2.gz BHZILOJNMFITOT-ZDUSSCGKSA-N 1 0 278.465 3.689 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCC[C@H]2CCCCO2)c(O)c1 ZINC000183985612 262003746 /nfs/dbraw/zinc/00/37/46/262003746.db2.gz VUXKIFWSSLLDGS-HUUCEWRRSA-N 1 0 277.408 3.701 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)c1cc(Cl)ccc1O)c1cccnc1 ZINC000184882941 262032296 /nfs/dbraw/zinc/03/22/96/262032296.db2.gz ZQOOGRWAMSNWJC-QWRGUYRKSA-N 1 0 276.767 3.852 20 10 CHCDRO CC(=O)Nc1ccc(C[NH2+][C@@H](C)c2ccc(C)cc2O)cc1 ZINC000184916434 262033472 /nfs/dbraw/zinc/03/34/72/262033472.db2.gz SYRODAFNBVPLRY-ZDUSSCGKSA-N 1 0 298.386 3.510 20 10 CHCDRO CC(=O)Nc1cccc(C[NH2+][C@@H](C)c2ccc(C)cc2O)c1 ZINC000185021114 262037955 /nfs/dbraw/zinc/03/79/55/262037955.db2.gz UYRGZESSFGJLBC-ZDUSSCGKSA-N 1 0 298.386 3.510 20 10 CHCDRO CO[C@@H](C[NH2+][C@H](C)c1ccc(C)cc1O)c1ccccc1 ZINC000185102006 262040821 /nfs/dbraw/zinc/04/08/21/262040821.db2.gz NCKDFIKUZPOZOO-KDOFPFPSSA-N 1 0 285.387 3.739 20 10 CHCDRO CCc1nc(CC[NH2+][C@@H](C)c2cc(C)ccc2O)cs1 ZINC000185310629 262050398 /nfs/dbraw/zinc/05/03/98/262050398.db2.gz BCKKSORAVKSMTR-LBPRGKRZSA-N 1 0 290.432 3.613 20 10 CHCDRO Cc1noc(C)c1C[C@@H](C)[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000185501758 262056929 /nfs/dbraw/zinc/05/69/29/262056929.db2.gz TVWSZVLNEBLQAA-NEPJUHHUSA-N 1 0 288.391 3.587 20 10 CHCDRO COc1cc(C)ccc1C[NH2+][C@H](C)c1ccc(F)cc1[O-] ZINC000185714693 262067983 /nfs/dbraw/zinc/06/79/83/262067983.db2.gz JXRJCMALENCVGX-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc([C@H](C)O)cc1)c1ccccc1O ZINC000186127399 262081345 /nfs/dbraw/zinc/08/13/45/262081345.db2.gz QOZSRGOEINITQY-SUMWQHHRSA-N 1 0 285.387 3.686 20 10 CHCDRO COc1cc(F)cc(C[NH2+][C@H](C)c2ccc(C)cc2O)c1 ZINC000186216876 262084747 /nfs/dbraw/zinc/08/47/47/262084747.db2.gz YSURJYHGYNXSLA-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)[C@@H]1CCOC1)c1cccc(Cl)c1[O-] ZINC000287850611 263102882 /nfs/dbraw/zinc/10/28/82/263102882.db2.gz WSWOTKSTSNZCDU-GYSYKLTISA-N 1 0 283.799 3.511 20 10 CHCDRO Cc1c[nH+]ccc1N1CC=C(c2ccc(Cl)nc2)CC1 ZINC000370554061 267327875 /nfs/dbraw/zinc/32/78/75/267327875.db2.gz MLRVQJODNBVTJS-UHFFFAOYSA-N 1 0 285.778 3.732 20 10 CHCDRO COc1cccc(C[NH2+][C@@H]2C[C@H](c3ccccc3)[C@@H]2C)c1O ZINC000370560412 267327905 /nfs/dbraw/zinc/32/79/05/267327905.db2.gz YODKBIVPKCSAAH-RRQGHBQHSA-N 1 0 297.398 3.683 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H](c2ccccc2)[C@H]2CCOC2)c1 ZINC000374472287 267793677 /nfs/dbraw/zinc/79/36/77/267793677.db2.gz PMFHVGRNOMDROK-QFBILLFUSA-N 1 0 297.398 3.568 20 10 CHCDRO CCc1ccc([C@H](COC)[NH2+][C@@H](C)c2ccccc2O)o1 ZINC000183530151 327820320 /nfs/dbraw/zinc/82/03/20/327820320.db2.gz FCNMNCRQAMFMOX-WFASDCNBSA-N 1 0 289.375 3.586 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H]2CCC[C@H](SC)C2)c1O ZINC000117395180 327831360 /nfs/dbraw/zinc/83/13/60/327831360.db2.gz VUURVNJGQIIBHQ-KGLIPLIRSA-N 1 0 295.448 3.555 20 10 CHCDRO COC[C@@H]([NH2+][C@H](C)c1ccc(C)cc1O)c1ccc(C)o1 ZINC000185630829 327841696 /nfs/dbraw/zinc/84/16/96/327841696.db2.gz SLOMKYBQJJBJIL-UKRRQHHQSA-N 1 0 289.375 3.640 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCc2ccc(Cl)nc2)c1 ZINC000185750510 327844232 /nfs/dbraw/zinc/84/42/32/327844232.db2.gz VKRHWBBGTMKSEJ-GFCCVEGCSA-N 1 0 290.794 3.642 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+][C@@H]2CCOC3(CCC3)C2)c(O)c1 ZINC000285134383 328247358 /nfs/dbraw/zinc/24/73/58/328247358.db2.gz LOFPBIHZDGZPAZ-HUUCEWRRSA-N 1 0 289.419 3.761 20 10 CHCDRO CC(C)OCC[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000168882682 327489334 /nfs/dbraw/zinc/48/93/34/327489334.db2.gz RLLQKYFYCKYJQW-ZDUSSCGKSA-N 1 0 273.376 3.621 20 10 CHCDRO C[C@@H]([NH2+][C@H](c1ccccn1)C1CCC1)c1ccccc1O ZINC000527969826 330301641 /nfs/dbraw/zinc/30/16/41/330301641.db2.gz RUWQXENOIGXSBL-ACJLOTCBSA-N 1 0 282.387 3.979 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H](C)c1ccoc1 ZINC000530413109 333546871 /nfs/dbraw/zinc/54/68/71/333546871.db2.gz JQCAXRBKLHTEND-CYBMUJFWSA-N 1 0 268.360 3.931 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1CC[C@@H]1C1CC1 ZINC000554097449 334412432 /nfs/dbraw/zinc/41/24/32/334412432.db2.gz ZBKYEIBQFUHZMO-HZPDHXFCSA-N 1 0 268.404 3.765 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1cnn(C)c1)c1ccc2ccccc2c1O ZINC000273366858 334764790 /nfs/dbraw/zinc/76/47/90/334764790.db2.gz BRUFTYRQYWQBGO-QWHCGFSZSA-N 1 0 295.386 3.691 20 10 CHCDRO CCCC[C@@H](C)[NH2+][C@H](C)c1cc(OC)ccc1O ZINC000050886955 521011537 /nfs/dbraw/zinc/01/15/37/521011537.db2.gz SXIOGTAZOKLCKU-VXGBXAGGSA-N 1 0 251.370 3.630 20 10 CHCDRO CCCC[C@H](C)[NH2+][C@@H](C)c1cc(OC)ccc1O ZINC000050886954 521152474 /nfs/dbraw/zinc/15/24/74/521152474.db2.gz SXIOGTAZOKLCKU-RYUDHWBXSA-N 1 0 251.370 3.630 20 10 CHCDRO CC[C@H]([NH2+]CC1CC(F)(F)C1)c1ccc(N(C)C)cc1 ZINC000293624197 522571884 /nfs/dbraw/zinc/57/18/84/522571884.db2.gz JVCFKZZQMBAAOE-HNNXBMFYSA-N 1 0 282.378 3.839 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@H]2CCSC2)cc1 ZINC000280208439 520283480 /nfs/dbraw/zinc/28/34/80/520283480.db2.gz VZDGMEOXBGCOKH-ZIAGYGMSSA-N 1 0 278.465 3.546 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2ccco2)cc1 ZINC000035136787 520911858 /nfs/dbraw/zinc/91/18/58/520911858.db2.gz MQWFRMNIPFAQKJ-CQSZACIVSA-N 1 0 272.392 3.977 20 10 CHCDRO CCOC1(C)CC[NH+](Cc2cc(Cl)cc(C)c2O)CC1 ZINC000292749718 521636236 /nfs/dbraw/zinc/63/62/36/521636236.db2.gz IHTYDIZBLMGJQU-UHFFFAOYSA-N 1 0 297.826 3.745 20 10 CHCDRO COc1cc(Cl)cc(C[N@H+](C)Cc2occc2C)c1O ZINC000292827660 522538144 /nfs/dbraw/zinc/53/81/44/522538144.db2.gz QTLDPDTUDYRQRD-UHFFFAOYSA-N 1 0 295.766 3.588 20 10 CHCDRO CC[C@H]([NH2+]CC[C@H]1CCO[C@@H](C)C1)c1ccccc1O ZINC000274776064 522599654 /nfs/dbraw/zinc/59/96/54/522599654.db2.gz OAEUXLLVLWDWOB-DZKIICNBSA-N 1 0 277.408 3.638 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1[C@H]2CCO[C@@H]2C1(C)C)c1ccc(C)cc1O ZINC000280241342 522727064 /nfs/dbraw/zinc/72/70/64/522727064.db2.gz VZZWYIJTPPGMRU-WTTBNOFXSA-N 1 0 289.419 3.555 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)C1CCOCC1)c1ccc(C)cc1O ZINC000280282069 522730892 /nfs/dbraw/zinc/73/08/92/522730892.db2.gz YOJYHPGKPFGZJH-CJNGLKHVSA-N 1 0 277.408 3.556 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1ccccn1)c1ccc(C)cc1O ZINC000280119783 522742116 /nfs/dbraw/zinc/74/21/16/522742116.db2.gz OGQHVEPLVUHBEE-HIFRSBDPSA-N 1 0 270.376 3.898 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCOC(C)(C)C1)c1ccc(C)cc1O ZINC000280075639 522756239 /nfs/dbraw/zinc/75/62/39/522756239.db2.gz LJMHBNUNYGGRNA-ZFWWWQNUSA-N 1 0 277.408 3.699 20 10 CHCDRO CC[C@@H]([NH2+]CC1(C)CCOCC1)c1ccc(C)cc1O ZINC000280074062 522817537 /nfs/dbraw/zinc/81/75/37/522817537.db2.gz LGMYEXHWUBWNCY-OAHLLOKOSA-N 1 0 277.408 3.558 20 10 CHCDRO CC[C@@H]([NH2+]CCCCOC(C)C)c1ccc(C)cc1O ZINC000280263967 522826653 /nfs/dbraw/zinc/82/66/53/522826653.db2.gz XKKNMLDTROUDJQ-MRXNPFEDSA-N 1 0 279.424 3.947 20 10 CHCDRO CO[C@H](C)[C@@H](C)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000290234603 523891444 /nfs/dbraw/zinc/89/14/44/523891444.db2.gz RZZCKOGAOBSDNJ-FRRDWIJNSA-N 1 0 273.376 3.619 20 10 CHCDRO Cc1cccc(C[NH2+]C[C@@H]2CCO[C@H]2c2ccccc2)c1O ZINC000192039496 524433274 /nfs/dbraw/zinc/43/32/74/524433274.db2.gz DNZRRGJLEFYJEE-HKUYNNGSSA-N 1 0 297.398 3.568 20 10 CHCDRO C[C@@H](CCc1ccc(O)cc1)[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000297568309 524525909 /nfs/dbraw/zinc/52/59/09/524525909.db2.gz GLCZFRJFGSRMHU-SUMWQHHRSA-N 1 0 297.398 3.696 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@@H](c2ccccc2)C(C)C)c1 ZINC000036967211 524752716 /nfs/dbraw/zinc/75/27/16/524752716.db2.gz CEENPOVZVGOFHF-GOSISDBHSA-N 1 0 285.387 3.888 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccccc2C)c1 ZINC000037718996 525362233 /nfs/dbraw/zinc/36/22/33/525362233.db2.gz KFCBEAGDRDQBMG-CQSZACIVSA-N 1 0 255.361 3.860 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)c1ccccc1O ZINC000248390933 525400203 /nfs/dbraw/zinc/40/02/03/525400203.db2.gz UKWFVBPAEDYNPA-QRTARXTBSA-N 1 0 267.372 3.847 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cccc(F)c1F ZINC000121870184 525446670 /nfs/dbraw/zinc/44/66/70/525446670.db2.gz VRFZWZGORAARLG-LBPRGKRZSA-N 1 0 290.357 3.882 20 10 CHCDRO C[C@@H]([NH2+]CCF)c1ccc(N2CCCCCC2)cc1 ZINC000280918207 525447125 /nfs/dbraw/zinc/44/71/25/525447125.db2.gz DPQOTOKJMMIXCR-CQSZACIVSA-N 1 0 264.388 3.687 20 10 CHCDRO C[C@H]([NH2+]Cc1cccc(F)c1)c1ccc(N(C)C)cc1 ZINC000037246811 525456552 /nfs/dbraw/zinc/45/65/52/525456552.db2.gz MDHFSBJSHVWGHB-ZDUSSCGKSA-N 1 0 272.367 3.743 20 10 CHCDRO C[C@@H]([NH2+]CC[C@H](C)CCO)c1ccc2ccccc2c1O ZINC000297411099 525457138 /nfs/dbraw/zinc/45/71/38/525457138.db2.gz UAZAZFQHMHOCTK-UONOGXRCSA-N 1 0 287.403 3.605 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCCC(F)(F)C1)c1ccccc1O ZINC000282753123 525481261 /nfs/dbraw/zinc/48/12/61/525481261.db2.gz NUZSSLRJUNBSIV-VXGBXAGGSA-N 1 0 269.335 3.868 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1COc2ccccc21)c1ccc(N(C)C)cc1 ZINC000289824629 525489000 /nfs/dbraw/zinc/48/90/00/525489000.db2.gz AIVDGJZDVZVQTE-GDBMZVCRSA-N 1 0 296.414 3.579 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1O ZINC000037775502 525614753 /nfs/dbraw/zinc/61/47/53/525614753.db2.gz RPFBFHMWJZKYGP-NWDGAFQWSA-N 1 0 286.331 3.712 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)c1ccccn1)c1ccc(N(C)C)cc1 ZINC000037218846 525662644 /nfs/dbraw/zinc/66/26/44/525662644.db2.gz GJDMBMGVBMYBJA-ZIAGYGMSSA-N 1 0 269.392 3.559 20 10 CHCDRO Cc1ccsc1C[NH2+][C@H](C)c1cc(F)ccc1O ZINC000094875244 525863085 /nfs/dbraw/zinc/86/30/85/525863085.db2.gz KDXIJHZRZQIPGX-SNVBAGLBSA-N 1 0 265.353 3.752 20 10 CHCDRO COc1cccc(C[NH2+]Cc2ccc(Cl)cc2C)c1O ZINC000289404713 526023465 /nfs/dbraw/zinc/02/34/65/526023465.db2.gz GYPZLEKMNIBGGB-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO COc1cccc(C[NH2+]Cc2ccc3c(c2)CCCC3)c1O ZINC000292725340 526026045 /nfs/dbraw/zinc/02/60/45/526026045.db2.gz FRLWQQODXBSMQY-UHFFFAOYSA-N 1 0 297.398 3.569 20 10 CHCDRO Oc1ccccc1C[NH2+]C[C@@H]1CCCCC(F)(F)C1 ZINC000291778404 526374706 /nfs/dbraw/zinc/37/47/06/526374706.db2.gz UNIGBTDZMCGIPC-GFCCVEGCSA-N 1 0 269.335 3.697 20 10 CHCDRO Oc1ccccc1C[NH2+]C[C@H]1CCCCC(F)(F)C1 ZINC000291778406 526374783 /nfs/dbraw/zinc/37/47/83/526374783.db2.gz UNIGBTDZMCGIPC-LBPRGKRZSA-N 1 0 269.335 3.697 20 10 CHCDRO CCCCC[NH2+][C@@H](C)c1ccc(N2CCOCC2)c(F)c1 ZINC000020582635 570408205 /nfs/dbraw/zinc/40/82/05/570408205.db2.gz BLSHBWOAPIWZTD-AWEZNQCLSA-N 1 0 294.414 3.503 20 10 CHCDRO COc1ccc(C[N@@H+]2CCC[C@@H]3CCCC[C@H]32)c(O)c1 ZINC000228137560 1125462384 /nfs/dbraw/zinc/46/23/84/1125462384.db2.gz WYOFZMLOLXOPHQ-XJKSGUPXSA-N 1 0 275.392 3.555 20 10 CHCDRO Cc1nc(C)c([C@H](C)[N@H+](C)Cc2ccccc2O)s1 ZINC000179572855 1119751185 /nfs/dbraw/zinc/75/11/85/1119751185.db2.gz QMRXSHSSPQDORT-NSHDSACASA-N 1 0 276.405 3.659 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)c(C)c1)[C@@H]1CC1(C)C ZINC001195280417 1122860186 /nfs/dbraw/zinc/86/01/86/1122860186.db2.gz STTLZWWPFQRBIC-HOTGVXAUSA-N 1 0 274.452 3.975 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CC23CCCC3)c(O)c1C ZINC000760040833 1123181197 /nfs/dbraw/zinc/18/11/97/1123181197.db2.gz LUMGYWUOOIJEES-HIFRSBDPSA-N 1 0 259.393 3.992 20 10 CHCDRO C[C@@H]([NH2+]CCCSc1nccs1)C1CC(F)(F)C1 ZINC000862281916 1123797980 /nfs/dbraw/zinc/79/79/80/1123797980.db2.gz ZEJHBNQBMGUZQP-SECBINFHSA-N 1 0 292.420 3.649 20 10 CHCDRO CC[C@H](CSC)[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000794818551 1123959580 /nfs/dbraw/zinc/95/95/80/1123959580.db2.gz UIQRLXUGQICYDF-OCCSQVGLSA-N 1 0 267.438 3.883 20 10 CHCDRO CCCOc1ccc(C[NH2+]C[C@H](CCC)OC)cc1C ZINC001202546643 1125063519 /nfs/dbraw/zinc/06/35/19/1125063519.db2.gz NTTQLAMOGZDUCF-INIZCTEOSA-N 1 0 279.424 3.689 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H](C)CC(C)(C)O)c1O ZINC000834877052 1131716038 /nfs/dbraw/zinc/71/60/38/1131716038.db2.gz SGEQJLZFJAMUST-GHMZBOCLSA-N 1 0 285.815 3.554 20 10 CHCDRO C[C@H]([NH2+]C1CCC(C(F)F)CC1)c1ccccc1O ZINC000840807269 1132288583 /nfs/dbraw/zinc/28/85/83/1132288583.db2.gz RTOYECIKGXLYQI-UNXYVOJBSA-N 1 0 269.335 3.867 20 10 CHCDRO CCSC[C@@H](C)[N@H+](CC)Cc1ccc(N(C)C)cc1 ZINC001173316448 1132477443 /nfs/dbraw/zinc/47/74/43/1132477443.db2.gz XDSHLKUDGXMVFA-CQSZACIVSA-N 1 0 280.481 3.716 20 10 CHCDRO C[C@@H]1CC[C@@H](C)[C@@H]([NH2+]Cc2cc(Cl)ccc2O)C1 ZINC001206517425 1133712535 /nfs/dbraw/zinc/71/25/35/1133712535.db2.gz SYJPATMLBHDLKH-GYSYKLTISA-N 1 0 267.800 3.960 20 10 CHCDRO CCc1oc2ccccc2c1C[NH2+]Cc1ccccc1O ZINC000134236618 1125545825 /nfs/dbraw/zinc/54/58/25/1125545825.db2.gz QNYAKMKZEPJSEE-UHFFFAOYSA-N 1 0 281.355 3.991 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@@H]2CCCC[C@@H]2C(C)C)c1 ZINC000214933910 1125547461 /nfs/dbraw/zinc/54/74/61/1125547461.db2.gz NVVHAGFYXIWMRZ-HZPDHXFCSA-N 1 0 277.408 3.705 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccccc1O)c1nc2ccccc2s1 ZINC000134674440 1125566172 /nfs/dbraw/zinc/56/61/72/1125566172.db2.gz YYEIYKCTGGLSDI-LLVKDONJSA-N 1 0 284.384 3.853 20 10 CHCDRO CC[C@@H](C)[NH2+][C@@H](C)c1cc(Br)ccc1O ZINC000134906440 1125569603 /nfs/dbraw/zinc/56/96/03/1125569603.db2.gz FWDCCVOSVGASAR-BDAKNGLRSA-N 1 0 272.186 3.604 20 10 CHCDRO CC[C@@H](C)[NH2+][C@H](C)c1cc(Br)ccc1O ZINC000134906480 1125570028 /nfs/dbraw/zinc/57/00/28/1125570028.db2.gz FWDCCVOSVGASAR-RKDXNWHRSA-N 1 0 272.186 3.604 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCC[C@@H]([NH+](C)C)C1)c1ccc(Cl)cc1[O-] ZINC000841756181 1125593830 /nfs/dbraw/zinc/59/38/30/1125593830.db2.gz UTTZCKQSJWDYEQ-FPMFFAJLSA-N 1 0 296.842 3.569 20 10 CHCDRO Cc1cc(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)ccn1 ZINC000841757642 1125597283 /nfs/dbraw/zinc/59/72/83/1125597283.db2.gz ODCVDTGQVQYOSQ-NSHDSACASA-N 1 0 276.767 3.600 20 10 CHCDRO COc1ccc(C[N@@H+]2CCC3(C2)CCCCC3)c(O)c1 ZINC000093663766 1125674028 /nfs/dbraw/zinc/67/40/28/1125674028.db2.gz AZWZRPMTXMXVAG-UHFFFAOYSA-N 1 0 275.392 3.557 20 10 CHCDRO CCOc1cccc(C[NH+]2CCC(C(C)C)CC2)c1O ZINC000219825086 1125685353 /nfs/dbraw/zinc/68/53/53/1125685353.db2.gz HABCLSRNVODASK-UHFFFAOYSA-N 1 0 277.408 3.659 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2cc(C3CC3)no2)c(O)c1 ZINC000886684744 1125709023 /nfs/dbraw/zinc/70/90/23/1125709023.db2.gz RFATUKQPYIZTDV-GFCCVEGCSA-N 1 0 286.375 3.725 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CC3(CCC3)CO2)c(O)c1C ZINC000886701335 1125710755 /nfs/dbraw/zinc/71/07/55/1125710755.db2.gz NWXLSVGBLBADDP-HUUCEWRRSA-N 1 0 289.419 3.619 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]C2CCC=CCC2)c1O ZINC000886815684 1125720117 /nfs/dbraw/zinc/72/01/17/1125720117.db2.gz IECXCCYYWASBMY-LBPRGKRZSA-N 1 0 261.365 3.550 20 10 CHCDRO COc1cccc(C[NH+]2CCCCCCCC2)c1O ZINC000322021597 1125764326 /nfs/dbraw/zinc/76/43/26/1125764326.db2.gz CRWFAAOTCVGEIC-UHFFFAOYSA-N 1 0 263.381 3.557 20 10 CHCDRO CCC[N@H+](Cc1ccccc1O)Cc1ncccc1C ZINC000093177558 1125766032 /nfs/dbraw/zinc/76/60/32/1125766032.db2.gz ICXQVPMPRFAQSC-UHFFFAOYSA-N 1 0 270.376 3.508 20 10 CHCDRO COc1cccc(C[N@@H+]2C[C@H](C)[C@H]2c2ccccc2)c1O ZINC000093867533 1125774296 /nfs/dbraw/zinc/77/42/96/1125774296.db2.gz ZBHAQJIOGXDSDZ-GUYCJALGSA-N 1 0 283.371 3.594 20 10 CHCDRO C[N@H+](Cc1cccs1)Cc1cc(Cl)ccc1O ZINC000768160834 1129837362 /nfs/dbraw/zinc/83/73/62/1129837362.db2.gz SQNQARUHRVUZPL-UHFFFAOYSA-N 1 0 267.781 3.739 20 10 CHCDRO CCOc1ccc(C[N@H+](C)C2(C)CCCC2)c(O)c1 ZINC000787334000 1130145064 /nfs/dbraw/zinc/14/50/64/1130145064.db2.gz CCNXIZZKMINEKX-UHFFFAOYSA-N 1 0 263.381 3.555 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]C(C)(C)C(C)C)c1O ZINC000697944765 1126733791 /nfs/dbraw/zinc/73/37/91/1126733791.db2.gz HWHGNGUYZRRSKV-UHFFFAOYSA-N 1 0 271.788 3.578 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](C)c1nccs1)c1ccccc1O ZINC000158098877 1126745736 /nfs/dbraw/zinc/74/57/36/1126745736.db2.gz XRCIKVZWVASLAY-AAEUAGOBSA-N 1 0 276.405 3.693 20 10 CHCDRO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(N(C)C)cc1 ZINC000194619993 1126784471 /nfs/dbraw/zinc/78/44/71/1126784471.db2.gz RZRLMNAQGCHTKN-ZDUSSCGKSA-N 1 0 299.374 3.512 20 10 CHCDRO CSc1ccc(C[N@H+](C)Cc2ccccc2O)s1 ZINC000811457197 1130610213 /nfs/dbraw/zinc/61/02/13/1130610213.db2.gz KHLKIRDKCZKISV-UHFFFAOYSA-N 1 0 279.430 3.808 20 10 CHCDRO CC[C@H]([NH2+]Cc1cccc(NC(C)=O)c1)c1ccccc1O ZINC000183345213 1126885862 /nfs/dbraw/zinc/88/58/62/1126885862.db2.gz XTLADCMNRDSMEZ-KRWDZBQOSA-N 1 0 298.386 3.592 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCc2ccc(Cl)nc2)c(O)c1 ZINC000185751308 1126902105 /nfs/dbraw/zinc/90/21/05/1126902105.db2.gz FRAFFKLQPLUXSS-LBPRGKRZSA-N 1 0 290.794 3.642 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1cc(OC)ccc1O)c1ccncc1 ZINC000185541159 1126900514 /nfs/dbraw/zinc/90/05/14/1126900514.db2.gz FAMWYAVPJXPNRK-BLLLJJGKSA-N 1 0 286.375 3.598 20 10 CHCDRO CCO[C@H](CC[NH2+][C@H](C)c1cc(OC)ccc1O)C(C)C ZINC000185625633 1126901651 /nfs/dbraw/zinc/90/16/51/1126901651.db2.gz UNZSPFYEXPPCQQ-CXAGYDPISA-N 1 0 295.423 3.503 20 10 CHCDRO CCCOc1ccc(C[NH2+]Cc2ccccc2O)c(C)c1 ZINC000188793100 1126926080 /nfs/dbraw/zinc/92/60/80/1126926080.db2.gz LVZVABZMTUGBKM-UHFFFAOYSA-N 1 0 285.387 3.779 20 10 CHCDRO CCOC1CC(CC[NH2+][C@@H](C)c2ccc(C)cc2O)C1 ZINC000189249544 1126929664 /nfs/dbraw/zinc/92/96/64/1126929664.db2.gz DQSKPQBKULOMFL-NFOMZHRRSA-N 1 0 277.408 3.556 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CO)c1ccccc1)c1ccc(N(C)C)cc1 ZINC000268977253 1127030610 /nfs/dbraw/zinc/03/06/10/1127030610.db2.gz BHVFMBYLWQAFMS-MOPGFXCFSA-N 1 0 298.430 3.527 20 10 CHCDRO Cc1ccc([C@H](C)C[NH2+]Cc2cc(C)ccc2O)cc1 ZINC000237532518 1127049298 /nfs/dbraw/zinc/04/92/98/1127049298.db2.gz NRXFXDWVGSXFEB-OAHLLOKOSA-N 1 0 269.388 3.902 20 10 CHCDRO C[C@H]1C[C@H]([NH2+]Cc2cc(-c3ccccc3)ccc2O)CCO1 ZINC000271198796 1127071996 /nfs/dbraw/zinc/07/19/96/1127071996.db2.gz AZLQSNPHHLLBCD-KBXCAEBGSA-N 1 0 297.398 3.716 20 10 CHCDRO CCOc1ccc(C[NH2+][C@H](C)c2ccccc2O)cc1 ZINC000271674974 1127097284 /nfs/dbraw/zinc/09/72/84/1127097284.db2.gz OHBJIZNZDVNQMA-CYBMUJFWSA-N 1 0 271.360 3.642 20 10 CHCDRO CCCN(Cc1cccc(F)c1)c1ccc(C[NH3+])cc1 ZINC000034654676 1127117250 /nfs/dbraw/zinc/11/72/50/1127117250.db2.gz JTUPJIIIPLGCTG-UHFFFAOYSA-N 1 0 272.367 3.701 20 10 CHCDRO C[N@@H+](Cc1c(O)cccc1OC(F)(F)F)CC1CCC1 ZINC001237122309 1131056016 /nfs/dbraw/zinc/05/60/16/1131056016.db2.gz IBWPWXXFBGTWAZ-UHFFFAOYSA-N 1 0 289.297 3.523 20 10 CHCDRO CC[C@@H]([NH2+]CCCc1c(C)noc1C)c1ccccc1O ZINC000156293773 1127137347 /nfs/dbraw/zinc/13/73/47/1127137347.db2.gz OJCGFCKXGGTRIE-MRXNPFEDSA-N 1 0 288.391 3.671 20 10 CHCDRO CCOc1ccc(C[NH2+][C@H](CC)CC(F)(F)F)c(O)c1 ZINC000760660835 1127154904 /nfs/dbraw/zinc/15/49/04/1127154904.db2.gz PVQDPIVGSGTJAZ-LLVKDONJSA-N 1 0 291.313 3.612 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2ccc([C@@H](C)O)cc2)c(O)c1 ZINC000284295396 1127180113 /nfs/dbraw/zinc/18/01/13/1127180113.db2.gz YGQXBPGZRWNLOF-LSDHHAIUSA-N 1 0 299.414 3.913 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CC[C@@H]2CCO[C@H](C)C2)c(O)c1 ZINC000285293289 1127221984 /nfs/dbraw/zinc/22/19/84/1127221984.db2.gz RTRAVUKIILJEEH-OWCLPIDISA-N 1 0 291.435 3.865 20 10 CHCDRO CSC1(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)CC1 ZINC000285441227 1127228409 /nfs/dbraw/zinc/22/84/09/1127228409.db2.gz ZBGOKBVXQSXPRU-GFCCVEGCSA-N 1 0 265.422 3.555 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1c(F)cncc1F)c1ccccc1O ZINC000285826931 1127243740 /nfs/dbraw/zinc/24/37/40/1127243740.db2.gz XLSUEYXHHGOMSL-IINYFYTJSA-N 1 0 292.329 3.867 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000817412061 1131160024 /nfs/dbraw/zinc/16/00/24/1131160024.db2.gz BZBBHTANOTVSFX-SNVBAGLBSA-N 1 0 291.288 3.696 20 10 CHCDRO Cc1ccnc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCCN3C)c1 ZINC000286019604 1127253853 /nfs/dbraw/zinc/25/38/53/1127253853.db2.gz JPPXLXVKSZABLH-OAHLLOKOSA-N 1 0 295.430 3.623 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCCSC2)c(O)c1C ZINC000286999295 1127280776 /nfs/dbraw/zinc/28/07/76/1127280776.db2.gz KAAXZPRIPOGDMW-ZIAGYGMSSA-N 1 0 279.449 3.803 20 10 CHCDRO CC[C@H]([NH2+]CC1CCOCC1)c1cccc(Cl)c1[O-] ZINC000287907921 1127315453 /nfs/dbraw/zinc/31/54/53/1127315453.db2.gz ZZVYFJBSAUQRAP-AWEZNQCLSA-N 1 0 283.799 3.513 20 10 CHCDRO CC[C@@H](CC(F)(F)F)[NH2+][C@@H](C)c1cc(OC)ccc1O ZINC000760905144 1127325214 /nfs/dbraw/zinc/32/52/14/1127325214.db2.gz JEVZFUVSZXSWMK-UWVGGRQHSA-N 1 0 291.313 3.782 20 10 CHCDRO Cc1cc(C)cc(C[NH2+]Cc2ccc(N(C)C)c(F)c2)c1 ZINC000058474522 1127348960 /nfs/dbraw/zinc/34/89/60/1127348960.db2.gz VQJNJPLKLCPMDP-UHFFFAOYSA-N 1 0 286.394 3.798 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2cc(F)ccc2O)cc1F ZINC000226616386 1127412383 /nfs/dbraw/zinc/41/23/83/1127412383.db2.gz GJTYKBIUYBGPKO-LLVKDONJSA-N 1 0 277.314 3.830 20 10 CHCDRO COc1ccc(C[NH2+][C@H]2CCC[C@H](SC)C2)cc1C ZINC000227377365 1127475341 /nfs/dbraw/zinc/47/53/41/1127475341.db2.gz XDOGEBVMUCLEHV-GJZGRUSLSA-N 1 0 279.449 3.767 20 10 CHCDRO Cc1cc(C[N@@H+](C)[C@@H](C)c2cccnc2)ccc1N(C)C ZINC000293749622 1127517106 /nfs/dbraw/zinc/51/71/06/1127517106.db2.gz IOTFSXMOYJIPLC-HNNXBMFYSA-N 1 0 283.419 3.649 20 10 CHCDRO CCCc1nc(C)c(C[NH2+][C@H](C)c2cc(C)ccc2O)o1 ZINC000293785275 1127520056 /nfs/dbraw/zinc/52/00/56/1127520056.db2.gz UDGBDXXCUGGDDF-GFCCVEGCSA-N 1 0 288.391 3.800 20 10 CHCDRO CCc1noc(C)c1C[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000293819807 1127522774 /nfs/dbraw/zinc/52/27/74/1127522774.db2.gz WHYGVEQRCNUKMP-VIFPVBQESA-N 1 0 294.782 3.755 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2ccccc2F)c(O)c1 ZINC000293859377 1127527113 /nfs/dbraw/zinc/52/71/13/1127527113.db2.gz UMPJJNBHERGQAS-ZDUSSCGKSA-N 1 0 273.351 3.999 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2CC[C@@H](C)C[C@@H]2C)cc1Cl ZINC001231870793 1127544417 /nfs/dbraw/zinc/54/44/17/1127544417.db2.gz UFQOUVPCTDFWLR-PWSUYJOCSA-N 1 0 267.800 3.974 20 10 CHCDRO CC[C@H]1CCC[N@H+](Cc2cc(Cl)cc(OC)c2O)C1 ZINC000228630099 1127576380 /nfs/dbraw/zinc/57/63/80/1127576380.db2.gz XNMFLNZZYHFXNK-NSHDSACASA-N 1 0 283.799 3.676 20 10 CHCDRO COc1cc(O)c(C[NH2+][C@@H](C)CCC=C(C)C)cc1OC ZINC000295101492 1127620186 /nfs/dbraw/zinc/62/01/86/1127620186.db2.gz SWHHWJBCVXGWRU-ZDUSSCGKSA-N 1 0 293.407 3.634 20 10 CHCDRO Oc1ccccc1C[NH2+]Cc1ccccc1C(F)(F)F ZINC000060942172 1127624866 /nfs/dbraw/zinc/62/48/66/1127624866.db2.gz KGOIPEISPQLQAD-UHFFFAOYSA-N 1 0 281.277 3.701 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc(F)cnc1Cl)c1ccccc1O ZINC000295176973 1127625481 /nfs/dbraw/zinc/62/54/81/1127625481.db2.gz VCZLXVXVRGOEHL-CYBMUJFWSA-N 1 0 294.757 3.821 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCc2cccc(O)c21)c1ccncc1 ZINC000296241930 1127666439 /nfs/dbraw/zinc/66/64/39/1127666439.db2.gz ATYCAGRNHNKLMQ-GJZGRUSLSA-N 1 0 268.360 3.515 20 10 CHCDRO CCOCCC1(C[NH2+][C@@H]2CCc3cccc(O)c32)CCC1 ZINC000296906776 1127685792 /nfs/dbraw/zinc/68/57/92/1127685792.db2.gz PELHRYLLFQQSHC-OAHLLOKOSA-N 1 0 289.419 3.566 20 10 CHCDRO C[C@@H]([NH2+]CCC(C)(F)F)c1cc2c(cc1O)CCCC2 ZINC000297192104 1127691072 /nfs/dbraw/zinc/69/10/72/1127691072.db2.gz FLZCHPXYFAMQAR-LLVKDONJSA-N 1 0 283.362 3.967 20 10 CHCDRO CCOc1cccc(C[NH2+]CC(C(C)C)C(C)C)c1O ZINC000229528232 1127693918 /nfs/dbraw/zinc/69/39/18/1127693918.db2.gz HVHLMEIADOVJMF-UHFFFAOYSA-N 1 0 279.424 3.809 20 10 CHCDRO CCOc1cccc(C[N@@H+]2C[C@H](C)C[C@@H](C)[C@@H]2C)c1O ZINC000229554506 1127695902 /nfs/dbraw/zinc/69/59/02/1127695902.db2.gz IFLUVVTVPFGWLX-MCIONIFRSA-N 1 0 277.408 3.657 20 10 CHCDRO C[C@@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1ccccc1O ZINC000171926032 1127734659 /nfs/dbraw/zinc/73/46/59/1127734659.db2.gz UXTAPLCSMNYPCO-NSHDSACASA-N 1 0 277.314 3.863 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CC[C@@]2(C1)CCCOC2 ZINC000366942936 1127748705 /nfs/dbraw/zinc/74/87/05/1127748705.db2.gz IYEIGXFVLKTZKP-LJQANCHMSA-N 1 0 297.398 3.548 20 10 CHCDRO CCC1(C[NH2+][C@@H](C)c2cc(F)ccc2O)CCC1 ZINC000230665769 1127770809 /nfs/dbraw/zinc/77/08/09/1127770809.db2.gz WGAJVMWYCCGAJL-NSHDSACASA-N 1 0 251.345 3.762 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@]2(C)CCO[C@H]2C2CC2)c(O)c1 ZINC000372096557 1127788145 /nfs/dbraw/zinc/78/81/45/1127788145.db2.gz TVVFVUIGFJCCSA-KKXDTOCCSA-N 1 0 289.419 3.556 20 10 CHCDRO c1cc(N2CCCCC2)ccc1C[NH2+]CCC1CC1 ZINC000088454652 1127937548 /nfs/dbraw/zinc/93/75/48/1127937548.db2.gz CTKSXDLFMKHNGY-UHFFFAOYSA-N 1 0 258.409 3.567 20 10 CHCDRO COCCC[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000151681558 1128071599 /nfs/dbraw/zinc/07/15/99/1128071599.db2.gz ULGXNADLLNTDKD-MRXNPFEDSA-N 1 0 290.451 3.754 20 10 CHCDRO CC[C@@H](COC)[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000152853545 1128153404 /nfs/dbraw/zinc/15/34/04/1128153404.db2.gz CXXDZBMOECMHOQ-WBVHZDCISA-N 1 0 290.451 3.753 20 10 CHCDRO CC(C)[C@@H]([NH2+]Cc1cccc(Cl)c1[O-])C1CC1 ZINC000324318908 1128173319 /nfs/dbraw/zinc/17/33/19/1128173319.db2.gz XXULVCOYIALRQH-CYBMUJFWSA-N 1 0 253.773 3.570 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ncc(C)cc1C)c1ccc(C)cc1O ZINC000926958114 1128205739 /nfs/dbraw/zinc/20/57/39/1128205739.db2.gz CKTSVHPMZXDERU-MRXNPFEDSA-N 1 0 284.403 3.953 20 10 CHCDRO Cc1nc2c(cccc2CC[NH2+][C@H](C)c2ccccc2O)o1 ZINC000926971926 1128206422 /nfs/dbraw/zinc/20/64/22/1128206422.db2.gz PKEPMAMLSKKQGD-GFCCVEGCSA-N 1 0 296.370 3.735 20 10 CHCDRO Cc1nc2c(cccc2CC[NH2+][C@@H](C)c2ccccc2O)o1 ZINC000926971928 1128206668 /nfs/dbraw/zinc/20/66/68/1128206668.db2.gz PKEPMAMLSKKQGD-LBPRGKRZSA-N 1 0 296.370 3.735 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H](C2CC2)[C@@H]2CCCOC2)c(O)c1 ZINC000927069475 1128215738 /nfs/dbraw/zinc/21/57/38/1128215738.db2.gz MZIWWHFHWUWBIW-JCKWVBRZSA-N 1 0 289.419 3.556 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cccc2c1OCC2)c1ccccc1O ZINC000927091464 1128216258 /nfs/dbraw/zinc/21/62/58/1128216258.db2.gz PKWITHSXBDTDAN-MRXNPFEDSA-N 1 0 283.371 3.568 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cccc2c1OCC2)c1ccc(C)cc1O ZINC000927089508 1128216689 /nfs/dbraw/zinc/21/66/89/1128216689.db2.gz CAGXEMUAXSNVGQ-QGZVFWFLSA-N 1 0 297.398 3.876 20 10 CHCDRO CC1(C)C[C@@H](C[NH2+][C@@H]2CCc3cccc(O)c32)C(C)(C)O1 ZINC000927099380 1128217242 /nfs/dbraw/zinc/21/72/42/1128217242.db2.gz NDIIRQDXZMNLKY-UONOGXRCSA-N 1 0 289.419 3.563 20 10 CHCDRO CC(C)[N@@H+](Cc1c(O)ccc2ccncc21)CC1CC1 ZINC000915207516 1128290081 /nfs/dbraw/zinc/29/00/81/1128290081.db2.gz AZNFYVMIUJCBHN-UHFFFAOYSA-N 1 0 270.376 3.561 20 10 CHCDRO Cc1cc(C)c(O)c(C[NH+]2CCc3ccccc3CC2)c1 ZINC000754740720 1128299918 /nfs/dbraw/zinc/29/99/18/1128299918.db2.gz HKWLGDVAXHZHDL-UHFFFAOYSA-N 1 0 281.399 3.610 20 10 CHCDRO COc1cc(C)cc(C[NH2+]C(C)(C)c2ccccc2)c1O ZINC000754719384 1128298407 /nfs/dbraw/zinc/29/84/07/1128298407.db2.gz BYCPOCDZHKWOIZ-UHFFFAOYSA-N 1 0 285.387 3.734 20 10 CHCDRO Cc1cc([C@H]2CCC[N@@H+]2Cc2cc(C)cc(C)c2O)on1 ZINC000754727544 1128299270 /nfs/dbraw/zinc/29/92/70/1128299270.db2.gz IJMBXFZSWMPXFZ-OAHLLOKOSA-N 1 0 286.375 3.643 20 10 CHCDRO CCCN(CCC)c1ccc(C[NH2+]C(C)(C)[C@@H](C)O)cc1 ZINC000762627771 1128311478 /nfs/dbraw/zinc/31/14/78/1128311478.db2.gz IFZVPVSBMKZPCG-OAHLLOKOSA-N 1 0 292.467 3.562 20 10 CHCDRO COc1ccc(C[NH2+]CC2(c3ccc(F)cc3)CC2)cc1C ZINC000915682718 1128333028 /nfs/dbraw/zinc/33/30/28/1128333028.db2.gz HOIFYHDGFBGDFR-UHFFFAOYSA-N 1 0 299.389 3.964 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@H](C1CC1)C1CCC1)CC2 ZINC000324631660 1128389296 /nfs/dbraw/zinc/38/92/96/1128389296.db2.gz AOCOURXRMKSWAW-YOEHRIQHSA-N 1 0 257.377 3.548 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@@H](C1CC1)C1CCC1)CC2 ZINC000324631658 1128389377 /nfs/dbraw/zinc/38/93/77/1128389377.db2.gz AOCOURXRMKSWAW-RHSMWYFYSA-N 1 0 257.377 3.548 20 10 CHCDRO C[C@@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1ccccc1O ZINC000780793300 1128451291 /nfs/dbraw/zinc/45/12/91/1128451291.db2.gz LCBADQPOALYTCU-PWSUYJOCSA-N 1 0 273.298 3.555 20 10 CHCDRO CCC[C@H](C)CC[C@H](C)[NH2+]Cc1ccc(O)cc1O ZINC001257467234 1128456960 /nfs/dbraw/zinc/45/69/60/1128456960.db2.gz HQHTZRYEEZRHAS-STQMWFEESA-N 1 0 265.397 3.792 20 10 CHCDRO COc1ccc(C[NH2+]CCOc2c(C)cccc2C)cc1C ZINC000916845920 1128458161 /nfs/dbraw/zinc/45/81/61/1128458161.db2.gz WGOVFIXLXUBSEA-UHFFFAOYSA-N 1 0 299.414 3.789 20 10 CHCDRO CCC[C@H](C)CC[C@@H](C)[NH2+]Cc1ccc(O)c(O)c1 ZINC001257472347 1128473061 /nfs/dbraw/zinc/47/30/61/1128473061.db2.gz SJCDMSAIWRXJLD-QWHCGFSZSA-N 1 0 265.397 3.792 20 10 CHCDRO CN(C)c1ccc(C[N@H+](CC2CCCC2)C2CC2)cc1 ZINC000917074993 1128475120 /nfs/dbraw/zinc/47/51/20/1128475120.db2.gz OFIHBTRECLRNND-UHFFFAOYSA-N 1 0 272.436 3.907 20 10 CHCDRO CC[C@@H]([NH2+]CCc1sc(C)nc1C)c1ccccc1O ZINC000155752722 1128613719 /nfs/dbraw/zinc/61/37/19/1128613719.db2.gz QDVUYIXFUQEULN-CQSZACIVSA-N 1 0 290.432 3.749 20 10 CHCDRO COc1ccc(N2CCC([NH2+]CCC(C)(C)C)CC2)cc1 ZINC000155511097 1128607171 /nfs/dbraw/zinc/60/71/71/1128607171.db2.gz NHHKFACAHPTSKX-UHFFFAOYSA-N 1 0 290.451 3.690 20 10 CHCDRO CC[C@H]([NH2+]C[C@](C)(O)CCC(C)C)c1ccccc1O ZINC000155971479 1128621326 /nfs/dbraw/zinc/62/13/26/1128621326.db2.gz QEDWMQIUGNLSMH-DOTOQJQBSA-N 1 0 279.424 3.620 20 10 CHCDRO Oc1cccc(Cl)c1C[NH+]1CCC(C(F)(F)F)CC1 ZINC000156053967 1128624311 /nfs/dbraw/zinc/62/43/11/1128624311.db2.gz YMTXLUIRZSXULF-UHFFFAOYSA-N 1 0 293.716 3.820 20 10 CHCDRO Cc1cccc(C[N@@H+](C)[C@H]2CCc3ccccc32)c1O ZINC000158024665 1128663476 /nfs/dbraw/zinc/66/34/76/1128663476.db2.gz JYRYRQMBLCAZQK-KRWDZBQOSA-N 1 0 267.372 3.820 20 10 CHCDRO Cc1cc(Br)cc([C@H](C)[NH2+]C[C@@H]2C[C@@H]2C)c1O ZINC000779008556 1128676814 /nfs/dbraw/zinc/67/68/14/1128676814.db2.gz RIEOPKAHLLHLJL-LSJOCFKGSA-N 1 0 298.224 3.770 20 10 CHCDRO C[C@@H](C[N@H+](C)Cc1cc(F)ccc1O)c1ccccc1 ZINC000779009931 1128676898 /nfs/dbraw/zinc/67/68/98/1128676898.db2.gz QSWZWOCNPONDEY-ZDUSSCGKSA-N 1 0 273.351 3.767 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CC[C@@H](c2cccc(F)c2)C1 ZINC000779015859 1128682100 /nfs/dbraw/zinc/68/21/00/1128682100.db2.gz XJAYMJYMWDASGE-CYBMUJFWSA-N 1 0 289.325 3.660 20 10 CHCDRO Cc1ccc(CC[NH2+]Cc2ccc3c(c2)CCO3)c(C)c1 ZINC000920868374 1128694143 /nfs/dbraw/zinc/69/41/43/1128694143.db2.gz SWBKYISEOADSRG-UHFFFAOYSA-N 1 0 281.399 3.571 20 10 CHCDRO CC(C)CC[N@H+](C)Cc1cc(C(C)(C)C)cc(O)c1O ZINC000921049414 1128699595 /nfs/dbraw/zinc/69/95/95/1128699595.db2.gz FATDTLZMHCLONG-UHFFFAOYSA-N 1 0 279.424 3.873 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+][C@H](c1cccs1)C1CC1 ZINC000779052670 1128710341 /nfs/dbraw/zinc/71/03/41/1128710341.db2.gz RFCOKLBYDQYBSO-HNNXBMFYSA-N 1 0 277.364 3.834 20 10 CHCDRO COc1ccccc1[C@@H](C)[NH2+]Cc1ccc2c(c1)CCCO2 ZINC000921487883 1128710903 /nfs/dbraw/zinc/71/09/03/1128710903.db2.gz ZWUZJWUNPXDXLH-CQSZACIVSA-N 1 0 297.398 3.871 20 10 CHCDRO C[C@]1([NH2+]Cc2cc(F)ccc2O)CCCc2ccccc21 ZINC000779079424 1128722785 /nfs/dbraw/zinc/72/27/85/1128722785.db2.gz RPEFEWGQMGBNSX-SFHVURJKSA-N 1 0 285.362 3.873 20 10 CHCDRO CC[C@@](C)([NH2+]Cc1cc(F)ccc1O)c1ccccc1 ZINC000779084684 1128725751 /nfs/dbraw/zinc/72/57/51/1128725751.db2.gz JIBVXXWZUFSEEE-QGZVFWFLSA-N 1 0 273.351 3.946 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCSC(F)(F)F)c(O)c1 ZINC000185086470 1117761505 /nfs/dbraw/zinc/76/15/05/1117761505.db2.gz GUPJACXUVCKPCW-SECBINFHSA-N 1 0 279.327 3.604 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]C(C1CCC1)C1CCC1 ZINC000325008832 1117782496 /nfs/dbraw/zinc/78/24/96/1117782496.db2.gz CBFPDNYGBLEVEC-UHFFFAOYSA-N 1 0 263.356 3.590 20 10 CHCDRO CSCCCCC[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000186771072 1117783124 /nfs/dbraw/zinc/78/31/24/1117783124.db2.gz MMKUSGTWGJBIHH-ZDUSSCGKSA-N 1 0 267.438 3.885 20 10 CHCDRO CCc1nc(C[NH2+][C@H](C)c2ccc(C)cc2O)cs1 ZINC000185397311 1117820074 /nfs/dbraw/zinc/82/00/74/1117820074.db2.gz KWQAPNXWEDWYRY-LLVKDONJSA-N 1 0 276.405 3.570 20 10 CHCDRO C[C@H]([NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)c1ccc(F)cc1[O-] ZINC000185471804 1117827001 /nfs/dbraw/zinc/82/70/01/1117827001.db2.gz MIRSFLJMVLYVLM-LRDDRELGSA-N 1 0 296.430 3.548 20 10 CHCDRO CSCCC[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000185490567 1117830703 /nfs/dbraw/zinc/83/07/03/1117830703.db2.gz JYOSWSYLELKRPY-LBPRGKRZSA-N 1 0 279.449 3.675 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H](CCO)c2ccccc2)c1 ZINC000185525219 1117836988 /nfs/dbraw/zinc/83/69/88/1117836988.db2.gz VBUMLLWZVWBSRB-NVXWUHKLSA-N 1 0 299.414 3.517 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H](C)[C@H](C)c2ccccc2)c1 ZINC000237566683 1128743334 /nfs/dbraw/zinc/74/33/34/1128743334.db2.gz KKLSEZLUNWZYJD-GJZGRUSLSA-N 1 0 269.388 3.982 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C2CCSCC2)c(O)c1 ZINC000294895770 1117961407 /nfs/dbraw/zinc/96/14/07/1117961407.db2.gz VOCYKVFPLSJEMX-GFCCVEGCSA-N 1 0 265.422 3.555 20 10 CHCDRO COc1ccc(N2CCC([NH2+]CCCC(C)C)CC2)cc1 ZINC000764754752 1118110656 /nfs/dbraw/zinc/11/06/56/1118110656.db2.gz IUAOURURFPJEDH-UHFFFAOYSA-N 1 0 290.451 3.690 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CC[C@H](C)F)cc1 ZINC000815646014 1118128095 /nfs/dbraw/zinc/12/80/95/1118128095.db2.gz XANBXTZKRGXFGP-QWHCGFSZSA-N 1 0 252.377 3.541 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccnc(Cl)c1 ZINC000765609957 1118182292 /nfs/dbraw/zinc/18/22/92/1118182292.db2.gz SAPBZGGKRDJIHO-LLVKDONJSA-N 1 0 288.778 3.521 20 10 CHCDRO C[C@@H](CSC(C)(C)C)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000765608815 1118182495 /nfs/dbraw/zinc/18/24/95/1118182495.db2.gz LNNCNROTZSVRJL-LBPRGKRZSA-N 1 0 279.449 3.631 20 10 CHCDRO COc1cc(C)ccc1[C@H](C)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000765608797 1118182557 /nfs/dbraw/zinc/18/25/57/1118182557.db2.gz KXZSGRNFXZBDGD-AWEZNQCLSA-N 1 0 297.398 3.789 20 10 CHCDRO CCc1ccc(C[NH2+][C@H](C)c2ccccc2O)cc1 ZINC000179875457 1128763787 /nfs/dbraw/zinc/76/37/87/1128763787.db2.gz JMGVTFMULUVZBC-CYBMUJFWSA-N 1 0 255.361 3.805 20 10 CHCDRO C[N@H+](Cc1ccccc1O)CC1(c2ccccc2)CC1 ZINC000188716923 1128764472 /nfs/dbraw/zinc/76/44/72/1128764472.db2.gz IQFUXMYJPSRBHT-UHFFFAOYSA-N 1 0 267.372 3.556 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CC[C@H]3CCC[C@H]3C2)c1O ZINC001140181943 1118246200 /nfs/dbraw/zinc/24/62/00/1118246200.db2.gz XXUSRHARAXGKIM-CABCVRRESA-N 1 0 259.393 3.631 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCCc3ccccc3C2)c1O ZINC001140182751 1118251936 /nfs/dbraw/zinc/25/19/36/1118251936.db2.gz ZAWCESJUPQVFMS-UHFFFAOYSA-N 1 0 281.399 3.957 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1cc(F)ccc1O)c1c(C)noc1C ZINC000186187614 1118291529 /nfs/dbraw/zinc/29/15/29/1118291529.db2.gz NTLVJJDHVCFSHH-OTYXRUKQSA-N 1 0 292.354 3.938 20 10 CHCDRO Cc1cc(C)cc(C[NH2+]Cc2cc(Cl)ccc2O)c1 ZINC000693164675 1118301953 /nfs/dbraw/zinc/30/19/53/1118301953.db2.gz ATOSGMFCLLMVAA-UHFFFAOYSA-N 1 0 275.779 3.952 20 10 CHCDRO CCOc1cccc(C[N@H+](C)[C@H]2CCc3ccccc32)c1O ZINC000179944267 1128768636 /nfs/dbraw/zinc/76/86/36/1128768636.db2.gz IAKYFJVGEZSPON-KRWDZBQOSA-N 1 0 297.398 3.910 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](C)[C@H](C)C2CC2)cc1Cl ZINC001658124592 1118460966 /nfs/dbraw/zinc/46/09/66/1118460966.db2.gz ORZUSVWPRBLIAR-SNVBAGLBSA-N 1 0 253.773 3.584 20 10 CHCDRO C[C@H]1CCC[C@H]([NH2+]Cc2ccc3c(c2)CCCN3C)C1 ZINC000050286456 1118475301 /nfs/dbraw/zinc/47/53/01/1118475301.db2.gz VSUHCZQKMWKSTN-YOEHRIQHSA-N 1 0 272.436 3.737 20 10 CHCDRO C[C@@H]1CCCCC[C@@H]1[NH2+]Cc1ccc2c(c1)CCO2 ZINC000088509477 1118521097 /nfs/dbraw/zinc/52/10/97/1118521097.db2.gz RZOITFGSWPXROZ-CJNGLKHVSA-N 1 0 259.393 3.680 20 10 CHCDRO CC[C@@H]([NH2+]CC(C1CC1)C1CC1)c1ccccc1O ZINC000088456008 1118521113 /nfs/dbraw/zinc/52/11/13/1118521113.db2.gz UHQIDRUKKXRKHT-MRXNPFEDSA-N 1 0 259.393 3.869 20 10 CHCDRO C[C@H]1CCC[C@H]1C[NH2+]Cc1c(O)cccc1Br ZINC000706847066 1118553190 /nfs/dbraw/zinc/55/31/90/1118553190.db2.gz VFDUJDUGCHTQQM-QWRGUYRKSA-N 1 0 298.224 3.681 20 10 CHCDRO CCc1cccc(C[NH2+][C@@H](C)c2cc(OC)ccc2O)c1 ZINC000189844270 1128786743 /nfs/dbraw/zinc/78/67/43/1128786743.db2.gz YPJTVFOYQMYZQW-ZDUSSCGKSA-N 1 0 285.387 3.814 20 10 CHCDRO CC1(C)CCC[N@@H+]1Cc1c(O)cccc1Br ZINC000707129085 1118640277 /nfs/dbraw/zinc/64/02/77/1118640277.db2.gz DUVSJOTZPFKVRE-UHFFFAOYSA-N 1 0 284.197 3.529 20 10 CHCDRO CC[N@@H+](Cc1cccc(C)c1O)C[C@H](O)c1ccc(C)cc1 ZINC000180419803 1128791313 /nfs/dbraw/zinc/79/13/13/1128791313.db2.gz ZBXDJISERTUCGE-SFHVURJKSA-N 1 0 299.414 3.565 20 10 CHCDRO C[C@H]1CCC[N@H+](Cc2c(O)cccc2Br)CC1 ZINC000707153052 1118650973 /nfs/dbraw/zinc/65/09/73/1118650973.db2.gz SZJUFIGYKWLYLM-NSHDSACASA-N 1 0 298.224 3.777 20 10 CHCDRO C[C@]1(F)CCC[N@H+](Cc2ccc(Cl)cc2O)CC1 ZINC001140461921 1118720420 /nfs/dbraw/zinc/72/04/20/1118720420.db2.gz YJPYOBZMHJIMLO-AWEZNQCLSA-N 1 0 271.763 3.760 20 10 CHCDRO CC(C)[C@@H]1CCC[N@@H+]1Cc1ccc(Cl)cc1O ZINC001140464595 1118736114 /nfs/dbraw/zinc/73/61/14/1118736114.db2.gz WNUUJYMXRANEAS-ZDUSSCGKSA-N 1 0 253.773 3.666 20 10 CHCDRO Oc1cc(Cl)ccc1C[NH+]1CC(c2ccccc2)C1 ZINC001140465220 1118739449 /nfs/dbraw/zinc/73/94/49/1118739449.db2.gz IQWZSXCKGGSNGU-UHFFFAOYSA-N 1 0 273.763 3.645 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)C1CCC1 ZINC000129006651 1118748081 /nfs/dbraw/zinc/74/80/81/1118748081.db2.gz AAKLISNMQUHXFK-CQSZACIVSA-N 1 0 258.409 3.565 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]C/C=C\c2ccccc2)c1 ZINC000588449438 1118791058 /nfs/dbraw/zinc/79/10/58/1118791058.db2.gz IXFYSMKRBGFGGU-DEBLGDTFSA-N 1 0 283.371 3.765 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CC)c1ccccc1O)[C@@H]1CCCOC1 ZINC000723990989 1118797797 /nfs/dbraw/zinc/79/77/97/1118797797.db2.gz YGNUPKRMNGBRLX-BMFZPTHFSA-N 1 0 277.408 3.638 20 10 CHCDRO CC(C)OCCCC[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC000835048295 1118823681 /nfs/dbraw/zinc/82/36/81/1118823681.db2.gz PTQOTCSLQCITON-FPLPWBNLSA-N 1 0 290.451 3.561 20 10 CHCDRO CC[N@H+](Cc1cc(C)c(C)cc1O)[C@@H]1CCOC(C)(C)C1 ZINC000291536356 1118985055 /nfs/dbraw/zinc/98/50/55/1118985055.db2.gz KUZPRJBFPSPSHL-MRXNPFEDSA-N 1 0 291.435 3.789 20 10 CHCDRO C[N@H+](Cc1cc(F)c(F)c(F)c1)Cc1cc(F)ccc1O ZINC000180909853 1128818931 /nfs/dbraw/zinc/81/89/31/1128818931.db2.gz ZNTXAPVCACWMGL-UHFFFAOYSA-N 1 0 299.267 3.581 20 10 CHCDRO C[N@H+](Cc1ccccc1O)Cc1ccccc1OC(F)F ZINC000111236426 1119079333 /nfs/dbraw/zinc/07/93/33/1119079333.db2.gz OHWPHEBYRVSORA-UHFFFAOYSA-N 1 0 293.313 3.626 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCO3)s1 ZINC000049161748 1119087066 /nfs/dbraw/zinc/08/70/66/1119087066.db2.gz MIWZJHDHXMBCIW-GFCCVEGCSA-N 1 0 273.401 3.842 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000176673540 1119092210 /nfs/dbraw/zinc/09/22/10/1119092210.db2.gz KKDDLCSGDOSSES-AWEZNQCLSA-N 1 0 255.361 3.975 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCc2cccc(O)c21)c1ccccc1 ZINC000034398292 1119104933 /nfs/dbraw/zinc/10/49/33/1119104933.db2.gz DRFYWBXOVUIBRS-WFASDCNBSA-N 1 0 253.345 3.730 20 10 CHCDRO [O-]c1cc(F)cc(F)c1C[N@@H+]1CC[C@H](c2ccccc2)C1 ZINC001140582467 1119148355 /nfs/dbraw/zinc/14/83/55/1119148355.db2.gz JAFALQQWJJBLNT-ZDUSSCGKSA-N 1 0 289.325 3.660 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]CCc1ccc(Cl)s1 ZINC000226585190 1119211316 /nfs/dbraw/zinc/21/13/16/1119211316.db2.gz ZQWYFICFGOAOKZ-UHFFFAOYSA-N 1 0 285.771 3.579 20 10 CHCDRO Cc1ccc(O)c(C[N@H+](C)CCc2cccc(F)c2)c1 ZINC001140622870 1119294057 /nfs/dbraw/zinc/29/40/57/1119294057.db2.gz CSLJNHBVKSOGJC-UHFFFAOYSA-N 1 0 273.351 3.514 20 10 CHCDRO CCCC[C@H](CCC)[NH2+]Cc1cccc(O)c1O ZINC000226759990 1119323433 /nfs/dbraw/zinc/32/34/33/1119323433.db2.gz YLNTVLASZBGPGF-ZDUSSCGKSA-N 1 0 251.370 3.546 20 10 CHCDRO C[C@H]([NH2+]Cc1cc(F)cc(F)c1[O-])c1ccsc1 ZINC000708453146 1119467153 /nfs/dbraw/zinc/46/71/53/1119467153.db2.gz DCTRSGPAMAODKR-QMMMGPOBSA-N 1 0 269.316 3.583 20 10 CHCDRO Cn1cccc1[C@H]1CCC[N@@H+]1Cc1cc(Cl)ccc1O ZINC000179706617 1119758273 /nfs/dbraw/zinc/75/82/73/1119758273.db2.gz SCAZZNKMYDKYGS-OAHLLOKOSA-N 1 0 290.794 3.721 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCC[C@@H]2C[C@@H]21)c1ccc(N(C)C)cc1 ZINC000694323731 1119847284 /nfs/dbraw/zinc/84/72/84/1119847284.db2.gz QRQGZMNVSVEDHN-JSQNDZKTSA-N 1 0 258.409 3.592 20 10 CHCDRO C[C@@H]([NH2+]CC[C@H]1CCC(F)(F)C1)c1ccccc1O ZINC000903333097 1120084341 /nfs/dbraw/zinc/08/43/41/1120084341.db2.gz NNZODHAEGNDEND-VXGBXAGGSA-N 1 0 269.335 3.868 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@@H]2CCCS2)cc1 ZINC000168669859 1120094361 /nfs/dbraw/zinc/09/43/61/1120094361.db2.gz IRFMGMFNYWWBBU-CJNGLKHVSA-N 1 0 278.465 3.689 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCCC(F)(F)C1)c1ccccc1O ZINC000695066086 1120100875 /nfs/dbraw/zinc/10/08/75/1120100875.db2.gz MWTCILQVVPLUTA-WDEREUQCSA-N 1 0 255.308 3.621 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]CCc1ccc(Cl)s1)CC2 ZINC000311847778 1120112970 /nfs/dbraw/zinc/11/29/70/1120112970.db2.gz IOLFBJYLTHVMLK-GFCCVEGCSA-N 1 0 293.819 3.927 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)CCCOC(C)C)cc1 ZINC000728688050 1120140237 /nfs/dbraw/zinc/14/02/37/1120140237.db2.gz CCVCOYXFBCKOAP-UHFFFAOYSA-N 1 0 292.467 3.780 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2cccc(C)c2O)s1 ZINC000180036079 1120262736 /nfs/dbraw/zinc/26/27/36/1120262736.db2.gz OXUQIKRIQAEAOG-UHFFFAOYSA-N 1 0 261.390 3.703 20 10 CHCDRO Cc1ccncc1[C@H](C)[NH2+]Cc1ccc2c(c1)CCCO2 ZINC000921960392 1120306812 /nfs/dbraw/zinc/30/68/12/1120306812.db2.gz LNJKOJPASGDJAY-AWEZNQCLSA-N 1 0 282.387 3.566 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cc3ccccc3o2)c1 ZINC000182436939 1120321102 /nfs/dbraw/zinc/32/11/02/1120321102.db2.gz LYMHTXUSRKCQCV-LBPRGKRZSA-N 1 0 297.354 3.998 20 10 CHCDRO COc1ccc(C)cc1CC[NH2+][C@@H](C)c1ccccc1O ZINC000183389803 1120341979 /nfs/dbraw/zinc/34/19/79/1120341979.db2.gz XCLFTOFSUBTIMN-AWEZNQCLSA-N 1 0 285.387 3.603 20 10 CHCDRO COC1(C[NH2+][C@H](C)c2cc(C)ccc2O)CCCCC1 ZINC000186510515 1120351560 /nfs/dbraw/zinc/35/15/60/1120351560.db2.gz SCPVPHYVWMQZNN-CQSZACIVSA-N 1 0 277.408 3.701 20 10 CHCDRO Cc1noc(C)c1[C@H](C)[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000092326527 1120357189 /nfs/dbraw/zinc/35/71/89/1120357189.db2.gz BSWCWBDLNCUZCB-NEPJUHHUSA-N 1 0 287.407 3.769 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1c(C)noc1C)c1ccccc1O ZINC000092327881 1120357419 /nfs/dbraw/zinc/35/74/19/1120357419.db2.gz MXXMWIQLBNGNBV-YGRLFVJLSA-N 1 0 274.364 3.799 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H]2CCC[C@@H](SC)C2)c1O ZINC000117395184 1120359560 /nfs/dbraw/zinc/35/95/60/1120359560.db2.gz VUURVNJGQIIBHQ-ZIAGYGMSSA-N 1 0 295.448 3.555 20 10 CHCDRO C[C@H]([NH2+]C/C=C/c1ccccc1)c1cc(F)ccc1O ZINC000185440339 1120376809 /nfs/dbraw/zinc/37/68/09/1120376809.db2.gz PIECKWORKGEWGM-LJLILKBBSA-N 1 0 271.335 3.895 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H](C)Oc2ccccc2)c1 ZINC000186040730 1120389507 /nfs/dbraw/zinc/38/95/07/1120389507.db2.gz MEHZLGYVBGWSBL-HUUCEWRRSA-N 1 0 285.387 3.819 20 10 CHCDRO C[C@@]1(CC[NH2+]Cc2ccc3c(c2)CCCO3)CC1(F)F ZINC000922248924 1120484848 /nfs/dbraw/zinc/48/48/48/1120484848.db2.gz GKVSGBHQDYRCDO-OAHLLOKOSA-N 1 0 281.346 3.537 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)C[C@H](C)O2)c1ccccc1O ZINC000922328652 1120514375 /nfs/dbraw/zinc/51/43/75/1120514375.db2.gz GRGJYJXEQIIEHO-STQMWFEESA-N 1 0 283.371 3.566 20 10 CHCDRO CCOCCC[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000019962916 1120554586 /nfs/dbraw/zinc/55/45/86/1120554586.db2.gz MAOIRKYPIGHCKS-ZDUSSCGKSA-N 1 0 273.376 3.623 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccccc1O)c1cc(F)ccc1OC ZINC000922620744 1120564150 /nfs/dbraw/zinc/56/41/50/1120564150.db2.gz XJTVYANGHNGUBR-OAHLLOKOSA-N 1 0 289.350 3.781 20 10 CHCDRO Cc1csc([C@@H](C)C[NH2+][C@@H](C)c2ccc(C)cc2O)n1 ZINC000186573125 1120587049 /nfs/dbraw/zinc/58/70/49/1120587049.db2.gz OFDFHEKWTYTUJZ-AAEUAGOBSA-N 1 0 290.432 3.920 20 10 CHCDRO C[C@@H]([NH2+]CCCOC(F)F)c1cc2c(cc1O)CCCC2 ZINC000194033231 1120590120 /nfs/dbraw/zinc/59/01/20/1120590120.db2.gz FCOBJBUNWAKXGI-LLVKDONJSA-N 1 0 299.361 3.551 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]C2(Cc3ccccc3)CC2)c1 ZINC000186583910 1120608590 /nfs/dbraw/zinc/60/85/90/1120608590.db2.gz HMEZPCQCRIZJHS-AWEZNQCLSA-N 1 0 297.398 3.827 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)c1ccsc1 ZINC000766030573 1120673796 /nfs/dbraw/zinc/67/37/96/1120673796.db2.gz UHFPCKVYQOHWRG-ZDUSSCGKSA-N 1 0 274.433 3.973 20 10 CHCDRO COCC(C)(C)C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000314001947 1120842290 /nfs/dbraw/zinc/84/22/90/1120842290.db2.gz ZJZTVHZEEBOIMY-CYBMUJFWSA-N 1 0 287.403 3.869 20 10 CHCDRO CCOc1cccc(C[N@H+](C)[C@H](C)CCSCC)c1O ZINC000093870953 1120893094 /nfs/dbraw/zinc/89/30/94/1120893094.db2.gz YHOZVIJTDHBBNO-CYBMUJFWSA-N 1 0 297.464 3.754 20 10 CHCDRO Oc1ccccc1C[NH2+]Cc1ccc(C2CC2)cc1 ZINC000184768749 1120906381 /nfs/dbraw/zinc/90/63/81/1120906381.db2.gz JJLKMYKVFHXHKA-UHFFFAOYSA-N 1 0 253.345 3.559 20 10 CHCDRO COc1ccccc1CC[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000184861509 1120906595 /nfs/dbraw/zinc/90/65/95/1120906595.db2.gz CJFUPOMGRMEOOS-AWEZNQCLSA-N 1 0 285.387 3.603 20 10 CHCDRO C[C@H](Cc1ccccc1F)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000162915505 1120947253 /nfs/dbraw/zinc/94/72/53/1120947253.db2.gz PNMGCFSHSPNQKU-CQSZACIVSA-N 1 0 286.394 3.613 20 10 CHCDRO COc1ccc(C[NH2+]C2CCCCCCC2)c(O)c1 ZINC000040905708 1120956934 /nfs/dbraw/zinc/95/69/34/1120956934.db2.gz ODGZTTDMBAHYOP-UHFFFAOYSA-N 1 0 263.381 3.603 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CCCc2nn(C)cc21)c1ccc(C)cc1O ZINC000282516654 1121063237 /nfs/dbraw/zinc/06/32/37/1121063237.db2.gz UEANOCGTRONQQL-CVEARBPZSA-N 1 0 299.418 3.552 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C[C@@H]2CCc3ccccc3C2)c1 ZINC000773425784 1121090201 /nfs/dbraw/zinc/09/02/01/1121090201.db2.gz CXMBACHYTAXKOE-OAHLLOKOSA-N 1 0 281.399 3.595 20 10 CHCDRO CCc1cnccc1[C@H](C)[NH2+]Cc1ccc(OC)c(C)c1 ZINC000773427430 1121098284 /nfs/dbraw/zinc/09/82/84/1121098284.db2.gz LWBNPTWBCOBMAV-AWEZNQCLSA-N 1 0 284.403 3.812 20 10 CHCDRO CCSC1(C[NH2+][C@@H](C)c2ccc(C)cc2O)CC1 ZINC000700815787 1121122220 /nfs/dbraw/zinc/12/22/20/1121122220.db2.gz FLBPMLJRCRPDPF-LBPRGKRZSA-N 1 0 265.422 3.637 20 10 CHCDRO Oc1cc(Br)ccc1C[NH2+][C@H]1CC12CCCC2 ZINC000700976213 1121129499 /nfs/dbraw/zinc/12/94/99/1121129499.db2.gz UOJIRTUTRBIRIW-ZDUSSCGKSA-N 1 0 296.208 3.577 20 10 CHCDRO CC1CCC([N@H+](C)Cc2cc(F)ccc2O)CC1 ZINC000226561934 1121157443 /nfs/dbraw/zinc/15/74/43/1121157443.db2.gz VCNQFWWOCRLICN-UHFFFAOYSA-N 1 0 251.345 3.542 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]CCc1cc(F)cc(F)c1 ZINC000060717628 1121173463 /nfs/dbraw/zinc/17/34/63/1121173463.db2.gz IAIIXDTWDMRZGS-UHFFFAOYSA-N 1 0 297.732 3.656 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CCCC[C@@H](C)C2)c1O ZINC000703203774 1121239326 /nfs/dbraw/zinc/23/93/26/1121239326.db2.gz FMVVPGYAJDYUOK-LLVKDONJSA-N 1 0 283.799 3.676 20 10 CHCDRO Cc1cc(F)ccc1CC[NH2+][C@H](C)c1cc(F)ccc1O ZINC000094950973 1121247162 /nfs/dbraw/zinc/24/71/62/1121247162.db2.gz FHFJWLFDQUMUOT-GFCCVEGCSA-N 1 0 291.341 3.872 20 10 CHCDRO CCc1cc(C[NH2+][C@H](C)c2ccc(N(C)CC)cc2)on1 ZINC000766134668 1121303555 /nfs/dbraw/zinc/30/35/55/1121303555.db2.gz GOHFEZIGSXPEEJ-CYBMUJFWSA-N 1 0 287.407 3.544 20 10 CHCDRO C[C@@H]([NH2+]CCSCc1ccccc1)c1ccccc1O ZINC001175419723 1121316930 /nfs/dbraw/zinc/31/69/30/1121316930.db2.gz XQFBLBSYKMLMBT-CQSZACIVSA-N 1 0 287.428 3.976 20 10 CHCDRO Oc1ccc(F)c(Cl)c1C[NH+]1C[C@H]2CCCC[C@@H]2C1 ZINC001237122772 1128979333 /nfs/dbraw/zinc/97/93/33/1128979333.db2.gz YQBWMLCDGHROFS-GHMZBOCLSA-N 1 0 283.774 3.807 20 10 CHCDRO CCCC[C@@H]1CCC[C@H]1[NH2+]Cc1cccc(OC)c1O ZINC000236868487 1121367894 /nfs/dbraw/zinc/36/78/94/1121367894.db2.gz RQJLNXRDKZSTFI-UKRRQHHQSA-N 1 0 277.408 3.849 20 10 CHCDRO CC1([NH2+]Cc2ccc(N3CCCCC3)cc2)CC=CC1 ZINC000705238914 1121392988 /nfs/dbraw/zinc/39/29/88/1121392988.db2.gz KIOGXBVZJLTVTL-UHFFFAOYSA-N 1 0 270.420 3.875 20 10 CHCDRO C[C@@H]([NH2+]CC1(C(F)(F)F)CC1)c1cc(F)ccc1O ZINC000797071503 1121482017 /nfs/dbraw/zinc/48/20/17/1121482017.db2.gz RZUKUASOGRGGHP-MRVPVSSYSA-N 1 0 277.261 3.524 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2ccc(N(C)C)c(F)c2)cc1F ZINC000067121235 1121497391 /nfs/dbraw/zinc/49/73/91/1121497391.db2.gz IVJVAGDQJQMVLS-UHFFFAOYSA-N 1 0 290.357 3.629 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CC[C@H]2CCC3(CCC3)O2)cc1C ZINC000922966878 1121499131 /nfs/dbraw/zinc/49/91/31/1121499131.db2.gz AATGAXYGYALCFP-MRXNPFEDSA-N 1 0 289.419 3.590 20 10 CHCDRO Cc1cc(Nc2cccc(C(F)(F)F)c2O)cc(C)[nH+]1 ZINC001176059793 1121543513 /nfs/dbraw/zinc/54/35/13/1121543513.db2.gz HNAQTXJQOAGBDX-UHFFFAOYSA-N 1 0 282.265 3.588 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCC[C@@H](F)C2)c1 ZINC001118176400 1121559502 /nfs/dbraw/zinc/55/95/02/1121559502.db2.gz AZFIZULQJBEJDF-YNEHKIRRSA-N 1 0 251.345 3.632 20 10 CHCDRO CCCN(CCC)c1ccc(C[NH2+][C@H]2CCCOC2)cc1 ZINC000237003199 1121595391 /nfs/dbraw/zinc/59/53/91/1121595391.db2.gz ZGTVWTXIVONDQN-KRWDZBQOSA-N 1 0 290.451 3.582 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CCc3ccccc32)c1 ZINC000182802847 1128999857 /nfs/dbraw/zinc/99/98/57/1128999857.db2.gz BNAUHLYJISEMCA-UKRRQHHQSA-N 1 0 297.398 3.781 20 10 CHCDRO COc1cc(C)cc(C[NH2+]Cc2cccc(Cl)c2)c1O ZINC000894148495 1121673182 /nfs/dbraw/zinc/67/31/82/1121673182.db2.gz DXKVHJPJBRAKTN-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO COc1ccc(C[NH2+]C[C@@H](C)N(C)c2ccccc2)cc1C ZINC000727643710 1121729870 /nfs/dbraw/zinc/72/98/70/1121729870.db2.gz HICYSDDUJOLFHD-MRXNPFEDSA-N 1 0 298.430 3.618 20 10 CHCDRO CCCOc1ccc(C[NH2+]C[C@H]2CC2(C)C)cc1C ZINC001177800229 1121752967 /nfs/dbraw/zinc/75/29/67/1121752967.db2.gz VXVVBYWVJNLEAJ-OAHLLOKOSA-N 1 0 261.409 3.920 20 10 CHCDRO Cc1cc(C)cc(C[NH2+]Cc2ccc(N(C)C)cc2C)c1 ZINC000237090313 1121779963 /nfs/dbraw/zinc/77/99/63/1121779963.db2.gz DTGZOYNHRWUVBM-UHFFFAOYSA-N 1 0 282.431 3.968 20 10 CHCDRO C[C@@H]([NH2+]CC1(CO)CCCC1)c1ccc2ccccc2c1O ZINC000178874208 1121785534 /nfs/dbraw/zinc/78/55/34/1121785534.db2.gz SDIPNZBRPQGRSX-CQSZACIVSA-N 1 0 299.414 3.749 20 10 CHCDRO Cc1cc(C[NH2+][C@H]2CCCOC2)c(C)n1-c1cccc(C)c1 ZINC000730018097 1121790405 /nfs/dbraw/zinc/79/04/05/1121790405.db2.gz YMUJYUQYNVVMIW-SFHVURJKSA-N 1 0 298.430 3.671 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CCC[C@@H]2C2CC2)cc1 ZINC000773749500 1121794166 /nfs/dbraw/zinc/79/41/66/1121794166.db2.gz WNMCCGGYAHRZSV-QGZVFWFLSA-N 1 0 258.409 3.517 20 10 CHCDRO CC[N@H+](Cc1ccc(F)c(F)c1)Cc1ccccc1O ZINC001204226488 1121811979 /nfs/dbraw/zinc/81/19/79/1121811979.db2.gz BGHHUHBQMMOPFN-UHFFFAOYSA-N 1 0 277.314 3.693 20 10 CHCDRO CC(C)OC1CC[NH+](Cc2c(O)ccc3ccccc32)CC1 ZINC000730564127 1121815705 /nfs/dbraw/zinc/81/57/05/1121815705.db2.gz IYBIHBKSXNTMOD-UHFFFAOYSA-N 1 0 299.414 3.935 20 10 CHCDRO CCOCC[N@H+](CC)Cc1cc(C)cc(C(C)(C)C)c1O ZINC000730801776 1121827997 /nfs/dbraw/zinc/82/79/97/1121827997.db2.gz KXDTZYKGFWCGRE-UHFFFAOYSA-N 1 0 293.451 3.857 20 10 CHCDRO CCCOc1ccc(C[NH2+][C@H]2[C@@H]3CCC[C@@H]32)cc1C ZINC001179266694 1121865855 /nfs/dbraw/zinc/86/58/55/1121865855.db2.gz VYEJZYBBNWPOOI-QLPKVWCKSA-N 1 0 259.393 3.672 20 10 CHCDRO CCC[N@H+](Cc1ccc2c(c1)CCO2)Cc1ccccc1O ZINC000731850272 1121887215 /nfs/dbraw/zinc/88/72/15/1121887215.db2.gz RURSGSURPYJJTO-UHFFFAOYSA-N 1 0 297.398 3.739 20 10 CHCDRO COc1ccc(C[NH2+]CC[C@H]2CCC(F)(F)C2)cc1C ZINC001179758149 1121909355 /nfs/dbraw/zinc/90/93/55/1121909355.db2.gz BMBYYDQBRKRNRA-CYBMUJFWSA-N 1 0 283.362 3.919 20 10 CHCDRO Oc1ccc2ccncc2c1C[N@@H+]1CC[C@H](c2ccco2)C1 ZINC000732184225 1121910060 /nfs/dbraw/zinc/91/00/60/1121910060.db2.gz XSONLRDOIJFQAV-AWEZNQCLSA-N 1 0 294.354 3.523 20 10 CHCDRO CC(C)C[N@H+](C/C=C\c1ccc(N(C)C)cc1)C1CC1 ZINC001179983703 1121932397 /nfs/dbraw/zinc/93/23/97/1121932397.db2.gz FDLXYEQLDSSQLZ-WAYWQWQTSA-N 1 0 272.436 3.886 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C[C@@H]2CCc3ccccc32)cc1F ZINC000733327665 1121978238 /nfs/dbraw/zinc/97/82/38/1121978238.db2.gz AVRGSBQDGHFMRL-INIZCTEOSA-N 1 0 298.405 3.711 20 10 CHCDRO CCN(C)c1ccc(C[NH2+][C@H]2CC(C)(C)OC2(C)C)cc1 ZINC000773852724 1121979371 /nfs/dbraw/zinc/97/93/71/1121979371.db2.gz CNYYBRRUYHITNQ-INIZCTEOSA-N 1 0 290.451 3.578 20 10 CHCDRO CC[C@@H](CC(F)(F)F)[NH2+]Cc1ccc(Cl)cc1O ZINC001180602033 1122002320 /nfs/dbraw/zinc/00/23/20/1122002320.db2.gz FKZSRPGLKOHNBU-JTQLQIEISA-N 1 0 281.705 3.866 20 10 CHCDRO Oc1ccc(C[N@@H+]2CC[C@@H](C3CCCCC3)C2)c(O)c1 ZINC001204278286 1122009547 /nfs/dbraw/zinc/00/95/47/1122009547.db2.gz CXHIYAIFXZVJAJ-CQSZACIVSA-N 1 0 275.392 3.500 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(Cl)cc1O)c1cccs1 ZINC001180917171 1122022456 /nfs/dbraw/zinc/02/24/56/1122022456.db2.gz MTGZWFLLSJPVQL-VIFPVBQESA-N 1 0 267.781 3.958 20 10 CHCDRO CC[C@@H]1[C@@H](C)CC[N@@H+]1Cc1ccc(Cl)cc1O ZINC001181102183 1122032769 /nfs/dbraw/zinc/03/27/69/1122032769.db2.gz JNAVLPFLUDFZJQ-GXFFZTMASA-N 1 0 253.773 3.666 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]CC[C@H]1CCc2ccccc21 ZINC001182109746 1122110580 /nfs/dbraw/zinc/11/05/80/1122110580.db2.gz SJCZNCWEEJVKOH-CQSZACIVSA-N 1 0 285.362 3.741 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CC(C)(C)[C@H]1C1CC1 ZINC001182184597 1122116917 /nfs/dbraw/zinc/11/69/17/1122116917.db2.gz PFSIFHRUXGIXHC-QGZVFWFLSA-N 1 0 272.436 3.681 20 10 CHCDRO Cc1cc(O)c(C[NH+]2CCC(C3CC3)CC2)c(Cl)c1 ZINC001182195863 1122119467 /nfs/dbraw/zinc/11/94/67/1122119467.db2.gz IZEFNZFVWVHNQI-UHFFFAOYSA-N 1 0 279.811 3.976 20 10 CHCDRO CCc1cccnc1[C@H](C)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000780705997 1122134799 /nfs/dbraw/zinc/13/47/99/1122134799.db2.gz JYQBBLAUBCMACY-AWEZNQCLSA-N 1 0 283.419 3.561 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCCc2occc21 ZINC000774193629 1122138149 /nfs/dbraw/zinc/13/81/49/1122138149.db2.gz UQUWCKTZRZPIOW-QGZVFWFLSA-N 1 0 284.403 3.821 20 10 CHCDRO COc1cc(C)c(C[NH2+][C@@H]2CCc3ccc(C)cc32)c(O)c1 ZINC001182683725 1122182396 /nfs/dbraw/zinc/18/23/96/1122182396.db2.gz FSHRCKZNSGQAGB-GOSISDBHSA-N 1 0 297.398 3.795 20 10 CHCDRO COc1ccc(O)c(C[NH2+]C2(C)CCC(C)(C)CC2)c1 ZINC001183325942 1122219245 /nfs/dbraw/zinc/21/92/45/1122219245.db2.gz VFDYMZOMUDXWJG-UHFFFAOYSA-N 1 0 277.408 3.849 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccccc2F)c(O)c1C ZINC000273362763 1122230006 /nfs/dbraw/zinc/23/00/06/1122230006.db2.gz DIRYUOPKIGHFIZ-CYBMUJFWSA-N 1 0 273.351 3.999 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@@H]3OCC[C@@H]32)c(O)c1C ZINC000273363331 1122230591 /nfs/dbraw/zinc/23/05/91/1122230591.db2.gz AVXQQBSSRQZWLT-SVGFKBNWSA-N 1 0 289.419 3.617 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CC[C@H]2CCO[C@@H](C)C2)c1 ZINC000273410686 1122231351 /nfs/dbraw/zinc/23/13/51/1122231351.db2.gz HRYBFYOSQJAXSE-KKUMJFAQSA-N 1 0 277.408 3.556 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2)c(O)c1C ZINC000273401878 1122231589 /nfs/dbraw/zinc/23/15/89/1122231589.db2.gz NIQBKOQZZHPBTI-OAHLLOKOSA-N 1 0 298.430 3.926 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCOC3(CCC3)C2)c(O)c1C ZINC000273530917 1122237577 /nfs/dbraw/zinc/23/75/77/1122237577.db2.gz WHTCGCOJVGYZHA-HUUCEWRRSA-N 1 0 289.419 3.761 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCO[C@H](C(C)C)C2)c(O)c1C ZINC000273538280 1122237940 /nfs/dbraw/zinc/23/79/40/1122237940.db2.gz XSXXRYZFIDFKOK-ZOBUZTSGSA-N 1 0 291.435 3.863 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H](CCO)c2ccccc2)c(O)c1C ZINC000273603120 1122239611 /nfs/dbraw/zinc/23/96/11/1122239611.db2.gz SJKHRYMAFBLMAP-MAUKXSAKSA-N 1 0 299.414 3.783 20 10 CHCDRO CCCC[C@H](C)[C@@H](C)[NH2+]Cc1c([O-])cccc1F ZINC001183918660 1122248571 /nfs/dbraw/zinc/24/85/71/1122248571.db2.gz BETWXKUEOLOTSF-NWDGAFQWSA-N 1 0 253.361 3.836 20 10 CHCDRO C[C@H]1CCC[C@@H]1[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000071205983 1129045780 /nfs/dbraw/zinc/04/57/80/1129045780.db2.gz JOMHWVSPUWTPTI-YJBOKZPZSA-N 1 0 272.436 3.955 20 10 CHCDRO CC1(C[N@@H+](Cc2ccccc2O)C[C@H]2CCCO2)CCC1 ZINC000774819882 1122317171 /nfs/dbraw/zinc/31/71/71/1122317171.db2.gz APXHJSVRUCMRMU-MRXNPFEDSA-N 1 0 289.419 3.563 20 10 CHCDRO CC[N@H+](Cc1c(O)ccc2ccc(OC)cc21)C1CC1 ZINC000192993881 1129049830 /nfs/dbraw/zinc/04/98/30/1129049830.db2.gz IUGNQTHQKAFGJH-UHFFFAOYSA-N 1 0 271.360 3.538 20 10 CHCDRO Cc1cccc(C[N@H+]2CC[C@H](C(F)(F)F)C[C@@H]2C)c1O ZINC000824714723 1122412057 /nfs/dbraw/zinc/41/20/57/1122412057.db2.gz FGGQWGCJNZODJY-AAEUAGOBSA-N 1 0 287.325 3.863 20 10 CHCDRO C[N@@H+](Cc1cc(Cl)ccc1O)C[C@H]1CC1(C)C ZINC001203664211 1122431963 /nfs/dbraw/zinc/43/19/63/1122431963.db2.gz RBEFSGWHPLWVLH-LLVKDONJSA-N 1 0 253.773 3.524 20 10 CHCDRO CCCN(Cc1cc(C)c(C)cc1O)c1ccc(C[NH3+])cc1 ZINC000775140136 1122439199 /nfs/dbraw/zinc/43/91/99/1122439199.db2.gz IVGBUCLAJUEPAI-UHFFFAOYSA-N 1 0 298.430 3.884 20 10 CHCDRO CCCN(Cc1cc(C)oc1C)c1ccc(C[NH3+])cc1 ZINC000775141037 1122440413 /nfs/dbraw/zinc/44/04/13/1122440413.db2.gz UXMUHOOJLOIIMY-UHFFFAOYSA-N 1 0 272.392 3.772 20 10 CHCDRO C[C@H](C[NH2+][C@@H](C)c1ccccc1O)COCc1ccccc1 ZINC000183459129 1129055680 /nfs/dbraw/zinc/05/56/80/1129055680.db2.gz VVXXUDUNAKKOMP-CVEARBPZSA-N 1 0 299.414 3.896 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C2(Cc3ccccc3)CC2)cc1C ZINC000775322809 1122516625 /nfs/dbraw/zinc/51/66/25/1122516625.db2.gz BFKLFKXEOHYJLX-UHFFFAOYSA-N 1 0 281.399 3.874 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1COc2ccccc2C1)c1ccccc1O ZINC000775487487 1122618327 /nfs/dbraw/zinc/61/83/27/1122618327.db2.gz CHYMYUQCQRVMGS-PBHICJAKSA-N 1 0 297.398 3.684 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)CCOC)c1cc(Cl)ccc1O ZINC000775501459 1122628886 /nfs/dbraw/zinc/62/88/86/1122628886.db2.gz QVRJOWNKZUAPET-ZWNOBZJWSA-N 1 0 271.788 3.511 20 10 CHCDRO CCC[C@](C)(O)C[NH2+][C@H](CC)c1cc(Cl)ccc1O ZINC000775503244 1122629055 /nfs/dbraw/zinc/62/90/55/1122629055.db2.gz DVLSFPRBHVSDPN-HIFRSBDPSA-N 1 0 285.815 3.637 20 10 CHCDRO CC[C@H]([NH2+]CCN(CC)C(C)C)c1cc(Cl)ccc1O ZINC000775502826 1122631269 /nfs/dbraw/zinc/63/12/69/1122631269.db2.gz ZQKAURXMLOZXJG-HNNXBMFYSA-N 1 0 298.858 3.817 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)[C@@H]1CCOC1)c1cc(Cl)ccc1O ZINC000775510007 1122632173 /nfs/dbraw/zinc/63/21/73/1122632173.db2.gz WZMBVZLHOFAZJI-GYSYKLTISA-N 1 0 283.799 3.511 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](O)CC(C)(C)C)c1cc(Cl)ccc1O ZINC000775507882 1122632468 /nfs/dbraw/zinc/63/24/68/1122632468.db2.gz OVXBOKSZZZUDPO-JSGCOSHPSA-N 1 0 299.842 3.883 20 10 CHCDRO CC[C@H](C[C@@H](C)CO)[NH2+][C@H](CC)c1cc(Cl)ccc1O ZINC000775513278 1122633457 /nfs/dbraw/zinc/63/34/57/1122633457.db2.gz PLVVRBQJFXNPCX-UXIGCNINSA-N 1 0 299.842 3.883 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](C)c1ccncc1)c1ccccc1O ZINC000775512922 1122634476 /nfs/dbraw/zinc/63/44/76/1122634476.db2.gz SMQFKGPFSHXQFH-XJKSGUPXSA-N 1 0 270.376 3.632 20 10 CHCDRO CC[C@H]([NH2+]C1CCSCC1)c1cc(Cl)ccc1O ZINC000775519400 1122638824 /nfs/dbraw/zinc/63/88/24/1122638824.db2.gz NLNIKQRRIQORJG-ZDUSSCGKSA-N 1 0 285.840 3.982 20 10 CHCDRO CC[C@@H]([NH2+]Cc1nn(C)c2ccccc12)c1ccccc1O ZINC000775555051 1122661167 /nfs/dbraw/zinc/66/11/67/1122661167.db2.gz IAHOUMUXEFDBSP-OAHLLOKOSA-N 1 0 295.386 3.520 20 10 CHCDRO CC[C@H]([NH2+]CCOC(C)C)c1cc(Cl)ccc1O ZINC000775552942 1122662164 /nfs/dbraw/zinc/66/21/64/1122662164.db2.gz ZIFQVZYLPBDKIM-ZDUSSCGKSA-N 1 0 271.788 3.511 20 10 CHCDRO Cc1cc(C[NH2+][C@@H]2CCC[C@H](C)[C@H]2C)ccc1N(C)C ZINC001193593153 1122699357 /nfs/dbraw/zinc/69/93/57/1122699357.db2.gz JGXREJXDLAEKFC-YSVLISHTSA-N 1 0 274.452 3.975 20 10 CHCDRO Cc1cccc(C[N@@H+]2Cc3ccccc3[C@@H](C)C2)c1O ZINC000775646123 1122854136 /nfs/dbraw/zinc/85/41/36/1122854136.db2.gz GYCDRXXBNWGSEV-AWEZNQCLSA-N 1 0 267.372 3.820 20 10 CHCDRO COc1c(C)cc(C[N@H+](C)Cc2cccc(C)c2O)cc1C ZINC000775670078 1122883444 /nfs/dbraw/zinc/88/34/44/1122883444.db2.gz HXDNLINBGJWRKK-UHFFFAOYSA-N 1 0 299.414 3.958 20 10 CHCDRO COc1cc(C)cc(C[NH2+]C[C@H]2CCCC(F)(F)C2)c1O ZINC000894664941 1122887658 /nfs/dbraw/zinc/88/76/58/1122887658.db2.gz JISPBOLFXZXBFN-LBPRGKRZSA-N 1 0 299.361 3.624 20 10 CHCDRO CC[C@@H](C)[C@@H](C)[N@H+](Cc1cc(OC)ccc1O)C1CC1 ZINC000775682505 1122901832 /nfs/dbraw/zinc/90/18/32/1122901832.db2.gz ZNJYCOGTWUHNEW-CHWSQXEVSA-N 1 0 277.408 3.800 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+]2CC=C(C)CC2)c1O ZINC000775702557 1122913151 /nfs/dbraw/zinc/91/31/51/1122913151.db2.gz SPEVFFXCSZMBHK-UHFFFAOYSA-N 1 0 251.757 3.506 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2C[C@@H](c3ccccc3)C[C@H]2C)c1 ZINC000775702333 1122914358 /nfs/dbraw/zinc/91/43/58/1122914358.db2.gz QAIALTXJPQFYDL-ZBFHGGJFSA-N 1 0 297.398 3.779 20 10 CHCDRO Cc1cccc(C[N@H+]2Cc3ccccc3C[C@H]2C)c1O ZINC000775716073 1122922504 /nfs/dbraw/zinc/92/25/04/1122922504.db2.gz BDMZGDZQEZWERI-CQSZACIVSA-N 1 0 267.372 3.647 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CC[C@@](C)(c3ccccc3)C2)c1 ZINC000775724866 1122926202 /nfs/dbraw/zinc/92/62/02/1122926202.db2.gz JARSKIKVQPFBPT-LJQANCHMSA-N 1 0 297.398 3.564 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CCC[C@H]2CCC(C)C)c1 ZINC000775730389 1122927247 /nfs/dbraw/zinc/92/72/47/1122927247.db2.gz APBRZTHCVMUTQT-HNNXBMFYSA-N 1 0 277.408 3.801 20 10 CHCDRO Cc1cccc(C[N@H+]2C[C@@H](C)[C@@H]2c2ccccc2)c1O ZINC000775735570 1122929132 /nfs/dbraw/zinc/92/91/32/1122929132.db2.gz WOYZNCZOUMBWTM-RHSMWYFYSA-N 1 0 267.372 3.894 20 10 CHCDRO Cc1cc(Cl)cc(C[NH+]2[C@H](C)CC[C@H]2C)c1O ZINC000775737468 1122929161 /nfs/dbraw/zinc/92/91/61/1122929161.db2.gz HVRAGKHXKSBLLE-GHMZBOCLSA-N 1 0 253.773 3.727 20 10 CHCDRO Cc1cccc(C[N@@H+](C)[C@@H](C)[C@@H]2Cc3ccccc3O2)c1O ZINC000775741599 1122933365 /nfs/dbraw/zinc/93/33/65/1122933365.db2.gz TVWKODAQLJFZRM-KSSFIOAISA-N 1 0 297.398 3.525 20 10 CHCDRO C[C@@H](CCc1ccco1)[NH2+]Cc1cc(Cl)cc(F)c1[O-] ZINC000775774269 1122957025 /nfs/dbraw/zinc/95/70/25/1122957025.db2.gz OVHFXXZRZXBFNM-JTQLQIEISA-N 1 0 297.757 3.889 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+]CCc2ccccc2)c1O ZINC000775794057 1122972117 /nfs/dbraw/zinc/97/21/17/1122972117.db2.gz UWGBHMOAKWCGKK-UHFFFAOYSA-N 1 0 275.779 3.686 20 10 CHCDRO CCCCC1([NH2+]Cc2ccc(N(C)CC)cc2)CC1 ZINC001198551404 1123000079 /nfs/dbraw/zinc/00/00/79/1123000079.db2.gz DBEYXHQPYQVGPO-UHFFFAOYSA-N 1 0 260.425 3.955 20 10 CHCDRO C[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001198958916 1123016611 /nfs/dbraw/zinc/01/66/11/1123016611.db2.gz FTVHGIAAAKBSDS-BBRMVZONSA-N 1 0 259.393 3.680 20 10 CHCDRO C[C@H]1CC[C@@H]([NH2+]Cc2ccc(N3CCSCC3)cc2)C1 ZINC001199376881 1123028734 /nfs/dbraw/zinc/02/87/34/1123028734.db2.gz QXIJKYGOPSBKAI-GOEBONIOSA-N 1 0 290.476 3.518 20 10 CHCDRO COc1ccc(O)c(C[NH2+]C[C@@H](C)C2CCCCC2)c1 ZINC000776078260 1123053450 /nfs/dbraw/zinc/05/34/50/1123053450.db2.gz VVXRGDWKBSCKDV-CYBMUJFWSA-N 1 0 277.408 3.707 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]CCc1ccc(F)cc1F ZINC000776174072 1123102601 /nfs/dbraw/zinc/10/26/01/1123102601.db2.gz GNGKLFUMAROQRU-UHFFFAOYSA-N 1 0 297.732 3.656 20 10 CHCDRO CCCOc1ccc(C[NH2+]C2(CC)CCOCC2)cc1C ZINC001201465040 1123103392 /nfs/dbraw/zinc/10/33/92/1123103392.db2.gz JKMWQFLJKOVGHL-UHFFFAOYSA-N 1 0 291.435 3.833 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+]C[C@@](C)(O)CCC(C)C)c1O ZINC000776209336 1123148584 /nfs/dbraw/zinc/14/85/84/1123148584.db2.gz VGVFJLOQEGOGOG-INIZCTEOSA-N 1 0 299.842 3.631 20 10 CHCDRO COc1cccc(C[NH2+][C@@H]2CCC(C)(C)C[C@@H]2C)c1O ZINC000237231980 1123220743 /nfs/dbraw/zinc/22/07/43/1123220743.db2.gz KGUVDIXXZDKDQG-GXTWGEPZSA-N 1 0 277.408 3.705 20 10 CHCDRO C[C@H]([NH2+]Cc1cc(F)ccc1F)c1ccccc1O ZINC000107929111 1123229710 /nfs/dbraw/zinc/22/97/10/1123229710.db2.gz AMTYWVBFIRTXGL-JTQLQIEISA-N 1 0 263.287 3.521 20 10 CHCDRO CC(C)(C)c1cnc(SCC[NH+]2CCCC2)s1 ZINC000776432980 1123232037 /nfs/dbraw/zinc/23/20/37/1123232037.db2.gz ICMGZYWKFMDJTH-UHFFFAOYSA-N 1 0 270.467 3.629 20 10 CHCDRO C[N@@H+]1CCCC[C@H]1CCSc1ncc(Cl)s1 ZINC000849998592 1123236280 /nfs/dbraw/zinc/23/62/80/1123236280.db2.gz PJNDELGLDINKFB-VIFPVBQESA-N 1 0 276.858 3.763 20 10 CHCDRO CC[C@H]([NH2+]Cc1cnn(CC2CCC2)c1)c1ccccc1O ZINC000895132962 1123244911 /nfs/dbraw/zinc/24/49/11/1123244911.db2.gz DNNCIALSNLDAEZ-KRWDZBQOSA-N 1 0 299.418 3.630 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@H](C)c2ccccn2)c(Cl)c1 ZINC000850341654 1123254820 /nfs/dbraw/zinc/25/48/20/1123254820.db2.gz AZNZJDVCOHEUJJ-LBPRGKRZSA-N 1 0 290.794 3.642 20 10 CHCDRO CC[C@@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)C1CC1 ZINC000850382623 1123261384 /nfs/dbraw/zinc/26/13/84/1123261384.db2.gz ZGXNFPPPGGEYDH-FUTAKVPZSA-N 1 0 258.409 3.544 20 10 CHCDRO CCOCc1cc(C[NH2+][C@@]2(C)CC2(C)C)ccc1OC ZINC000850399168 1123262833 /nfs/dbraw/zinc/26/28/33/1123262833.db2.gz IBWQTOOVUPJEJI-KRWDZBQOSA-N 1 0 277.408 3.510 20 10 CHCDRO CC[C@@H](COCC1CC1)[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000850492289 1123273986 /nfs/dbraw/zinc/27/39/86/1123273986.db2.gz CRFGHLNVFOZGOG-ZFWWWQNUSA-N 1 0 277.408 3.556 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@H]2CCN2C(C)(C)C)c(O)c1 ZINC000850482853 1123274059 /nfs/dbraw/zinc/27/40/59/1123274059.db2.gz VGUXKGVUTZFDTE-LSDHHAIUSA-N 1 0 290.451 3.532 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H]2CCN2C(C)(C)C)c(O)c1 ZINC000850482851 1123274125 /nfs/dbraw/zinc/27/41/25/1123274125.db2.gz VGUXKGVUTZFDTE-GJZGRUSLSA-N 1 0 290.451 3.532 20 10 CHCDRO CC[C@@H](COCC1CC1)[NH2+][C@H](C)c1cc(C)ccc1O ZINC000850493857 1123275488 /nfs/dbraw/zinc/27/54/88/1123275488.db2.gz LOKYKDATOSLIPR-HIFRSBDPSA-N 1 0 277.408 3.556 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1C=CCC1)c1cc2c(cc1O)CCCC2 ZINC000850507977 1123276976 /nfs/dbraw/zinc/27/69/76/1123276976.db2.gz HEPJOZDISPVNGB-IUODEOHRSA-N 1 0 257.377 3.640 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1cscn1)c1ccc(C)cc1O ZINC000850511709 1123277783 /nfs/dbraw/zinc/27/77/83/1123277783.db2.gz LRDYUYQLOMRFSK-WCQYABFASA-N 1 0 276.405 3.959 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2cscn2)c(O)c1C ZINC000850511501 1123278296 /nfs/dbraw/zinc/27/82/96/1123278296.db2.gz GTUZBSLCDNCBRM-RYUDHWBXSA-N 1 0 276.405 3.877 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2C[C@H](O)c3ccccc32)c1 ZINC000850526396 1123282008 /nfs/dbraw/zinc/28/20/08/1123282008.db2.gz BUVJEQKCWRXCJU-XZOAIXRZSA-N 1 0 283.371 3.530 20 10 CHCDRO CC[C@H]([NH2+]CCC(C)(C)F)c1ccc(C)cc1O ZINC000850531610 1123284818 /nfs/dbraw/zinc/28/48/18/1123284818.db2.gz LCGIUZZKINNIFR-ZDUSSCGKSA-N 1 0 253.361 3.880 20 10 CHCDRO C[C@H]1C[C@@H]([NH2+]CCC(C)(C)F)c2c1c(F)ccc2O ZINC000850532284 1123285796 /nfs/dbraw/zinc/28/57/96/1123285796.db2.gz SRMHLLXRFWTJMA-GXSJLCMTSA-N 1 0 269.335 3.807 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[C@@H](C)O2)c(O)c1C ZINC000850533801 1123285943 /nfs/dbraw/zinc/28/59/43/1123285943.db2.gz CEZMQPPGXWRBKR-SNPRPXQTSA-N 1 0 277.408 3.617 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCC[C@H](C)O2)c(O)c1C ZINC000850533799 1123285972 /nfs/dbraw/zinc/28/59/72/1123285972.db2.gz CEZMQPPGXWRBKR-QEJZJMRPSA-N 1 0 277.408 3.617 20 10 CHCDRO CC[C@@H]([NH2+]C[C@]1(C)CC1(F)F)c1ccc(C)cc1O ZINC000850535730 1123287017 /nfs/dbraw/zinc/28/70/17/1123287017.db2.gz AFBAEYWOHQXQPY-OCCSQVGLSA-N 1 0 269.335 3.787 20 10 CHCDRO CC[C@@H]([NH2+]CC[C@]1(C)CC1(F)F)c1ccccc1O ZINC000850536003 1123287402 /nfs/dbraw/zinc/28/74/02/1123287402.db2.gz GNKSCTXIHZZZAC-TZMCWYRMSA-N 1 0 269.335 3.868 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCc2ccc(O)cc21)c1cc(F)ccc1O ZINC000850543407 1123289338 /nfs/dbraw/zinc/28/93/38/1123289338.db2.gz JDBCWIMBXZHERL-HWPZZCPQSA-N 1 0 287.334 3.575 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2c(C3CCC3)cnn2C)c(O)c1 ZINC000850552801 1123290094 /nfs/dbraw/zinc/29/00/94/1123290094.db2.gz YWCQRYWBCBUEPT-CYBMUJFWSA-N 1 0 299.418 3.552 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCCc2ccco2)c(O)c1 ZINC000850570504 1123294534 /nfs/dbraw/zinc/29/45/34/1123294534.db2.gz UNLNECXZOQVNOU-ZDUSSCGKSA-N 1 0 259.349 3.577 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H](O)[C@@H](C)c2ccccc2)c(O)c1 ZINC000850573459 1123295370 /nfs/dbraw/zinc/29/53/70/1123295370.db2.gz MIRKEEXRLBQZNW-DOXZYTNZSA-N 1 0 299.414 3.516 20 10 CHCDRO COc1cccc(C[NH2+][C@H](C)c2cc(C)ccc2O)c1C ZINC000850578521 1123296092 /nfs/dbraw/zinc/29/60/92/1123296092.db2.gz MOKIASPGJMWAHH-CQSZACIVSA-N 1 0 285.387 3.868 20 10 CHCDRO CC[C@H]([NH2+][C@H](c1ccccc1)[C@@H](C)O)c1ccc(C)cc1O ZINC000850583237 1123296428 /nfs/dbraw/zinc/29/64/28/1123296428.db2.gz JYCYHPSEWWHRHB-LJHODMEESA-N 1 0 299.414 3.863 20 10 CHCDRO CC[C@H](C[NH2+][C@H](C)c1cc(OC)ccc1O)CC(F)F ZINC000851900114 1123387942 /nfs/dbraw/zinc/38/79/42/1123387942.db2.gz PIQBJLYXZYCOLF-MNOVXSKESA-N 1 0 287.350 3.733 20 10 CHCDRO Cc1ccsc1C[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000110435676 1123398513 /nfs/dbraw/zinc/39/85/13/1123398513.db2.gz XTUBWQRFNCAMTP-UHFFFAOYSA-N 1 0 286.444 3.729 20 10 CHCDRO CCOc1cccc(C[NH2+]C[C@@H]2C[C@H]2c2ccccc2)c1O ZINC000111398360 1123442611 /nfs/dbraw/zinc/44/26/11/1123442611.db2.gz UBQLQIJLMIFCLY-IRXDYDNUSA-N 1 0 297.398 3.684 20 10 CHCDRO COc1cccc(C[NH2+]C(C)(C)CCc2ccccc2)c1O ZINC000111387472 1123443101 /nfs/dbraw/zinc/44/31/01/1123443101.db2.gz PWUDIWIXQGIXMS-UHFFFAOYSA-N 1 0 299.414 3.902 20 10 CHCDRO COc1cccc(C[NH2+][C@H]2CCC[C@H]2c2ccccc2)c1O ZINC000111413016 1123443890 /nfs/dbraw/zinc/44/38/90/1123443890.db2.gz FBEXTOMGGBZFDI-IRXDYDNUSA-N 1 0 297.398 3.827 20 10 CHCDRO COc1cccc(C[NH2+][C@@H]2CCC[C@@H]2c2ccccc2)c1O ZINC000111413008 1123444054 /nfs/dbraw/zinc/44/40/54/1123444054.db2.gz FBEXTOMGGBZFDI-IAGOWNOFSA-N 1 0 297.398 3.827 20 10 CHCDRO COc1ccccc1C[NH2+]Cc1c(C)c2ccccc2n1C ZINC000389120318 1123462359 /nfs/dbraw/zinc/46/23/59/1123462359.db2.gz OLSUBOKIHUBBNO-UHFFFAOYSA-N 1 0 294.398 3.785 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@H]2CCc3cc(N)ccc32)c(O)c1 ZINC000854225908 1123477926 /nfs/dbraw/zinc/47/79/26/1123477926.db2.gz HBFKKXVKAZYMFQ-GUYCJALGSA-N 1 0 296.414 3.929 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+][C@H]2CCc3cc(N)ccc32)c(O)c1 ZINC000854225906 1123477930 /nfs/dbraw/zinc/47/79/30/1123477930.db2.gz HBFKKXVKAZYMFQ-DYVFJYSZSA-N 1 0 296.414 3.929 20 10 CHCDRO CC[C@H]([NH2+]Cc1cccc(N)c1)c1cc(Cl)ccc1O ZINC000854217357 1123478009 /nfs/dbraw/zinc/47/80/09/1123478009.db2.gz LAYYXLMUNYDKDW-HNNXBMFYSA-N 1 0 290.794 3.869 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCc2cc(N)ccc21)c1ccc(N(C)C)cc1 ZINC000854227146 1123478267 /nfs/dbraw/zinc/47/82/67/1123478267.db2.gz SQDQLNQDGLJZMG-DJJJIMSYSA-N 1 0 295.430 3.673 20 10 CHCDRO CCc1cnccc1[C@@H](C)[NH2+][C@@H](C)c1ccccc1O ZINC000783526222 1123493069 /nfs/dbraw/zinc/49/30/69/1123493069.db2.gz UQKDSLNOPYZTCO-OLZOCXBDSA-N 1 0 270.376 3.761 20 10 CHCDRO COc1cccc(C[NH2+][C@H]2CCCC[C@@H]2C(C)C)c1O ZINC000112675765 1123496016 /nfs/dbraw/zinc/49/60/16/1123496016.db2.gz RFCHLLPMTCHUHM-CABCVRRESA-N 1 0 277.408 3.705 20 10 CHCDRO Oc1ccccc1C[N@H+](CC1CCOCC1)C1CCCC1 ZINC000112698140 1123497485 /nfs/dbraw/zinc/49/74/85/1123497485.db2.gz WXEKZWJJRWZUSU-UHFFFAOYSA-N 1 0 289.419 3.563 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]CCCc2c[nH]c3ccccc23)c1 ZINC000113339680 1123521609 /nfs/dbraw/zinc/52/16/09/1123521609.db2.gz WOVGRQKRKVJSPP-UHFFFAOYSA-N 1 0 294.398 3.904 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H](C)Cc2ccccc2F)c1 ZINC000113326437 1123521638 /nfs/dbraw/zinc/52/16/38/1123521638.db2.gz IBERDGQGCZIHFJ-CYBMUJFWSA-N 1 0 273.351 3.561 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)C1(C)CC1)c1ccc(N(C)C)cc1 ZINC000776884130 1123559640 /nfs/dbraw/zinc/55/96/40/1123559640.db2.gz ZKIMEWUKEFFRPN-BBRMVZONSA-N 1 0 260.425 3.982 20 10 CHCDRO FC1(F)C[C@H]1CC[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000856804334 1123569036 /nfs/dbraw/zinc/56/90/36/1123569036.db2.gz SYSQHWOHPZGTIO-OAHLLOKOSA-N 1 0 294.389 3.812 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]CC[C@H]1CC1(Cl)Cl ZINC000856806204 1123569524 /nfs/dbraw/zinc/56/95/24/1123569524.db2.gz BVKGEJAGYLSBCY-VIFPVBQESA-N 1 0 294.609 3.719 20 10 CHCDRO Oc1cccc(Cl)c1C[NH+]1CC(Cc2ccsc2)C1 ZINC000857067650 1123584353 /nfs/dbraw/zinc/58/43/53/1123584353.db2.gz CLKFOXHTAGUVLM-UHFFFAOYSA-N 1 0 293.819 3.782 20 10 CHCDRO CC(C)C[C@@H]1C[C@@H]([NH2+]Cc2cc(Cl)ccc2O)CCO1 ZINC000776951625 1123612869 /nfs/dbraw/zinc/61/28/69/1123612869.db2.gz XRQKULFJMKHMPA-LSDHHAIUSA-N 1 0 297.826 3.729 20 10 CHCDRO C[C@@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)c1ccns1 ZINC000858318080 1123644009 /nfs/dbraw/zinc/64/40/09/1123644009.db2.gz LIOXKFGOLPHPBS-DSYXLKISSA-N 1 0 287.432 3.573 20 10 CHCDRO C[C@@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)c1ccns1 ZINC000858318159 1123644501 /nfs/dbraw/zinc/64/45/01/1123644501.db2.gz LIOXKFGOLPHPBS-MUBLQREKSA-N 1 0 287.432 3.573 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CC[C@@H]2CCCOC2)cc1 ZINC000858445272 1123654602 /nfs/dbraw/zinc/65/46/02/1123654602.db2.gz DXBAJDUFJXFUKP-CVEARBPZSA-N 1 0 290.451 3.610 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CO[C@H](C2CC2)C1)c1ccc2ccccc2c1O ZINC000858548964 1123661591 /nfs/dbraw/zinc/66/15/91/1123661591.db2.gz YCUWOITWIIHLAO-QITLCBANSA-N 1 0 297.398 3.764 20 10 CHCDRO CCCN(Cc1cccs1)c1ccc(C[NH3+])cc1 ZINC000194978440 1129140646 /nfs/dbraw/zinc/14/06/46/1129140646.db2.gz HIIKYGPHFWUNRG-UHFFFAOYSA-N 1 0 260.406 3.623 20 10 CHCDRO CN1CCCc2cc(C[NH2+][C@H]3CCCc4occc43)ccc21 ZINC000195287300 1129144061 /nfs/dbraw/zinc/14/40/61/1129144061.db2.gz MVKHZEJYWLEZRQ-KRWDZBQOSA-N 1 0 296.414 3.829 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CCc3c(C)cc(C)cc3C2)c1 ZINC000777218587 1123784906 /nfs/dbraw/zinc/78/49/06/1123784906.db2.gz CDHRZTXOEZNJHK-UHFFFAOYSA-N 1 0 297.398 3.576 20 10 CHCDRO CCOc1cccc(C[N@H+]2C[C@@H](C)C(F)(F)[C@@H](C)C2)c1O ZINC000862438378 1123810065 /nfs/dbraw/zinc/81/00/65/1123810065.db2.gz ALNAHDCAKUXXLK-TXEJJXNPSA-N 1 0 299.361 3.514 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)OCCO2)c1ccccc1O ZINC000192785087 1123816216 /nfs/dbraw/zinc/81/62/16/1123816216.db2.gz FXYLHWFVTGJULA-QWHCGFSZSA-N 1 0 299.370 3.575 20 10 CHCDRO Oc1ccccc1C[N@@H+]1C[C@@H]2C[C@@H](c3ccccc3)[C@@H]2C1 ZINC000862528779 1123816507 /nfs/dbraw/zinc/81/65/07/1123816507.db2.gz ISEFJLUHOCXEQE-OKZBNKHCSA-N 1 0 279.383 3.628 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CC3(CCC3)C[C@@H]2C)c1O ZINC000763645406 1129149894 /nfs/dbraw/zinc/14/98/94/1129149894.db2.gz FNDXQHQNTCHVNH-ZDUSSCGKSA-N 1 0 275.392 3.555 20 10 CHCDRO COc1ccc2ccc(O)c(C[NH+](C3CC3)C3CC3)c2c1 ZINC000863303845 1123859065 /nfs/dbraw/zinc/85/90/65/1123859065.db2.gz DHIZAZVGLJAUSY-UHFFFAOYSA-N 1 0 283.371 3.681 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1C[C@@H](C)O[C@@H]1C)c1cc(Cl)ccc1O ZINC000840871918 1123867329 /nfs/dbraw/zinc/86/73/29/1123867329.db2.gz ICDBPFDSTWLQQD-WRWGMCAJSA-N 1 0 283.799 3.510 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1cccc(O)c1 ZINC000193023698 1123869143 /nfs/dbraw/zinc/86/91/43/1123869143.db2.gz BAWKSUMSVTWOOY-HNNXBMFYSA-N 1 0 296.414 3.843 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]Cc1ccc(F)cc1F ZINC000083552314 1129150652 /nfs/dbraw/zinc/15/06/52/1129150652.db2.gz KBYYYOMQYTVDHY-UHFFFAOYSA-N 1 0 283.705 3.614 20 10 CHCDRO CO[C@H](C)C1C[NH+](Cc2cc(C)n(-c3ccccc3)c2C)C1 ZINC001137859207 1123899425 /nfs/dbraw/zinc/89/94/25/1123899425.db2.gz NQUGGIWTAMGXCT-MRXNPFEDSA-N 1 0 298.430 3.561 20 10 CHCDRO COc1cc(C[N@H+](C)[C@H]2CCC(C)(C)C2)c(O)cc1C ZINC000794686855 1123927369 /nfs/dbraw/zinc/92/73/69/1123927369.db2.gz SIMYNTATZWPMAR-AWEZNQCLSA-N 1 0 277.408 3.720 20 10 CHCDRO C[C@@H]1CC2(CCC2)C[N@@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000763647957 1129155137 /nfs/dbraw/zinc/15/51/37/1129155137.db2.gz PHHSRKOCUZMVJY-CYBMUJFWSA-N 1 0 276.399 3.656 20 10 CHCDRO CC[C@@H]([NH2+]CCN1CCCCCC1)c1ccc(C)cc1O ZINC000794793368 1123950479 /nfs/dbraw/zinc/95/04/79/1123950479.db2.gz NXCMGORVFSVFGF-QGZVFWFLSA-N 1 0 290.451 3.617 20 10 CHCDRO CC[C@H]([NH2+]C[C@](C)(O)CCC(C)C)c1ccc(C)cc1O ZINC000794799985 1123950958 /nfs/dbraw/zinc/95/09/58/1123950958.db2.gz AYIWFJKMWRQMAH-FUHWJXTLSA-N 1 0 293.451 3.929 20 10 CHCDRO CC[C@H]([NH2+]CCCC(C)(C)CO)c1ccc(C)cc1O ZINC000794805615 1123955676 /nfs/dbraw/zinc/95/56/76/1123955676.db2.gz XWQCTQLLEMEOLB-HNNXBMFYSA-N 1 0 279.424 3.540 20 10 CHCDRO CC[C@H](C)[C@](C)(O)C[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000794809922 1123956425 /nfs/dbraw/zinc/95/64/25/1123956425.db2.gz RXHXCVUTDUTWRC-JLJPHGGASA-N 1 0 279.424 3.538 20 10 CHCDRO CC[C@@H](C)[C@@](C)(O)C[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000794809923 1123956521 /nfs/dbraw/zinc/95/65/21/1123956521.db2.gz RXHXCVUTDUTWRC-KMFMINBZSA-N 1 0 279.424 3.538 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1C[C@@H](C)O[C@@H](C)C1)c1ccc(C)cc1O ZINC000794814332 1123957321 /nfs/dbraw/zinc/95/73/21/1123957321.db2.gz CYMNHXYNXDRQSJ-HLPPOEQASA-N 1 0 277.408 3.697 20 10 CHCDRO CCOC[C@H]([NH2+][C@@H](CC)c1ccc(C)cc1O)C(C)C ZINC000794812480 1123959025 /nfs/dbraw/zinc/95/90/25/1123959025.db2.gz DQKSPTYWGONIBA-HOTGVXAUSA-N 1 0 279.424 3.802 20 10 CHCDRO CC[C@H]([NH2+][C@@H](CO)c1ccsc1)c1ccc(C)cc1O ZINC000794812448 1123959060 /nfs/dbraw/zinc/95/90/60/1123959060.db2.gz CZEGYROTTSVKRH-GJZGRUSLSA-N 1 0 291.416 3.536 20 10 CHCDRO CC[C@H]([NH2+][C@H](CO)CC(C)(C)C)c1ccc(C)cc1O ZINC000794818340 1123959802 /nfs/dbraw/zinc/95/98/02/1123959802.db2.gz RVUKBZYAEOYGAK-ZFWWWQNUSA-N 1 0 279.424 3.538 20 10 CHCDRO C[C@@H]([NH2+][C@H](CO)CC1CCC1)c1ccc2ccccc2c1O ZINC000794833792 1123965867 /nfs/dbraw/zinc/96/58/67/1123965867.db2.gz LBQGRSDIJMYNJC-CJNGLKHVSA-N 1 0 299.414 3.747 20 10 CHCDRO C[C@H]([NH2+][C@H](CO)CC1CCC1)c1ccc2ccccc2c1O ZINC000794833788 1123966033 /nfs/dbraw/zinc/96/60/33/1123966033.db2.gz LBQGRSDIJMYNJC-BBRMVZONSA-N 1 0 299.414 3.747 20 10 CHCDRO C[C@@H]([NH2+]CCCc1ccccc1F)c1cc(F)ccc1O ZINC000794840677 1123989904 /nfs/dbraw/zinc/98/99/04/1123989904.db2.gz JYPZTHBJORSLTG-GFCCVEGCSA-N 1 0 291.341 3.954 20 10 CHCDRO Cc1ncc([C@@H](C)[NH2+]Cc2cc(Cl)ccc2O)s1 ZINC000865702087 1124006842 /nfs/dbraw/zinc/00/68/42/1124006842.db2.gz USLDEFXGJXHYIJ-MRVPVSSYSA-N 1 0 282.796 3.661 20 10 CHCDRO CCOc1ccc(C[NH2+]CC(C)(C)C(C)(F)F)c(O)c1 ZINC000865789781 1124015576 /nfs/dbraw/zinc/01/55/76/1124015576.db2.gz SBKHCTYAZQYFKG-UHFFFAOYSA-N 1 0 287.350 3.562 20 10 CHCDRO COc1ccccc1[C@H](C)[NH2+]Cc1cc(C)c(C)cc1O ZINC000865821577 1124018200 /nfs/dbraw/zinc/01/82/00/1124018200.db2.gz IKOLAYWSQCDRHY-AWEZNQCLSA-N 1 0 285.387 3.868 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CC[C@H]2CCSC2)c(O)c1 ZINC000866404900 1124063987 /nfs/dbraw/zinc/06/39/87/1124063987.db2.gz XHAFYJREEBLEAF-KGLIPLIRSA-N 1 0 279.449 3.803 20 10 CHCDRO C[C@H]([NH2+]CC(C)(C)F)c1cc(Br)ccc1O ZINC000866409303 1124064879 /nfs/dbraw/zinc/06/48/79/1124064879.db2.gz XZKAFLRZUUOYIP-QMMMGPOBSA-N 1 0 290.176 3.553 20 10 CHCDRO CC[N@H+](Cc1occc1C)Cc1cc(C)ccc1O ZINC000840969775 1124067464 /nfs/dbraw/zinc/06/74/64/1124067464.db2.gz KFIFDFBJNJSSCI-UHFFFAOYSA-N 1 0 259.349 3.624 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2cnc(C)s2)c1 ZINC000866456496 1124069133 /nfs/dbraw/zinc/06/91/33/1124069133.db2.gz ZUPUHXMVGRKISH-NXEZZACHSA-N 1 0 292.404 3.578 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)c2ccc(Cl)cc2O)o1 ZINC000866477962 1124070174 /nfs/dbraw/zinc/07/01/74/1124070174.db2.gz HCPJHUMHJUFROC-SNVBAGLBSA-N 1 0 265.740 3.798 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C1CCC1)[C@@H]1CCOC1)c1ccccc1O ZINC000866512724 1124076616 /nfs/dbraw/zinc/07/66/16/1124076616.db2.gz OFPWGMPISYGPNY-HFTRVMKXSA-N 1 0 289.419 3.638 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2c3ccccc3CN2C)c(O)c1 ZINC000866562143 1124082194 /nfs/dbraw/zinc/08/21/94/1124082194.db2.gz CRGMOEDQSCWWTF-KSSFIOAISA-N 1 0 296.414 3.538 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H]2c3ccccc3CN2C)c1 ZINC000866564454 1124083274 /nfs/dbraw/zinc/08/32/74/1124083274.db2.gz VPFVXIJHIYTZCQ-KSSFIOAISA-N 1 0 296.414 3.538 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CC=CC[C@H]1C(F)(F)F)c1ccccc1O ZINC000866609368 1124087886 /nfs/dbraw/zinc/08/78/86/1124087886.db2.gz MGQNYFMNROISAI-CYZMBNFOSA-N 1 0 285.309 3.940 20 10 CHCDRO C[C@@H]([NH2+]C1([C@@H]2CCCCO2)CCC1)c1ccccc1O ZINC000866623093 1124090872 /nfs/dbraw/zinc/09/08/72/1124090872.db2.gz RYIGPSCHCZOKDR-CJNGLKHVSA-N 1 0 275.392 3.535 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CCCn2nccc21)c1ccc(N(C)C)cc1 ZINC000866632723 1124092331 /nfs/dbraw/zinc/09/23/31/1124092331.db2.gz ORMZXCJXQVTDIN-SJORKVTESA-N 1 0 298.434 3.525 20 10 CHCDRO Cc1cc(N(C)C)ccc1CNc1ccc([C@@H](C)[NH3+])cc1 ZINC000841030857 1124107979 /nfs/dbraw/zinc/10/79/79/1124107979.db2.gz MDTZAHYTCYSHAS-CQSZACIVSA-N 1 0 283.419 3.693 20 10 CHCDRO C[C@H]([NH2+]CC1(O)CCCC1)c1ccc2ccccc2c1O ZINC000087015803 1129172139 /nfs/dbraw/zinc/17/21/39/1129172139.db2.gz WURMSLNZWMMHDI-ZDUSSCGKSA-N 1 0 285.387 3.501 20 10 CHCDRO COC(C)(C)C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000122173436 1124472413 /nfs/dbraw/zinc/47/24/13/1124472413.db2.gz RFAUWDITRMGUKB-OAHLLOKOSA-N 1 0 290.451 3.753 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1ccc(N(C)C)cc1)[C@H]1CCCOC1 ZINC000872064424 1124672472 /nfs/dbraw/zinc/67/24/72/1124672472.db2.gz YSEIVTVGMZYWET-HFTRVMKXSA-N 1 0 290.451 3.608 20 10 CHCDRO Cc1cc(N2CCCCC2)ccc1C1=CCC[NH2+]CC1 ZINC001238951422 1131276335 /nfs/dbraw/zinc/27/63/35/1131276335.db2.gz VHIXHTVJYOWPKG-UHFFFAOYSA-N 1 0 270.420 3.752 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1C[C@@H]2CCC[C@@H]2O1)c1ccc(C)cc1O ZINC000872105728 1124683927 /nfs/dbraw/zinc/68/39/27/1124683927.db2.gz BDIDVTHRKCDQOE-DNUAJFIVSA-N 1 0 289.419 3.699 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H]2C[C@H]3CCC[C@H]3O2)c(O)c1 ZINC000872106855 1124684772 /nfs/dbraw/zinc/68/47/72/1124684772.db2.gz IKRHMVKEMNOEDC-QSJFSLAZSA-N 1 0 289.419 3.617 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1ccccc1O)[C@H](O)c1ccccc1 ZINC000872134422 1124692897 /nfs/dbraw/zinc/69/28/97/1124692897.db2.gz WCJZVVWXUDRNIQ-RPVQJOFSSA-N 1 0 285.387 3.555 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCC[C@@H](OC3CCC3)CC2)c1 ZINC000872262125 1124701453 /nfs/dbraw/zinc/70/14/53/1124701453.db2.gz QDHUSCDMNKWFOZ-QGZVFWFLSA-N 1 0 289.419 3.624 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccccc1Cl)c1ccccc1O ZINC000019908213 1124768922 /nfs/dbraw/zinc/76/89/22/1124768922.db2.gz TWASBJJFDUNVRD-LLVKDONJSA-N 1 0 261.752 3.896 20 10 CHCDRO COc1cc(C[N@H+](C)[C@@H](C)C2CC2)c(O)c(C(C)(C)C)c1 ZINC000874090103 1124817051 /nfs/dbraw/zinc/81/70/51/1124817051.db2.gz OPOGDIXDMRYXCH-LBPRGKRZSA-N 1 0 291.435 3.929 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)[C@H]2CCSC2)cc1C(C)C ZINC000125022035 1124834155 /nfs/dbraw/zinc/83/41/55/1124834155.db2.gz ZLZJVNULGSBAEK-AWEZNQCLSA-N 1 0 279.449 3.761 20 10 CHCDRO CN(C)c1ccc(C[NH2+]Cc2cc(Cl)ccc2F)cc1 ZINC000125127232 1124854925 /nfs/dbraw/zinc/85/49/25/1124854925.db2.gz DANOYVZPHKQDAK-UHFFFAOYSA-N 1 0 292.785 3.835 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@@H]2CCC(F)(F)C2)cc1Cl ZINC000825752538 1124866321 /nfs/dbraw/zinc/86/63/21/1124866321.db2.gz CHODJAPBXIZWFB-SNVBAGLBSA-N 1 0 289.753 3.879 20 10 CHCDRO COc1cccc(C[NH+]2CCC(c3ccccc3)CC2)c1O ZINC000125411076 1124890290 /nfs/dbraw/zinc/89/02/90/1124890290.db2.gz ZHFRGNHINHZLNV-UHFFFAOYSA-N 1 0 297.398 3.780 20 10 CHCDRO CC(C)[N@H+](Cc1ccns1)Cc1ccc(N(C)C)cc1 ZINC000876584541 1124964040 /nfs/dbraw/zinc/96/40/40/1124964040.db2.gz IXJJTLQRLREPJE-UHFFFAOYSA-N 1 0 289.448 3.620 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+](C)[C@H](C)c1cccs1 ZINC000876590138 1124964572 /nfs/dbraw/zinc/96/45/72/1124964572.db2.gz SVCJZELPPWITLT-GFCCVEGCSA-N 1 0 261.390 3.955 20 10 CHCDRO COc1ccccc1[C@H](C)[NH2+]Cc1ccc(C)cc1O ZINC000876883123 1124986689 /nfs/dbraw/zinc/98/66/89/1124986689.db2.gz ZUPJFRQUOPUDEK-ZDUSSCGKSA-N 1 0 271.360 3.560 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2ccc(C)cc2O)c(C)c1 ZINC000876943056 1124991535 /nfs/dbraw/zinc/99/15/35/1124991535.db2.gz AFDMRKLJEMBHQT-UHFFFAOYSA-N 1 0 255.361 3.607 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H]2CSCc3ccccc32)c(O)c1 ZINC000876974645 1124994589 /nfs/dbraw/zinc/99/45/89/1124994589.db2.gz NVAZWKLGPWVBIT-MRXNPFEDSA-N 1 0 285.412 3.778 20 10 CHCDRO Cc1ccc(C[NH2+]C2(c3nccs3)CCCC2)c(O)c1 ZINC000877042065 1125001954 /nfs/dbraw/zinc/00/19/54/1125001954.db2.gz LYQPPBRFGJPRAG-UHFFFAOYSA-N 1 0 288.416 3.716 20 10 CHCDRO Cc1ccc(C[NH2+]C[C@H](c2cccnc2)C(C)C)c(O)c1 ZINC000877081998 1125006991 /nfs/dbraw/zinc/00/69/91/1125006991.db2.gz KHGIWHFACVPTOI-KRWDZBQOSA-N 1 0 284.403 3.625 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)c2cccc(F)c2F)c(O)c1 ZINC000877117444 1125011431 /nfs/dbraw/zinc/01/14/31/1125011431.db2.gz AFERABIPHGEIMZ-LLVKDONJSA-N 1 0 277.314 3.830 20 10 CHCDRO CCOCC(C)(C)C[NH2+]Cc1cc(Cl)c(C)cc1O ZINC000825944111 1125018463 /nfs/dbraw/zinc/01/84/63/1125018463.db2.gz QETLEOQQVRMQLN-UHFFFAOYSA-N 1 0 285.815 3.506 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H]2CCO[C@H](c3ccccc3)C2)c(O)c1 ZINC000877377139 1125024334 /nfs/dbraw/zinc/02/43/34/1125024334.db2.gz VZUREGKNLBRDQL-MJGOQNOKSA-N 1 0 297.398 3.711 20 10 CHCDRO COc1ccc(O)c(C[NH2+]Cc2ccccc2CC(C)C)c1 ZINC000529637525 1125024597 /nfs/dbraw/zinc/02/45/97/1125024597.db2.gz CMRCICGYOMKHMJ-UHFFFAOYSA-N 1 0 299.414 3.889 20 10 CHCDRO CSCc1cccc(C[NH2+]Cc2c(C)cccc2O)c1 ZINC000877462902 1125029165 /nfs/dbraw/zinc/02/91/65/1125029165.db2.gz ZPAPCPKTJBPDLL-UHFFFAOYSA-N 1 0 287.428 3.853 20 10 CHCDRO CCO[C@H](C[NH2+]Cc1c(C)cccc1O)c1ccccc1 ZINC000877481563 1125033604 /nfs/dbraw/zinc/03/36/04/1125033604.db2.gz KZILGSSFMNPHPY-GOSISDBHSA-N 1 0 285.387 3.568 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H]2C[C@@H](C)Oc3ccccc32)c(O)c1 ZINC000877561317 1125044516 /nfs/dbraw/zinc/04/45/16/1125044516.db2.gz FCTPLPJBJVAISC-CZUORRHYSA-N 1 0 283.371 3.703 20 10 CHCDRO Cc1cccc(O)c1CNc1ccc(C[NH+](C)C)cc1F ZINC000877588519 1125049672 /nfs/dbraw/zinc/04/96/72/1125049672.db2.gz RRBQARYETPCGLY-UHFFFAOYSA-N 1 0 288.366 3.513 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]CC1(C(F)(F)F)CCCC1 ZINC000877659696 1125059292 /nfs/dbraw/zinc/05/92/92/1125059292.db2.gz ZWOJDZXSHRIQGP-UHFFFAOYSA-N 1 0 287.325 3.913 20 10 CHCDRO Cc1ncc([C@H](C)[NH2+]Cc2cc(Cl)c(C)cc2O)s1 ZINC000877685234 1125063039 /nfs/dbraw/zinc/06/30/39/1125063039.db2.gz QMHPUXZYPVBZHT-VIFPVBQESA-N 1 0 296.823 3.970 20 10 CHCDRO CC(C)O[C@@H](C[N@@H+]1Cc2cccc(O)c2C1)c1ccccc1 ZINC000877703204 1125066195 /nfs/dbraw/zinc/06/61/95/1125066195.db2.gz WDJCZMFFBDAWIR-IBGZPJMESA-N 1 0 297.398 3.874 20 10 CHCDRO COc1cc(C[NH2+][C@H](C)c2ccccc2O)ccc1Cl ZINC000877755938 1125072600 /nfs/dbraw/zinc/07/26/00/1125072600.db2.gz TYWQLALIFNDTBF-LLVKDONJSA-N 1 0 291.778 3.905 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1C[C@H]1c1ccccc1)c1ccccc1O ZINC000877756575 1125074783 /nfs/dbraw/zinc/07/47/83/1125074783.db2.gz UKWFVBPAEDYNPA-UNEWFSDZSA-N 1 0 267.372 3.847 20 10 CHCDRO CC(C)c1ncc(C[NH2+][C@H](C)c2ccccc2O)s1 ZINC000877756583 1125074997 /nfs/dbraw/zinc/07/49/97/1125074997.db2.gz VQLWZLUFNHZION-LLVKDONJSA-N 1 0 276.405 3.823 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc([C@@H]2C[C@H]2C)o1)c1ccccc1O ZINC000877756603 1125075009 /nfs/dbraw/zinc/07/50/09/1125075009.db2.gz XJIHRHBKAQPLPK-LALPHHSUSA-N 1 0 271.360 3.959 20 10 CHCDRO C[C@H]([NH2+]CC[C@@H]1CCCC1(F)F)c1ccccc1O ZINC000878354161 1125143402 /nfs/dbraw/zinc/14/34/02/1125143402.db2.gz DAGZETWPKPKODT-RYUDHWBXSA-N 1 0 269.335 3.868 20 10 CHCDRO COc1cccc(C[N@@H+]2C[C@H](c3ccccc3)C[C@H]2C)c1O ZINC000127579564 1125203045 /nfs/dbraw/zinc/20/30/45/1125203045.db2.gz LVSXDCKMRQSJHT-RHSMWYFYSA-N 1 0 297.398 3.779 20 10 CHCDRO C[C@@H]([NH2+]Cc1cccnc1C(F)(F)F)c1ccccc1O ZINC000879649737 1125222936 /nfs/dbraw/zinc/22/29/36/1125222936.db2.gz FNICGEMOVWUYSQ-SNVBAGLBSA-N 1 0 296.292 3.657 20 10 CHCDRO CC[C@@H](C)C[C@H](C)[NH2+]Cc1cc(Cl)cc(OC)c1O ZINC000228675627 1125251159 /nfs/dbraw/zinc/25/11/59/1125251159.db2.gz NWHNUNQXKPACRS-MNOVXSKESA-N 1 0 285.815 3.969 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CCc2ccccc2C1 ZINC000211489250 1125306905 /nfs/dbraw/zinc/30/69/05/1125306905.db2.gz ZWSOADYITRSEOU-UHFFFAOYSA-N 1 0 273.763 3.604 20 10 CHCDRO COc1ccc([C@@H](C)[NH2+]Cc2ccccc2O)cc1C ZINC000897417337 1125320604 /nfs/dbraw/zinc/32/06/04/1125320604.db2.gz KQCNDAAJTYBORA-CYBMUJFWSA-N 1 0 271.360 3.560 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)C1CCC1 ZINC000130036945 1125355739 /nfs/dbraw/zinc/35/57/39/1125355739.db2.gz PUQBXGJHJLKCLV-HNNXBMFYSA-N 1 0 272.436 3.955 20 10 CHCDRO CCC[C@@H]1CCCC[N@@H+]1Cc1cccc(OCC)c1O ZINC000213582865 1125363135 /nfs/dbraw/zinc/36/31/35/1125363135.db2.gz BQLZWGSWSCWTML-OAHLLOKOSA-N 1 0 277.408 3.946 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]CC[C@@H]2CCCC2(F)F)c1 ZINC000883265584 1125388628 /nfs/dbraw/zinc/38/86/28/1125388628.db2.gz FTNFFIDHDXSQDN-ZDUSSCGKSA-N 1 0 299.361 3.706 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]CC[C@H]1CCCC1(F)F)CC2 ZINC000883274703 1125390350 /nfs/dbraw/zinc/39/03/50/1125390350.db2.gz RYQUPEPIWQVJBW-OLZOCXBDSA-N 1 0 281.346 3.795 20 10 CHCDRO Cc1ccc(C[NH2+][C@H]2CCc3cccc(O)c32)c(Cl)n1 ZINC000883301489 1125391830 /nfs/dbraw/zinc/39/18/30/1125391830.db2.gz BCRBFGOSYYHDCE-ZDUSSCGKSA-N 1 0 288.778 3.526 20 10 CHCDRO C[C@H]([NH2+]CCCSc1nccs1)c1ccccc1 ZINC000132183712 1125414686 /nfs/dbraw/zinc/41/46/86/1125414686.db2.gz WUDHVPBCSYBLLC-LBPRGKRZSA-N 1 0 278.446 3.976 20 10 CHCDRO CCOc1cccc(C[N@H+](CC)C2CCCC2)c1O ZINC000132162627 1125414861 /nfs/dbraw/zinc/41/48/61/1125414861.db2.gz ASGSFNKAMNXIQE-UHFFFAOYSA-N 1 0 263.381 3.555 20 10 CHCDRO CC[C@@H](C)[C@@H](C)[NH2+]CCCSc1nccs1 ZINC000132160236 1125415107 /nfs/dbraw/zinc/41/51/07/1125415107.db2.gz CUVNTRXMBRZUNJ-GHMZBOCLSA-N 1 0 258.456 3.650 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]CC[C@H]1CCC2(CCC2)O1 ZINC000717176104 1125422198 /nfs/dbraw/zinc/42/21/98/1125422198.db2.gz WZOSCJWYMOBHNK-GFCCVEGCSA-N 1 0 295.810 3.627 20 10 CHCDRO COC1(C[NH2+]Cc2cc(-c3ccccc3)ccc2O)CCC1 ZINC000779987540 1129179898 /nfs/dbraw/zinc/17/98/98/1129179898.db2.gz WIVOYMQZJKKRKS-UHFFFAOYSA-N 1 0 297.398 3.718 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@@H]1CCc3ccccc31)CC2 ZINC000295923188 1129220149 /nfs/dbraw/zinc/22/01/49/1129220149.db2.gz JUNGQAGDAFDSEA-HZPDHXFCSA-N 1 0 265.356 3.657 20 10 CHCDRO COc1ccc([C@@H](C)[NH2+][C@@H]2CCc3cccc(O)c32)cc1 ZINC000296237678 1129220781 /nfs/dbraw/zinc/22/07/81/1129220781.db2.gz APXKFXPAMUNGCB-MLGOLLRUSA-N 1 0 283.371 3.739 20 10 CHCDRO C[C@H]([NH2+]CCC(C)(C)CO)c1ccc2ccccc2c1O ZINC000296475679 1129222892 /nfs/dbraw/zinc/22/28/92/1129222892.db2.gz NZPCAEAEYQWUCR-ZDUSSCGKSA-N 1 0 287.403 3.605 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]CCC2CCCC2)c1 ZINC000037739393 1129258112 /nfs/dbraw/zinc/25/81/12/1129258112.db2.gz BABSJPJUIFSCKK-GFCCVEGCSA-N 1 0 263.381 3.632 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccccc1COC)c1ccccc1O ZINC000037762631 1129266391 /nfs/dbraw/zinc/26/63/91/1129266391.db2.gz ACCJYCABULBEAM-KRWDZBQOSA-N 1 0 285.387 3.780 20 10 CHCDRO Cc1ccccc1C[C@@H](C)[NH2+][C@@H](C)c1ccccc1O ZINC000037776897 1129268614 /nfs/dbraw/zinc/26/86/14/1129268614.db2.gz SOQUKHBTNJJRKI-CABCVRRESA-N 1 0 269.388 3.982 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H](C)Cc2cccc(F)c2)c1 ZINC000735508690 1129348858 /nfs/dbraw/zinc/34/88/58/1129348858.db2.gz LIJOBAQLTHZTOQ-CYBMUJFWSA-N 1 0 273.351 3.561 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H](C)Cc2cccc(F)c2)c1 ZINC000735508691 1129348905 /nfs/dbraw/zinc/34/89/05/1129348905.db2.gz LIJOBAQLTHZTOQ-ZDUSSCGKSA-N 1 0 273.351 3.561 20 10 CHCDRO CCOCc1cc(C[NH2+]CCCC2CC2)ccc1OC ZINC000736361151 1129372759 /nfs/dbraw/zinc/37/27/59/1129372759.db2.gz OTQLJATWDTWQFF-UHFFFAOYSA-N 1 0 277.408 3.512 20 10 CHCDRO CSC[C@@H](C)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000736361296 1129373013 /nfs/dbraw/zinc/37/30/13/1129373013.db2.gz SGNFCZMMHYWUTF-CYBMUJFWSA-N 1 0 287.428 3.900 20 10 CHCDRO Cc1ccc(O)c(C[N@H+](CCC(F)(F)F)CC2CC2)c1 ZINC000091901841 1129374543 /nfs/dbraw/zinc/37/45/43/1129374543.db2.gz RCUFDEQAJKNSIF-UHFFFAOYSA-N 1 0 287.325 3.865 20 10 CHCDRO Cc1ccc([C@H](C)C[NH2+]Cc2ccc(N(C)C)cc2)cc1 ZINC000738435869 1129393814 /nfs/dbraw/zinc/39/38/14/1129393814.db2.gz OBNVMHYANHAAAK-MRXNPFEDSA-N 1 0 282.431 3.954 20 10 CHCDRO CCO[C@@H]1C[C@@H]([N@H+](C)Cc2cc(C)c(C)cc2O)C1(C)C ZINC000740861683 1129420738 /nfs/dbraw/zinc/42/07/38/1129420738.db2.gz QXGUYJRCLQFRBM-IAGOWNOFSA-N 1 0 291.435 3.644 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCC[C@H](Nc3ccccc3)C2)c1 ZINC000093704418 1129427320 /nfs/dbraw/zinc/42/73/20/1129427320.db2.gz WSKTVNDOMKYPFF-SFHVURJKSA-N 1 0 296.414 3.777 20 10 CHCDRO C[C@@H]([NH2+]CCSc1ccccc1)c1cc(F)ccc1O ZINC000094617726 1129448107 /nfs/dbraw/zinc/44/81/07/1129448107.db2.gz KTHIXBSIEUTIKP-GFCCVEGCSA-N 1 0 291.391 3.974 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)CCc1ccco1)c1cc(F)ccc1O ZINC000094616935 1129448314 /nfs/dbraw/zinc/44/83/14/1129448314.db2.gz LAPWQKLJMSSDPI-NWDGAFQWSA-N 1 0 277.339 3.796 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1Cc2ccccc21)c1cc(F)ccc1O ZINC000094617596 1129448411 /nfs/dbraw/zinc/44/84/11/1129448411.db2.gz CZAAHWQWQZEBMV-YPMHNXCESA-N 1 0 271.335 3.522 20 10 CHCDRO CC(C)[N@H+](CCCCF)Cc1ccc(N(C)C)cc1 ZINC000795868744 1129453934 /nfs/dbraw/zinc/45/39/34/1129453934.db2.gz RWMWKTHHKWRZOW-UHFFFAOYSA-N 1 0 266.404 3.713 20 10 CHCDRO CC1=C(C)C[N@H+](Cc2c(O)cccc2Cl)CC1 ZINC000796020256 1129462827 /nfs/dbraw/zinc/46/28/27/1129462827.db2.gz KTZBAGYBPWGKIE-UHFFFAOYSA-N 1 0 251.757 3.588 20 10 CHCDRO Cc1ccc(CC[C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2)o1 ZINC000742381521 1129472873 /nfs/dbraw/zinc/47/28/73/1129472873.db2.gz ZCVWSDHOCBMBQG-CQSZACIVSA-N 1 0 286.419 3.765 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H]2CSc3ccccc32)cc1C ZINC000742371809 1129475127 /nfs/dbraw/zinc/47/51/27/1129475127.db2.gz FABOYFVIKUHSIB-OAHLLOKOSA-N 1 0 285.412 3.946 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccncc1 ZINC000742372238 1129475522 /nfs/dbraw/zinc/47/55/22/1129475522.db2.gz KBWNIXUHYOOFEZ-INIZCTEOSA-N 1 0 287.382 3.528 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2CC[C@@H]3CCC[C@@H]3C2)cc1F ZINC000742378734 1129476218 /nfs/dbraw/zinc/47/62/18/1129476218.db2.gz LNZLVEWAPZEFNL-ARFHVFGLSA-N 1 0 290.426 3.950 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H]2CCC[C@@H](C)[C@H]2C)c1O ZINC000250514068 1129483280 /nfs/dbraw/zinc/48/32/80/1129483280.db2.gz LXQPTJZOKURNCP-UMVBOHGHSA-N 1 0 277.408 3.705 20 10 CHCDRO COc1cc(C)c(C[NH2+]CC2C[C@H](C)C[C@@H](C)C2)c(O)c1 ZINC001206612461 1129523226 /nfs/dbraw/zinc/52/32/26/1129523226.db2.gz JZJGYGUCXPLCHQ-CHWSQXEVSA-N 1 0 291.435 3.871 20 10 CHCDRO CCC[N@H+](Cc1ccccc1O)[C@H](C)c1ccncc1 ZINC000743870147 1129542260 /nfs/dbraw/zinc/54/22/60/1129542260.db2.gz IUHSQPSOZKLXJY-CQSZACIVSA-N 1 0 270.376 3.760 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]CC2=CCCCC2)c1 ZINC000379578532 1129556589 /nfs/dbraw/zinc/55/65/89/1129556589.db2.gz CFTSTCFOZYFQFU-GFCCVEGCSA-N 1 0 261.365 3.552 20 10 CHCDRO CC[C@H]1C[C@H](C)C[N@@H+]1Cc1cc2c(cc1O)CCC2 ZINC000744444603 1129578275 /nfs/dbraw/zinc/57/82/75/1129578275.db2.gz XQCDMCCTQKBEOF-LRDDRELGSA-N 1 0 259.393 3.501 20 10 CHCDRO Oc1cc(OCc2ccccc2)ccc1C[NH2+][C@@H]1CC12CC2 ZINC000822498244 1131384766 /nfs/dbraw/zinc/38/47/66/1131384766.db2.gz WVASVEJMAZKOTQ-GOSISDBHSA-N 1 0 295.382 3.613 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2C[C@H](OC(C)C)C2(C)C)c(O)c1 ZINC000766330131 1129602888 /nfs/dbraw/zinc/60/28/88/1129602888.db2.gz GXLLEPALNBYOGR-XKQJLSEDSA-N 1 0 291.435 3.943 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2C[C@@H](OC(C)C)C2(C)C)c1 ZINC000766331848 1129604414 /nfs/dbraw/zinc/60/44/14/1129604414.db2.gz NMZUKAUDONQMGH-IAOVAPTHSA-N 1 0 291.435 3.943 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C[C@H](C)c2ccncc2)cc1 ZINC000749297243 1129656444 /nfs/dbraw/zinc/65/64/44/1129656444.db2.gz SFTLVONYHAGKHG-INIZCTEOSA-N 1 0 297.446 3.821 20 10 CHCDRO CC[C@@H]([NH2+]CC(C)(C)SC)c1ccc(N(C)C)cc1 ZINC000766360800 1129660189 /nfs/dbraw/zinc/66/01/89/1129660189.db2.gz BIRKXHIBHNSKCL-OAHLLOKOSA-N 1 0 280.481 3.935 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@@H](OC)C(C)(C)C)cc1 ZINC000766368496 1129660963 /nfs/dbraw/zinc/66/09/63/1129660963.db2.gz IESXBZPHIHGKRD-RHSMWYFYSA-N 1 0 292.467 3.854 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](OC)C(C)(C)C)c1ccc(N(C)C)cc1 ZINC000766370793 1129661053 /nfs/dbraw/zinc/66/10/53/1129661053.db2.gz VQEWMIFPYGCSJL-DLBZAZTESA-N 1 0 292.467 3.854 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](OC)C(C)(C)C)c1ccc(N(C)C)cc1 ZINC000766370796 1129661067 /nfs/dbraw/zinc/66/10/67/1129661067.db2.gz VQEWMIFPYGCSJL-SJORKVTESA-N 1 0 292.467 3.854 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)C1CCOCC1 ZINC000766387785 1129663583 /nfs/dbraw/zinc/66/35/83/1129663583.db2.gz HZSYELASHQEISW-KBXCAEBGSA-N 1 0 290.451 3.608 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)Cc1ccncc1)c1ccc(N(C)C)cc1 ZINC000766487955 1129669401 /nfs/dbraw/zinc/66/94/01/1129669401.db2.gz IXPBQVVSGYCWPZ-HNAYVOBHSA-N 1 0 297.446 3.820 20 10 CHCDRO Cc1oc2ccccc2c1CC[NH2+]Cc1ccccc1O ZINC000766479235 1129670827 /nfs/dbraw/zinc/67/08/27/1129670827.db2.gz NFAGYNMFPVUXET-UHFFFAOYSA-N 1 0 281.355 3.779 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCNc2ccccc2)cc1 ZINC000766516313 1129678794 /nfs/dbraw/zinc/67/87/94/1129678794.db2.gz VMWAMOKPLMAAAI-MRXNPFEDSA-N 1 0 297.446 3.905 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CCNc2ccccc2)cc1 ZINC000766516312 1129678996 /nfs/dbraw/zinc/67/89/96/1129678996.db2.gz VMWAMOKPLMAAAI-INIZCTEOSA-N 1 0 297.446 3.905 20 10 CHCDRO C[C@@H]1CC[C@@H]1[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000796525766 1129773076 /nfs/dbraw/zinc/77/30/76/1129773076.db2.gz FVDPHERHQKOKLB-DYVFJYSZSA-N 1 0 267.372 3.947 20 10 CHCDRO C[C@H]1CC[C@H]1[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000796527131 1129775354 /nfs/dbraw/zinc/77/53/54/1129775354.db2.gz VSHYILBHYFRIOR-IINYFYTJSA-N 1 0 286.341 3.660 20 10 CHCDRO CC/C=C\CC[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1 ZINC000767339065 1129785372 /nfs/dbraw/zinc/78/53/72/1129785372.db2.gz SGVLVEAGZAFALP-YIEVGGLXSA-N 1 0 288.435 3.530 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCc3cccc(F)c3C2)cc1C ZINC000767990398 1129824795 /nfs/dbraw/zinc/82/47/95/1129824795.db2.gz ZOIPGUFYHBAZFX-UHFFFAOYSA-N 1 0 285.362 3.706 20 10 CHCDRO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccccc1O)[C@H](C)C2 ZINC000272471239 1129838038 /nfs/dbraw/zinc/83/80/38/1129838038.db2.gz RWFJPOMGQJZNDE-ACJLOTCBSA-N 1 0 267.372 3.724 20 10 CHCDRO CCOc1ccc(C[N@H+](C)C2CCC(C)CC2)c(O)c1 ZINC000768197822 1129843466 /nfs/dbraw/zinc/84/34/66/1129843466.db2.gz NYNZMXZDFUOZRW-UHFFFAOYSA-N 1 0 277.408 3.801 20 10 CHCDRO COc1ccc([C@H](C)[N@H+](C)Cc2ccc(N(C)C)cc2)cc1 ZINC000768236041 1129845567 /nfs/dbraw/zinc/84/55/67/1129845567.db2.gz CJUZPYLMLPYGGH-HNNXBMFYSA-N 1 0 298.430 3.954 20 10 CHCDRO CCOc1cccc(C[N@H+](CCC(C)C)C2CC2)c1O ZINC000768257127 1129847775 /nfs/dbraw/zinc/84/77/75/1129847775.db2.gz GZOJLATYEXWMRN-UHFFFAOYSA-N 1 0 277.408 3.801 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CCC[C@@H]2CC(C)C)c1 ZINC000768316319 1129852621 /nfs/dbraw/zinc/85/26/21/1129852621.db2.gz CKFVUPQFHUFJPL-OAHLLOKOSA-N 1 0 277.408 3.801 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCC(F)(F)C1)c1ccc(N(C)C)cc1 ZINC000381949986 1129853651 /nfs/dbraw/zinc/85/36/51/1129853651.db2.gz AWFFXFHDFFCUFC-DGCLKSJQSA-N 1 0 268.351 3.591 20 10 CHCDRO COc1cc(C[N@@H+]2CC[C@@H](CC(C)C)C2)c(O)cc1C ZINC000768465489 1129858755 /nfs/dbraw/zinc/85/87/55/1129858755.db2.gz IDCNBVHWBPGPEA-AWEZNQCLSA-N 1 0 277.408 3.577 20 10 CHCDRO COc1cccc(C[NH+]2CC(C)(C)CC(C)(C)C2)c1O ZINC000768531965 1129860895 /nfs/dbraw/zinc/86/08/95/1129860895.db2.gz IWFOKJNDULSXCJ-UHFFFAOYSA-N 1 0 277.408 3.659 20 10 CHCDRO C[C@@H](C1CC1)[N@H+](Cc1ccc(N(C)C)c(F)c1)C1CC1 ZINC000768532886 1129861343 /nfs/dbraw/zinc/86/13/43/1129861343.db2.gz QCEIRGVPWOQJOR-LBPRGKRZSA-N 1 0 276.399 3.655 20 10 CHCDRO COc1ccc(C[NH2+]C[C@@H]2CCCC(F)(F)C2)cc1C ZINC000800276348 1129861930 /nfs/dbraw/zinc/86/19/30/1129861930.db2.gz LMWUEONEMNDEJZ-CQSZACIVSA-N 1 0 283.362 3.919 20 10 CHCDRO COc1ccc(C[NH2+]C[C@H]2CCCC(F)(F)C2)cc1C ZINC000800276346 1129861981 /nfs/dbraw/zinc/86/19/81/1129861981.db2.gz LMWUEONEMNDEJZ-AWEZNQCLSA-N 1 0 283.362 3.919 20 10 CHCDRO COc1cccc(O)c1C[N@H+](CC(C)C)C1CCCC1 ZINC000768650191 1129866844 /nfs/dbraw/zinc/86/68/44/1129866844.db2.gz JDKHMHZWDLUXKS-UHFFFAOYSA-N 1 0 277.408 3.801 20 10 CHCDRO Cc1cc(C[NH2+][C@@H](C)c2cn[nH]c2)ccc1N1CCCCC1 ZINC000828858059 1131403068 /nfs/dbraw/zinc/40/30/68/1131403068.db2.gz NAGCINMYODVGLY-HNNXBMFYSA-N 1 0 298.434 3.559 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[NH2+][C@H]1CCC12CCC2 ZINC000800476050 1129875804 /nfs/dbraw/zinc/87/58/04/1129875804.db2.gz GJUZJAXXAROQGP-KRWDZBQOSA-N 1 0 270.420 3.709 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2CCC[C@@H]3C[C@@]32C)cc1F ZINC000800475487 1129875966 /nfs/dbraw/zinc/87/59/66/1129875966.db2.gz WWUVKZOHMVKGLC-XYPHTWIQSA-N 1 0 276.399 3.560 20 10 CHCDRO C[N@@H+](Cc1ccccc1O)C[C@@H]1C[C@H]1c1ccccc1 ZINC000768873537 1129878705 /nfs/dbraw/zinc/87/87/05/1129878705.db2.gz PJSJDGDNUOMNRF-IRXDYDNUSA-N 1 0 267.372 3.628 20 10 CHCDRO CCSCCC[NH2+][C@@H](CC)c1ccc(N(C)C)cc1 ZINC000800492578 1129880097 /nfs/dbraw/zinc/88/00/97/1129880097.db2.gz MHYLMVXIEWYOCN-INIZCTEOSA-N 1 0 280.481 3.937 20 10 CHCDRO C[C@@H]([NH2+]CCc1cccc2[nH]ccc21)c1cc(F)ccc1O ZINC000800500619 1129881288 /nfs/dbraw/zinc/88/12/88/1129881288.db2.gz FXTCPFPRKCIAIM-GFCCVEGCSA-N 1 0 298.361 3.906 20 10 CHCDRO CCOCc1cc(C[NH2+][C@@H](C)CCC2CC2)ccc1OC ZINC000768952180 1129885602 /nfs/dbraw/zinc/88/56/02/1129885602.db2.gz LXJAMNYFWSSHAR-AWEZNQCLSA-N 1 0 291.435 3.900 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC[C@H]2c2ccc(O)cc2)cc1 ZINC000769107650 1129891597 /nfs/dbraw/zinc/89/15/97/1129891597.db2.gz ZAEFMDSECPKOPH-IBGZPJMESA-N 1 0 296.414 3.795 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[NH2+][C@H]1CCC[C@H]2C[C@H]21 ZINC000800890752 1129897028 /nfs/dbraw/zinc/89/70/28/1129897028.db2.gz QTHDXNXEHCGGTE-JQHSSLGASA-N 1 0 270.420 3.565 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CCC[C@@H]1C1CCC1 ZINC000769246265 1129898275 /nfs/dbraw/zinc/89/82/75/1129898275.db2.gz YWJDUBITKRWGNV-CQSZACIVSA-N 1 0 265.784 3.810 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CC[C@@H]1C1CCC1 ZINC000800970746 1129900766 /nfs/dbraw/zinc/90/07/66/1129900766.db2.gz DSJLAYOFPHHRPV-MSOLQXFVSA-N 1 0 272.436 3.729 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CCC[C@@H]2C(C)(C)C)c(O)c1 ZINC000769308962 1129901060 /nfs/dbraw/zinc/90/10/60/1129901060.db2.gz DRAICISRPKBUEG-MRXNPFEDSA-N 1 0 277.408 3.801 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CCC[C@@H]2C(C)(C)C)c1 ZINC000769313472 1129901651 /nfs/dbraw/zinc/90/16/51/1129901651.db2.gz NXNFBIPLJGRMCC-MRXNPFEDSA-N 1 0 277.408 3.801 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CCc3c(C)cccc3C2)c(O)c1 ZINC000769337888 1129903626 /nfs/dbraw/zinc/90/36/26/1129903626.db2.gz ILMZOJIFPOTMLE-UHFFFAOYSA-N 1 0 297.398 3.658 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CCc3c(C)cccc3C2)c1 ZINC000769338690 1129903861 /nfs/dbraw/zinc/90/38/61/1129903861.db2.gz NMQIKGBJKMEYNX-UHFFFAOYSA-N 1 0 297.398 3.658 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CCCCC[C@H]2C)c(O)c1 ZINC000769405951 1129906626 /nfs/dbraw/zinc/90/66/26/1129906626.db2.gz ZFMZSAGPCBCSPU-CYBMUJFWSA-N 1 0 263.381 3.555 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC[C@H](Cc3ccc(F)cc3)C2)c1 ZINC000769426141 1129907261 /nfs/dbraw/zinc/90/72/61/1129907261.db2.gz MRBWFHXZWCEBTH-MRXNPFEDSA-N 1 0 299.389 3.904 20 10 CHCDRO CCCN(CCC)c1ccc(C[N@H+](C)CC(C)(C)O)cc1 ZINC000769424505 1129907691 /nfs/dbraw/zinc/90/76/91/1129907691.db2.gz GAMVBSMYNYTTGJ-UHFFFAOYSA-N 1 0 292.467 3.516 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCc3ccsc3C2)cc1F ZINC000769433406 1129908021 /nfs/dbraw/zinc/90/80/21/1129908021.db2.gz IYUMSPMXJXQVQI-UHFFFAOYSA-N 1 0 290.407 3.512 20 10 CHCDRO COc1cccc(O)c1C[N@@H+]1C[C@H](c2ccccc2)C[C@@H]1C ZINC000769445515 1129910622 /nfs/dbraw/zinc/91/06/22/1129910622.db2.gz JZAOPGGSILOFLB-GOEBONIOSA-N 1 0 297.398 3.779 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCS[C@@H]3CCCC[C@@H]32)cc1 ZINC000769497900 1129914179 /nfs/dbraw/zinc/91/41/79/1129914179.db2.gz HKFRSBXKSDUNBY-DLBZAZTESA-N 1 0 290.476 3.613 20 10 CHCDRO CCSCC[C@@H](C)[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC000769551021 1129917383 /nfs/dbraw/zinc/91/73/83/1129917383.db2.gz UNXGZNSSSQVDHV-CQSZACIVSA-N 1 0 280.481 3.716 20 10 CHCDRO CCc1ccccc1CC[N@H+](C)Cc1ccccc1O ZINC000769745856 1129924525 /nfs/dbraw/zinc/92/45/25/1129924525.db2.gz GBHJWDQDGCYHJK-UHFFFAOYSA-N 1 0 269.388 3.629 20 10 CHCDRO Oc1ccccc1C[NH+]1CCC(c2ccc(F)cc2)CC1 ZINC000770510035 1129948295 /nfs/dbraw/zinc/94/82/95/1129948295.db2.gz HRJKHMCWBHZBRN-UHFFFAOYSA-N 1 0 285.362 3.911 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CC[C@H](c2cccc(F)c2)C1 ZINC000770510916 1129948682 /nfs/dbraw/zinc/94/86/82/1129948682.db2.gz VMEKAZCYLOAJGU-AWEZNQCLSA-N 1 0 271.335 3.521 20 10 CHCDRO C[C@@H]1C[C@H](c2ccc(F)cc2)C[N@@H+]1Cc1ccccc1O ZINC000770510855 1129949014 /nfs/dbraw/zinc/94/90/14/1129949014.db2.gz SIXBAWJQQHFQHH-CJNGLKHVSA-N 1 0 285.362 3.909 20 10 CHCDRO Oc1ccccc1C[N@@H+](Cc1ccc(F)cc1)CC1CC1 ZINC000770511080 1129949219 /nfs/dbraw/zinc/94/92/19/1129949219.db2.gz YYDXTIKEQRNUNY-UHFFFAOYSA-N 1 0 285.362 3.944 20 10 CHCDRO Cc1ccncc1[C@@H](C)[NH2+]Cc1cc(C)c(C)cc1O ZINC000770751419 1129958237 /nfs/dbraw/zinc/95/82/37/1129958237.db2.gz VRRAQEMHYWTGSW-CQSZACIVSA-N 1 0 270.376 3.563 20 10 CHCDRO CCC1(C)CC[NH+](Cc2cc(F)cc(C(C)=O)c2O)CC1 ZINC000062954933 1129958272 /nfs/dbraw/zinc/95/82/72/1129958272.db2.gz STXOKGIZPIUJMF-UHFFFAOYSA-N 1 0 293.382 3.746 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2sccc2Cl)c1 ZINC000801937541 1129961582 /nfs/dbraw/zinc/96/15/82/1129961582.db2.gz PLMIQQFRRACTRF-SECBINFHSA-N 1 0 297.807 3.967 20 10 CHCDRO CNc1ccc(C)cc1C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000902489670 1130017296 /nfs/dbraw/zinc/01/72/96/1130017296.db2.gz KGMAUODAISXJKS-OAHLLOKOSA-N 1 0 297.446 3.954 20 10 CHCDRO Cc1ccncc1[C@@H](C)[NH2+]Cc1ccc(N(C)C)cc1C ZINC000772454552 1130022277 /nfs/dbraw/zinc/02/22/77/1130022277.db2.gz IECSZGNXQLBBMD-OAHLLOKOSA-N 1 0 283.419 3.615 20 10 CHCDRO CC1C[NH+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000802651723 1130026864 /nfs/dbraw/zinc/02/68/64/1130026864.db2.gz ZAVYHCXQRXEJAT-UHFFFAOYSA-N 1 0 253.345 3.511 20 10 CHCDRO CCCC[N@H+](Cc1cccc(O)c1)Cc1ccccc1O ZINC000802657975 1130027989 /nfs/dbraw/zinc/02/79/89/1130027989.db2.gz XQJQZWIXZFMRLG-UHFFFAOYSA-N 1 0 285.387 3.900 20 10 CHCDRO CNc1ccc(C)cc1C[NH2+][C@@H](C)c1ccccc1O ZINC000902642831 1130032954 /nfs/dbraw/zinc/03/29/54/1130032954.db2.gz JBIHQBKXYUDGRF-ZDUSSCGKSA-N 1 0 270.376 3.593 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2nccc3c2CCCC3)c1 ZINC000903182397 1130124804 /nfs/dbraw/zinc/12/48/04/1130124804.db2.gz QAOFZRSKFHZSFA-CQSZACIVSA-N 1 0 296.414 3.825 20 10 CHCDRO C[C@@H]([NH2+]CC[C@@H]1CCC(C)(C)CO1)c1ccccc1O ZINC000903247357 1130136414 /nfs/dbraw/zinc/13/64/14/1130136414.db2.gz UZGCHJRLFYZVDR-KGLIPLIRSA-N 1 0 277.408 3.638 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCOC12CCCCC2)c1ccccc1O ZINC000903274198 1130142684 /nfs/dbraw/zinc/14/26/84/1130142684.db2.gz JPDFFQUFANDSPR-XJKSGUPXSA-N 1 0 275.392 3.535 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCSC(C)(C)C1)c1cc(F)ccc1O ZINC000903285193 1130147009 /nfs/dbraw/zinc/14/70/09/1130147009.db2.gz WPAGKTCEYAUSGS-ZYHUDNBSSA-N 1 0 283.412 3.856 20 10 CHCDRO C[C@H]([NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F)c1cncs1 ZINC000903310524 1130150597 /nfs/dbraw/zinc/15/05/97/1130150597.db2.gz KKQCHXIUBLRRBS-WCABBAIRSA-N 1 0 292.379 3.887 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CC[C@@H]2CCC(F)(F)C2)c1O ZINC000903340769 1130162699 /nfs/dbraw/zinc/16/26/99/1130162699.db2.gz JLAWSNONNMUOAK-NEPJUHHUSA-N 1 0 299.361 3.877 20 10 CHCDRO Cc1ncccc1CC[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000903416138 1130173620 /nfs/dbraw/zinc/17/36/20/1130173620.db2.gz QCRCPMLIUVMGJT-LBPRGKRZSA-N 1 0 290.794 3.642 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@@H](c1ccncc1)C1CC1)CC2 ZINC000903427468 1130176110 /nfs/dbraw/zinc/17/61/10/1130176110.db2.gz GMCJOCAICSEJEC-CRAIPNDOSA-N 1 0 280.371 3.515 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H](c2ccncc2)C2CC2)c(O)c1 ZINC000903430339 1130176919 /nfs/dbraw/zinc/17/69/19/1130176919.db2.gz YVRZPRCEBZMVLC-ACJLOTCBSA-N 1 0 282.387 3.898 20 10 CHCDRO CCC(O)(CC)CC[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000788264502 1130180233 /nfs/dbraw/zinc/18/02/33/1130180233.db2.gz XYVMVAGNGABYNH-WCQYABFASA-N 1 0 295.398 3.610 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CCc2ccccc2)c(O)c1 ZINC000788497132 1130190325 /nfs/dbraw/zinc/19/03/25/1130190325.db2.gz DUJDYVLMAWFTEC-OAHLLOKOSA-N 1 0 269.388 3.902 20 10 CHCDRO Cc1ccc([C@@H](O)C[NH2+][C@H](C)c2c(C)cc(C)cc2O)cc1 ZINC000788562949 1130194771 /nfs/dbraw/zinc/19/47/71/1130194771.db2.gz MJPILEKUWZENAW-QAPCUYQASA-N 1 0 299.414 3.702 20 10 CHCDRO CCN1CCCC[C@@H]1C[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000788595036 1130196673 /nfs/dbraw/zinc/19/66/73/1130196673.db2.gz ZBZCPNUBPRVJHI-JKSUJKDBSA-N 1 0 290.451 3.534 20 10 CHCDRO CCC1(O)CCC([NH2+][C@@H](C)c2c(C)cc(C)cc2O)CC1 ZINC000788646465 1130197827 /nfs/dbraw/zinc/19/78/27/1130197827.db2.gz CRWVJFSBRVNHTH-SYJJWHGVSA-N 1 0 291.435 3.743 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H]2CCCS2)c(O)c1 ZINC000788629595 1130199285 /nfs/dbraw/zinc/19/92/85/1130199285.db2.gz WMGJVYKXBXHWHL-OLZOCXBDSA-N 1 0 265.422 3.555 20 10 CHCDRO Cc1cccc([C@@H](O)C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)c1 ZINC000788669448 1130202180 /nfs/dbraw/zinc/20/21/80/1130202180.db2.gz OMKYUFHMYSRCJE-YJBOKZPZSA-N 1 0 299.414 3.702 20 10 CHCDRO CSC1(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)CCC1 ZINC000788796658 1130209234 /nfs/dbraw/zinc/20/92/34/1130209234.db2.gz SLGHOEULPMPQCT-ZDUSSCGKSA-N 1 0 279.449 3.945 20 10 CHCDRO Cc1cccc(C[NH2+][C@H](c2ccccc2)C(C)(C)CO)c1O ZINC000788830618 1130213038 /nfs/dbraw/zinc/21/30/38/1130213038.db2.gz CJCKWMKGMHJGHB-GOSISDBHSA-N 1 0 299.414 3.550 20 10 CHCDRO COc1c2ccccc2oc1C[NH2+]Cc1cc(C)ccc1O ZINC000788970481 1130221478 /nfs/dbraw/zinc/22/14/78/1130221478.db2.gz UDSMYZOUCYFPFS-UHFFFAOYSA-N 1 0 297.354 3.745 20 10 CHCDRO CC[N@H+](CCC(F)(F)F)Cc1c(O)ccc2ccncc21 ZINC000748294620 1130227976 /nfs/dbraw/zinc/22/79/76/1130227976.db2.gz AHIIZAQISMGCGL-UHFFFAOYSA-N 1 0 298.308 3.715 20 10 CHCDRO CC[N@H+](CCC(F)(F)F)Cc1cc2c(cc1O)CCC2 ZINC000748294612 1130228321 /nfs/dbraw/zinc/22/83/21/1130228321.db2.gz ACVIBYPVKMLRQQ-UHFFFAOYSA-N 1 0 287.325 3.655 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)C[C@@H]2CC[C@@H](C)O2)cc1 ZINC000789307256 1130242540 /nfs/dbraw/zinc/24/25/40/1130242540.db2.gz VGIIASMZLPQVJC-QAPCUYQASA-N 1 0 290.451 3.532 20 10 CHCDRO C[C@H]1CC[C@H](C[N@H+](Cc2ccccc2O)C2CCCC2)O1 ZINC000789327837 1130244023 /nfs/dbraw/zinc/24/40/23/1130244023.db2.gz XAQJEBUMEVYVEH-WMLDXEAASA-N 1 0 289.419 3.704 20 10 CHCDRO CCc1ccc([C@@H](O)C[NH2+][C@H](CC)c2ccccc2O)cc1 ZINC000789363046 1130246826 /nfs/dbraw/zinc/24/68/26/1130246826.db2.gz RJXLQQOVVBVARS-MJGOQNOKSA-N 1 0 299.414 3.729 20 10 CHCDRO CC[N@H+](Cc1[nH]c(C)cc1C)Cc1ccc(N(C)C)cc1 ZINC001137332019 1130399580 /nfs/dbraw/zinc/39/95/80/1130399580.db2.gz CTTSHEQGNKMLIF-UHFFFAOYSA-N 1 0 285.435 3.720 20 10 CHCDRO Oc1cccc2c1C[N@H+](Cc1c[nH]c3ccc(F)cc13)CC2 ZINC001137341250 1130430688 /nfs/dbraw/zinc/43/06/88/1130430688.db2.gz FBVJGKDFVZEKJL-UHFFFAOYSA-N 1 0 296.345 3.571 20 10 CHCDRO CC[C@H]1C[C@@H]([NH2+]Cc2cc3ccccc3cc2O)CCO1 ZINC001170183407 1130454507 /nfs/dbraw/zinc/45/45/07/1130454507.db2.gz RPTFBACVKUCCBC-IRXDYDNUSA-N 1 0 285.387 3.593 20 10 CHCDRO CC(C)(C)OCCC[NH2+]Cc1ccc2ccccc2c1O ZINC000827173597 1130466886 /nfs/dbraw/zinc/46/68/86/1130466886.db2.gz YJKGESFZYHAMTG-UHFFFAOYSA-N 1 0 287.403 3.840 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)cc1C(F)(F)F)C1CC1 ZINC000792788794 1130497093 /nfs/dbraw/zinc/49/70/93/1130497093.db2.gz DMZRQBPOIUCNFH-UHFFFAOYSA-N 1 0 286.341 3.756 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)C2CCC2)c(C(F)(F)F)c1 ZINC000792826236 1130500348 /nfs/dbraw/zinc/50/03/48/1130500348.db2.gz FNHSHFIEJRZULO-UHFFFAOYSA-N 1 0 286.341 3.756 20 10 CHCDRO CCC[C@@H]([NH2+]Cc1cccc(C)c1O)[C@H](O)c1ccccc1 ZINC000793237937 1130533066 /nfs/dbraw/zinc/53/30/66/1130533066.db2.gz HFIGVNGLPBENJM-IEBWSBKVSA-N 1 0 299.414 3.693 20 10 CHCDRO CCOCc1cc(C[NH2+]C[C@@H]2CC[C@@H](C)C2)ccc1OC ZINC000793346147 1130548483 /nfs/dbraw/zinc/54/84/83/1130548483.db2.gz DBGLREMFBFABSP-HUUCEWRRSA-N 1 0 291.435 3.758 20 10 CHCDRO Oc1ccccc1C[NH2+][C@@H]1CC[C@H](c2cccc(F)c2)C1 ZINC000793351995 1130549802 /nfs/dbraw/zinc/54/98/02/1130549802.db2.gz LMHUPOMPUJOJNL-WMLDXEAASA-N 1 0 285.362 3.957 20 10 CHCDRO COc1ccc(C[NH2+]Cc2cc(C)c(C)cc2C)c(O)c1 ZINC000793386009 1130551861 /nfs/dbraw/zinc/55/18/61/1130551861.db2.gz GESOAICPYBAJTO-UHFFFAOYSA-N 1 0 285.387 3.616 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)CCc2ccc(C)cc2)c(O)c1 ZINC000793388088 1130552505 /nfs/dbraw/zinc/55/25/05/1130552505.db2.gz LQBILPNJINEMOU-OAHLLOKOSA-N 1 0 299.414 3.820 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CC3(CCC3)[C@@H]2C2CC2)c1 ZINC000811513730 1130620297 /nfs/dbraw/zinc/62/02/97/1130620297.db2.gz NTTOTBHTSHPNQT-KRWDZBQOSA-N 1 0 287.403 3.555 20 10 CHCDRO CC(C)[N@H+](Cc1c(O)ccc2ccccc21)[C@@H]1CCOC1 ZINC000812291304 1130681577 /nfs/dbraw/zinc/68/15/77/1130681577.db2.gz MOYBBXMMUTXBAD-OAHLLOKOSA-N 1 0 285.387 3.545 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C(C)(C)CC(F)(F)F)c1 ZINC000780587098 1130683453 /nfs/dbraw/zinc/68/34/53/1130683453.db2.gz JASVUGOEIUMHSS-UHFFFAOYSA-N 1 0 261.287 3.521 20 10 CHCDRO CCc1cccnc1[C@@H](C)[NH2+]Cc1ccc(N(C)C)cc1C ZINC000780724440 1130689104 /nfs/dbraw/zinc/68/91/04/1130689104.db2.gz KVVWVVRXJZFOGI-OAHLLOKOSA-N 1 0 297.446 3.869 20 10 CHCDRO C[C@H]1C[N@H+](Cc2cccc(-c3ccccc3)c2O)CCCO1 ZINC001234993238 1130699625 /nfs/dbraw/zinc/69/96/25/1130699625.db2.gz XKTWVQJBDSHRLM-HNNXBMFYSA-N 1 0 297.398 3.670 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2cccc(-c3ccccc3)c2O)CCCO1 ZINC001234993240 1130699871 /nfs/dbraw/zinc/69/98/71/1130699871.db2.gz XKTWVQJBDSHRLM-OAHLLOKOSA-N 1 0 297.398 3.670 20 10 CHCDRO C[N@H+](Cc1ccno1)Cc1cccc(-c2ccccc2)c1O ZINC001234996356 1130701176 /nfs/dbraw/zinc/70/11/76/1130701176.db2.gz BOHMGKYUCXGRHK-UHFFFAOYSA-N 1 0 294.354 3.679 20 10 CHCDRO CC1(C)C[N@H+](Cc2cccc(-c3ccccc3)c2O)CCO1 ZINC001234993181 1130701338 /nfs/dbraw/zinc/70/13/38/1130701338.db2.gz VMOTWGQNDVRQCW-UHFFFAOYSA-N 1 0 297.398 3.670 20 10 CHCDRO CC[C@@H]1COCC[N@@H+]1Cc1cccc(-c2ccccc2)c1O ZINC001234996722 1130701460 /nfs/dbraw/zinc/70/14/60/1130701460.db2.gz NARDFSKNWUNQKN-QGZVFWFLSA-N 1 0 297.398 3.670 20 10 CHCDRO Cc1cc(CC[NH2+]Cc2ccccc2O)ccc1Cl ZINC000812772956 1130713302 /nfs/dbraw/zinc/71/33/02/1130713302.db2.gz NTCPQBOSJISNEW-UHFFFAOYSA-N 1 0 275.779 3.686 20 10 CHCDRO C[C@H]1CC[C@]2(CC[N@H+](Cc3cc(F)ccc3O)C2)C1 ZINC000781927305 1130748287 /nfs/dbraw/zinc/74/82/87/1130748287.db2.gz DJJVUXIMGUEQBO-LRDDRELGSA-N 1 0 263.356 3.543 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2CCc3cccc(O)c3C2)c1 ZINC001235536116 1130754188 /nfs/dbraw/zinc/75/41/88/1130754188.db2.gz ACWWYUOZROGTFN-UHFFFAOYSA-N 1 0 287.790 3.912 20 10 CHCDRO Nc1ccc(C[N@@H+]2CCC[C@H](Cc3ccccc3)C2)cc1 ZINC001235672751 1130763910 /nfs/dbraw/zinc/76/39/10/1130763910.db2.gz GJABMJWCTLDQPK-GOSISDBHSA-N 1 0 280.415 3.724 20 10 CHCDRO CC(C)[C@@H]1C[N@H+](Cc2ccc(C(C)(C)C)cc2O)CCO1 ZINC001235677075 1130766100 /nfs/dbraw/zinc/76/61/00/1130766100.db2.gz ANYDCACSDKUDMA-KRWDZBQOSA-N 1 0 291.435 3.547 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2c(O)ccc3ccncc32)[C@H]2CCCC[C@@H]12 ZINC000782274316 1130767538 /nfs/dbraw/zinc/76/75/38/1130767538.db2.gz AMVMHJPMYYANNE-XUWXXGDYSA-N 1 0 296.414 3.951 20 10 CHCDRO CC(C)(C)c1ccc(C[N@@H+]2C[C@@H]3C[C@H]2C[C@@H]3F)c(O)c1 ZINC001235679598 1130767757 /nfs/dbraw/zinc/76/77/57/1130767757.db2.gz PZKZJSVUPVPGSW-QEJZJMRPSA-N 1 0 277.383 3.622 20 10 CHCDRO C[C@@]1(c2ccccc2)CC[C@H]([NH2+]Cc2ccccc2O)C1 ZINC000783236282 1130804978 /nfs/dbraw/zinc/80/49/78/1130804978.db2.gz FYLKHCFIFNGZFE-PKOBYXMFSA-N 1 0 281.399 3.992 20 10 CHCDRO C[C@]1(c2ccccc2)CC[C@H]([NH2+]Cc2ccccc2O)C1 ZINC000783236279 1130805337 /nfs/dbraw/zinc/80/53/37/1130805337.db2.gz FYLKHCFIFNGZFE-HKUYNNGSSA-N 1 0 281.399 3.992 20 10 CHCDRO Nc1ccc(C[N@@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)cc1 ZINC001235948949 1130815530 /nfs/dbraw/zinc/81/55/30/1130815530.db2.gz XWRLXDGPLBQLNZ-OAHLLOKOSA-N 1 0 286.806 3.912 20 10 CHCDRO CC[C@@H]([NH2+]CC1(N(C)C)CCC1)c1cc(Cl)ccc1O ZINC000783314007 1130817030 /nfs/dbraw/zinc/81/70/30/1130817030.db2.gz JFOZYXHYDOOEPG-CQSZACIVSA-N 1 0 296.842 3.571 20 10 CHCDRO CCN(CCC[NH2+][C@@H](C)c1ccccc1O)c1ccccc1 ZINC000783496190 1130830076 /nfs/dbraw/zinc/83/00/76/1130830076.db2.gz YOIQTKUOCOPHCJ-INIZCTEOSA-N 1 0 298.430 3.959 20 10 CHCDRO CCC(=O)Nc1cccc(C[NH2+][C@H](C)c2ccccc2O)c1 ZINC000783504784 1130830996 /nfs/dbraw/zinc/83/09/96/1130830996.db2.gz MRFHXSHLGCBRRH-CYBMUJFWSA-N 1 0 298.386 3.592 20 10 CHCDRO Cc1ccc(CC[C@H](C)[NH2+][C@H](C)c2ccccc2O)o1 ZINC000783516053 1130832356 /nfs/dbraw/zinc/83/23/56/1130832356.db2.gz DHMWUFMIEKZNIB-GXTWGEPZSA-N 1 0 273.376 3.966 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CSc2ccccc21)c1ccccc1O ZINC000783513750 1130832456 /nfs/dbraw/zinc/83/24/56/1130832456.db2.gz MNPIGHDDIWBXAY-RISCZKNCSA-N 1 0 271.385 3.890 20 10 CHCDRO COc1ccc(O)c(C[N@H+](C)Cc2cccc(C)c2C)c1 ZINC000814170023 1130838521 /nfs/dbraw/zinc/83/85/21/1130838521.db2.gz QFLOIKJGTJMLGD-UHFFFAOYSA-N 1 0 285.387 3.650 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CC3(CCC3)[C@@H]2C(C)C)c1O ZINC000814170666 1130838898 /nfs/dbraw/zinc/83/88/98/1130838898.db2.gz BPJHJTDRJQFSIE-KRWDZBQOSA-N 1 0 289.419 3.801 20 10 CHCDRO CC(C)[C@H]1[N@H+](Cc2cc(F)ccc2O)CC12CCC2 ZINC000814171905 1130838970 /nfs/dbraw/zinc/83/89/70/1130838970.db2.gz YSTAGRMHAZLSCC-OAHLLOKOSA-N 1 0 263.356 3.542 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2C[C@H](C)[C@H]3CCCC[C@H]32)c1 ZINC000783592785 1130842592 /nfs/dbraw/zinc/84/25/92/1130842592.db2.gz KLDRFSWRTMLTFV-IAOVAPTHSA-N 1 0 289.419 3.801 20 10 CHCDRO Cc1cccc(C[N@@H+](C)CC2(c3ccccc3)CC2)c1O ZINC000783701631 1130850335 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Cc1cc(C)c([C@H](C)[NH2+]C[C@@H]2COc3ccccc32)c(O)c1 ZINC000815626729 1131011729 /nfs/dbraw/zinc/01/17/29/1131011729.db2.gz KQPQXRXGVCQNCC-LSDHHAIUSA-N 1 0 297.398 3.836 20 10 CHCDRO CC[C@H]1CCC[N@H+](Cc2c(O)cc(OC)cc2Cl)C1 ZINC001236801123 1131012112 /nfs/dbraw/zinc/01/21/12/1131012112.db2.gz DDZIJPNIZQHODW-NSHDSACASA-N 1 0 283.799 3.676 20 10 CHCDRO COc1cc(C)c(C[N@@H+]2CCC[C@@H]3CCCC[C@@H]32)c(O)c1 ZINC001236811648 1131012478 /nfs/dbraw/zinc/01/24/78/1131012478.db2.gz UQHPHSDXTQZLPG-YOEHRIQHSA-N 1 0 289.419 3.864 20 10 CHCDRO COc1cc(C)c(C[N@H+](C)Cc2ccc(C)c(C)c2)c(O)c1 ZINC001236821563 1131014135 /nfs/dbraw/zinc/01/41/35/1131014135.db2.gz QXKVKEWFHPADEU-UHFFFAOYSA-N 1 0 299.414 3.958 20 10 CHCDRO COc1cc(C)c(C[N@@H+]2CCc3ccccc3[C@H]2C)c(O)c1 ZINC001236817072 1131014732 /nfs/dbraw/zinc/01/47/32/1131014732.db2.gz CLZRXALIDRTKMO-CQSZACIVSA-N 1 0 297.398 3.829 20 10 CHCDRO CC[C@@H]([NH2+]CCC1(OC)CCC1)c1ccc(C)cc1O ZINC000815641903 1131015116 /nfs/dbraw/zinc/01/51/16/1131015116.db2.gz LLVUVAABNRDZGL-OAHLLOKOSA-N 1 0 277.408 3.701 20 10 CHCDRO CC[C@@H]([NH2+]CC[C@H](C)F)c1ccc(N(C)C)cc1 ZINC000815645535 1131015583 /nfs/dbraw/zinc/01/55/83/1131015583.db2.gz IXAPVWXQNNAZHT-SWLSCSKDSA-N 1 0 252.377 3.541 20 10 CHCDRO Oc1cc2ccccc2cc1C[NH+]1C[C@@H]2CCC[C@H]2C1 ZINC001236827118 1131015832 /nfs/dbraw/zinc/01/58/32/1131015832.db2.gz PLIRYYQXEYIKSC-HOTGVXAUSA-N 1 0 267.372 3.777 20 10 CHCDRO CC(C)C1([NH2+][C@H](C)c2ccc(Br)cc2O)CC1 ZINC000815647791 1131017083 /nfs/dbraw/zinc/01/70/83/1131017083.db2.gz VCJBLASTDCFKON-SNVBAGLBSA-N 1 0 298.224 3.994 20 10 CHCDRO Oc1cc2ccccc2cc1CN1CCC(F)(F)[C@@H](F)C1 ZINC001236827525 1131017444 /nfs/dbraw/zinc/01/74/44/1131017444.db2.gz UORYYDYKUOXCFQ-HNNXBMFYSA-N 1 0 295.304 3.725 20 10 CHCDRO Oc1cc2ccccc2cc1C[N@@H+]1CCC[C@@H]2C[C@@H]21 ZINC001236838131 1131017816 /nfs/dbraw/zinc/01/78/16/1131017816.db2.gz VJHNYIAOLWPGKX-ZBFHGGJFSA-N 1 0 253.345 3.530 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2cc3ccccc3cc2O)C2(CC2)C1 ZINC001236836261 1131018159 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CC(C)c1ccc(C[N@@H+]2CCOc3ccccc3C2)c(O)c1 ZINC001237053928 1131043521 /nfs/dbraw/zinc/04/35/21/1131043521.db2.gz RKFBKFBXEGWETC-UHFFFAOYSA-N 1 0 297.398 3.910 20 10 CHCDRO Oc1cccc(OC(F)(F)F)c1C[NH+]1CCCCCC1 ZINC001237120134 1131052755 /nfs/dbraw/zinc/05/27/55/1131052755.db2.gz MWXYKYFCLWPLHE-UHFFFAOYSA-N 1 0 289.297 3.667 20 10 CHCDRO CC1(C)CC[N@H+](Cc2cc(C(F)(F)F)ccc2O)C1 ZINC001237138870 1131058874 /nfs/dbraw/zinc/05/88/74/1131058874.db2.gz HXVMKHDEEUUZOL-UHFFFAOYSA-N 1 0 273.298 3.643 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCCc2cccnc21 ZINC000798928661 1131061894 /nfs/dbraw/zinc/06/18/94/1131061894.db2.gz CHTOUXGQOSKQCR-GOSISDBHSA-N 1 0 295.430 3.623 20 10 CHCDRO Cc1c(C[N@@H+]2CCc3cccc(O)c3C2)ccc(F)c1F ZINC001237167909 1131065238 /nfs/dbraw/zinc/06/52/38/1131065238.db2.gz TYBBDFSDVPPQBR-UHFFFAOYSA-N 1 0 289.325 3.537 20 10 CHCDRO [O-]c1cc(F)c(Cl)cc1C[N@@H+]1CCc2ccsc2C1 ZINC000816512538 1131103346 /nfs/dbraw/zinc/10/33/46/1131103346.db2.gz MBURVKFOSSCANY-UHFFFAOYSA-N 1 0 297.782 3.805 20 10 CHCDRO Cc1cccc(C[N@@H+](C)Cc2c(C)cccc2O)c1 ZINC001237482407 1131103969 /nfs/dbraw/zinc/10/39/69/1131103969.db2.gz LBPLTAHFWLPCMZ-UHFFFAOYSA-N 1 0 255.361 3.641 20 10 CHCDRO CCCCOCCC[NH2+]Cc1ccc2ccccc2c1O ZINC000816529771 1131104244 /nfs/dbraw/zinc/10/42/44/1131104244.db2.gz HDDCJNLWVBUFAS-UHFFFAOYSA-N 1 0 287.403 3.842 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+]1CCCC2(CCCC2)C1 ZINC001237485349 1131104260 /nfs/dbraw/zinc/10/42/60/1131104260.db2.gz ORZUAYHBECEYGV-UHFFFAOYSA-N 1 0 259.393 3.857 20 10 CHCDRO CC[N@H+](Cc1ccccc1)Cc1c(C)cccc1O ZINC001237483752 1131104663 /nfs/dbraw/zinc/10/46/63/1131104663.db2.gz SQFVDAPLGOYWQO-UHFFFAOYSA-N 1 0 255.361 3.723 20 10 CHCDRO C[C@@H]1CCCCN1CC[NH2+]Cc1ccc2ccccc2c1O ZINC000816535763 1131105251 /nfs/dbraw/zinc/10/52/51/1131105251.db2.gz YXIKRHUTGIQAMH-OAHLLOKOSA-N 1 0 298.430 3.509 20 10 CHCDRO C[C@H]([NH2+]CCc1ccc2[nH]ccc2c1)c1cc(F)ccc1O ZINC000799727864 1131105718 /nfs/dbraw/zinc/10/57/18/1131105718.db2.gz ARDNVVOCADGHHM-LBPRGKRZSA-N 1 0 298.361 3.906 20 10 CHCDRO C[N@@H+](Cc1ccc2ccccc2c1O)C[C@@H]1CCCC[C@@H]1O ZINC000816564945 1131111759 /nfs/dbraw/zinc/11/17/59/1131111759.db2.gz WCUYSYDAZVUTQY-YJBOKZPZSA-N 1 0 299.414 3.528 20 10 CHCDRO C[C@H]1CC[N@H+](Cc2ccc3ccccc3c2O)C[C@@H]1F ZINC000816565052 1131111861 /nfs/dbraw/zinc/11/18/61/1131111861.db2.gz ZQNRBKWTCXKFAG-LRDDRELGSA-N 1 0 273.351 3.725 20 10 CHCDRO COCCC(C)(C)C[NH2+]Cc1ccc2ccccc2c1O ZINC000816569237 1131112857 /nfs/dbraw/zinc/11/28/57/1131112857.db2.gz DDUHVHPSJGMFOR-UHFFFAOYSA-N 1 0 287.403 3.698 20 10 CHCDRO Oc1c(C[NH2+]C[C@H]2CCCSC2)ccc2ccccc21 ZINC000816612713 1131115981 /nfs/dbraw/zinc/11/59/81/1131115981.db2.gz WWNQUHBTGONHRO-CYBMUJFWSA-N 1 0 287.428 3.778 20 10 CHCDRO CCC[C@@]1(CO)CC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816613159 1131116014 /nfs/dbraw/zinc/11/60/14/1131116014.db2.gz LAJRTPFIPCDPLG-LJQANCHMSA-N 1 0 299.414 3.530 20 10 CHCDRO COc1cccc(O)c1C[N@@H+]1CCC[C@H](c2ccccc2)C1 ZINC000816619752 1131117234 /nfs/dbraw/zinc/11/72/34/1131117234.db2.gz UCOAHAHZVVMXOG-INIZCTEOSA-N 1 0 297.398 3.780 20 10 CHCDRO Cc1cc(Cl)cc(CN2CCC(F)(F)[C@H](F)C2)c1O ZINC001237680598 1131127086 /nfs/dbraw/zinc/12/70/86/1131127086.db2.gz DRYGFFNTUWAKPU-LLVKDONJSA-N 1 0 293.716 3.533 20 10 CHCDRO C[N@H+](Cc1ccccc1)Cc1cc(F)cc(Cl)c1[O-] ZINC001237810540 1131142608 /nfs/dbraw/zinc/14/26/08/1131142608.db2.gz QGAJYVCNMBLDEW-UHFFFAOYSA-N 1 0 279.742 3.817 20 10 CHCDRO CC[N@H+](Cc1ccc(N2CCCC2)cc1)Cc1ccccn1 ZINC001116443918 1131146369 /nfs/dbraw/zinc/14/63/69/1131146369.db2.gz LKPHUQPYTPWIMT-UHFFFAOYSA-N 1 0 295.430 3.704 20 10 CHCDRO C[C@@H]1CCC[N@H+](Cc2ccc(N3CCCC3)cc2)[C@H]1C ZINC001116444437 1131146676 /nfs/dbraw/zinc/14/66/76/1131146676.db2.gz SVPKESUXFGXILR-CVEARBPZSA-N 1 0 272.436 3.907 20 10 CHCDRO CCCC[N@H+](CCC)Cc1cc(F)cc(C)c1O ZINC001238060090 1131166298 /nfs/dbraw/zinc/16/62/98/1131166298.db2.gz HFBYZVFWKIGACF-UHFFFAOYSA-N 1 0 253.361 3.852 20 10 CHCDRO Cc1cc(F)cc(C[NH+]2CCCCCCC2)c1O ZINC001238063558 1131166915 /nfs/dbraw/zinc/16/69/15/1131166915.db2.gz YPCXCEQDDLKKDE-UHFFFAOYSA-N 1 0 251.345 3.606 20 10 CHCDRO Cc1cc(F)cc(C[N@@H+]2CCC3(CCCC3)C2)c1O ZINC001238063503 1131167222 /nfs/dbraw/zinc/16/72/22/1131167222.db2.gz XMGUCHBHSJMHQK-UHFFFAOYSA-N 1 0 263.356 3.606 20 10 CHCDRO CC[N@H+](Cc1ccncc1)Cc1ccc(N2CCCC2)cc1 ZINC001117583789 1131190003 /nfs/dbraw/zinc/19/00/03/1131190003.db2.gz XIQKRXXTAHCRDO-UHFFFAOYSA-N 1 0 295.430 3.704 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CCc2ccc(N)cc2)cc1 ZINC000817955784 1131190311 /nfs/dbraw/zinc/19/03/11/1131190311.db2.gz HRYPYECXTMMZBX-HNNXBMFYSA-N 1 0 297.446 3.618 20 10 CHCDRO CC[C@@H](CSC)[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001117638236 1131190435 /nfs/dbraw/zinc/19/04/35/1131190435.db2.gz NXGWASHUTAHUMI-INIZCTEOSA-N 1 0 292.492 3.860 20 10 CHCDRO Nc1ccc(CC[NH2+][C@@H](CC2CC2)c2ccccc2)cc1 ZINC000817955419 1131190502 /nfs/dbraw/zinc/19/05/02/1131190502.db2.gz AIGIELAUZKPATQ-IBGZPJMESA-N 1 0 280.415 3.942 20 10 CHCDRO Cc1cccc([C@H](C)[NH2+]CCc2ccc(N)cc2)c1C ZINC000817955811 1131190701 /nfs/dbraw/zinc/19/07/01/1131190701.db2.gz IGIVUYWXZGIJQZ-HNNXBMFYSA-N 1 0 268.404 3.779 20 10 CHCDRO C[C@H]([NH2+]CCc1ccc(N)cc1)[C@@H]1C[C@H]1c1ccccc1 ZINC000817958195 1131191000 /nfs/dbraw/zinc/19/10/00/1131191000.db2.gz SWGXRLVLQABUSL-JVPBZIDWSA-N 1 0 280.415 3.593 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccc(N)cc1)c1cccc(C)c1 ZINC000817958159 1131191023 /nfs/dbraw/zinc/19/10/23/1131191023.db2.gz SMENKRRRBLNPJA-SFHVURJKSA-N 1 0 268.404 3.861 20 10 CHCDRO CC(C)[C@@H]1CCC[C@@H]([NH2+]CCc2ccc(N)cc2)C1 ZINC000817957735 1131191519 /nfs/dbraw/zinc/19/15/19/1131191519.db2.gz OUVSABQXWQGLSA-NVXWUHKLSA-N 1 0 260.425 3.616 20 10 CHCDRO CCOc1ccc([C@H](C)[NH2+]CCc2ccc(N)cc2)cc1 ZINC000817956410 1131191658 /nfs/dbraw/zinc/19/16/58/1131191658.db2.gz YKEOXTMLYPMFSQ-AWEZNQCLSA-N 1 0 284.403 3.561 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2)c1ccccc1O ZINC000817977404 1131195590 /nfs/dbraw/zinc/19/55/90/1131195590.db2.gz JOWCZXDLNXFJMW-QGZVFWFLSA-N 1 0 296.414 3.991 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCC(C)(C)C1)c1cc(F)ccc1O ZINC000168862087 1131204467 /nfs/dbraw/zinc/20/44/67/1131204467.db2.gz QICPOAXNPOPSIX-PWSUYJOCSA-N 1 0 251.345 3.761 20 10 CHCDRO CCOCc1cc(C[NH2+][C@@H]2C[C@H]2C2CCC2)ccc1OC ZINC000818229999 1131205860 /nfs/dbraw/zinc/20/58/60/1131205860.db2.gz LRMUDFBHRVJVHK-DLBZAZTESA-N 1 0 289.419 3.510 20 10 CHCDRO Cc1cc(N)cc(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)c1 ZINC001118058852 1131208345 /nfs/dbraw/zinc/20/83/45/1131208345.db2.gz ICWBLGQDKJRKQT-BBRMVZONSA-N 1 0 296.414 3.929 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1C[C@H]2C[C@H]2C1)c1cc(Br)ccc1O ZINC000818358117 1131211957 /nfs/dbraw/zinc/21/19/57/1131211957.db2.gz CXSGYCGPVYASIQ-MWGHHZFTSA-N 1 0 296.208 3.604 20 10 CHCDRO Cc1cc(C[N@@H+]2CC[C@H](F)C2)c(C)n1-c1ccccc1 ZINC001137854024 1131424249 /nfs/dbraw/zinc/42/42/49/1131424249.db2.gz FMWFZYSEOWQUIS-INIZCTEOSA-N 1 0 272.367 3.638 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)Cc2ccco2)cc1Cl ZINC000824522479 1131472345 /nfs/dbraw/zinc/47/23/45/1131472345.db2.gz PDGCXFFINNDBAJ-UHFFFAOYSA-N 1 0 265.740 3.579 20 10 CHCDRO Cc1cc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCO3)ccc1F ZINC000824549076 1131473151 /nfs/dbraw/zinc/47/31/51/1131473151.db2.gz XYGRZNKEIWZSQM-CYBMUJFWSA-N 1 0 285.362 3.920 20 10 CHCDRO COc1ccc(O)c(C[NH2+]CC[C@H]2CCc3ccccc32)c1 ZINC000824548725 1131473612 /nfs/dbraw/zinc/47/36/12/1131473612.db2.gz NGXOMCCENYPESE-OAHLLOKOSA-N 1 0 297.398 3.611 20 10 CHCDRO Oc1ccccc1C[NH2+]CC[C@H]1CCc2ccccc21 ZINC000824548436 1131475636 /nfs/dbraw/zinc/47/56/36/1131475636.db2.gz HOUXRVLLWJNSMK-OAHLLOKOSA-N 1 0 267.372 3.602 20 10 CHCDRO COc1cccc(C[NH2+][C@H](C)c2ccc(F)c(C)c2)c1O ZINC000824548151 1131476729 /nfs/dbraw/zinc/47/67/29/1131476729.db2.gz APXQOILULWJMIN-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(OCc2ccccc2)cc1O)C1CC1 ZINC000824690637 1131480160 /nfs/dbraw/zinc/48/01/60/1131480160.db2.gz JUORPTDCPKGAMQ-AWEZNQCLSA-N 1 0 297.398 3.859 20 10 CHCDRO Cc1c(C[N@H+]2CCC[C@H](C)C2)c2ccccc2n1C ZINC001138252810 1131482095 /nfs/dbraw/zinc/48/20/95/1131482095.db2.gz VNFHDLBFSCUXGV-ZDUSSCGKSA-N 1 0 256.393 3.719 20 10 CHCDRO CC[C@H]1CCC[N@@H+]1Cc1c2ccccc2n(C)c1C ZINC001138257123 1131483251 /nfs/dbraw/zinc/48/32/51/1131483251.db2.gz XGUFHVQKCSSTDU-AWEZNQCLSA-N 1 0 256.393 3.861 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@H]2CCO[C@@H](C(C)C)C2)cc1C ZINC000824798573 1131484617 /nfs/dbraw/zinc/48/46/17/1131484617.db2.gz FAFANMKPFAQOBU-MAUKXSAKSA-N 1 0 291.435 3.550 20 10 CHCDRO CN1CCCc2cc(C[N@@H+]3CCC[C@@H]4CCC[C@@H]43)ccc21 ZINC001138355736 1131493965 /nfs/dbraw/zinc/49/39/65/1131493965.db2.gz BDCPTXRWNAKFBF-LPHOPBHVSA-N 1 0 284.447 3.834 20 10 CHCDRO CCCC[N@H+](C)Cc1ccc(N(CC)CC)cc1OC ZINC001138388008 1131496967 /nfs/dbraw/zinc/49/69/67/1131496967.db2.gz ONJISLWBSXACCD-UHFFFAOYSA-N 1 0 278.440 3.773 20 10 CHCDRO CCN(CC)c1ccc(C[NH+]2CCC(C)CC2)c(OC)c1 ZINC001138387525 1131497576 /nfs/dbraw/zinc/49/75/76/1131497576.db2.gz GHVFVHKNAGEVEV-UHFFFAOYSA-N 1 0 290.451 3.773 20 10 CHCDRO COc1cccc([C@H]2C[C@H]([NH2+]Cc3cc(C)ccc3O)C2)c1 ZINC000825091180 1131499038 /nfs/dbraw/zinc/49/90/38/1131499038.db2.gz VRRYMWAFOQUNST-JCNLHEQBSA-N 1 0 297.398 3.745 20 10 CHCDRO CC1(C)CCCN1CC[NH2+]Cc1ccc2ccccc2c1O ZINC000825332289 1131507530 /nfs/dbraw/zinc/50/75/30/1131507530.db2.gz VEQKXKVGUJOYHZ-UHFFFAOYSA-N 1 0 298.430 3.509 20 10 CHCDRO Cc1cnc([C@@H](C)[NH2+]Cc2cc(Cl)c(C)cc2O)s1 ZINC000825330860 1131507863 /nfs/dbraw/zinc/50/78/63/1131507863.db2.gz FGIVQEMESPLKNY-SNVBAGLBSA-N 1 0 296.823 3.970 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H]2CCC(F)(F)C2)cc1Cl ZINC000825357474 1131508264 /nfs/dbraw/zinc/50/82/64/1131508264.db2.gz FXBKMSMAOVSUOZ-JTQLQIEISA-N 1 0 275.726 3.631 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](C)[C@@H](C)c2ccncc2)cc1Cl ZINC000825501307 1131513473 /nfs/dbraw/zinc/51/34/73/1131513473.db2.gz ODNGLMJKRRLTDD-LBPRGKRZSA-N 1 0 290.794 3.942 20 10 CHCDRO Cc1cc(C[N@@H+]2CCC[C@@H]3CCC[C@@H]32)ccc1N(C)C ZINC001139672719 1131627079 /nfs/dbraw/zinc/62/70/79/1131627079.db2.gz CUAYIKDNPQKSMK-WMZOPIPTSA-N 1 0 272.436 3.826 20 10 CHCDRO CCCOc1ccc(C[NH2+][C@H](C)Cc2ccccn2)cc1C ZINC001202970429 1131636609 /nfs/dbraw/zinc/63/66/09/1131636609.db2.gz JTNGRSNUTNMHMR-MRXNPFEDSA-N 1 0 298.430 3.900 20 10 CHCDRO Oc1cccc2c1C[N@H+](Cc1ccccc1C1CC1)CC2 ZINC001139883089 1131645580 /nfs/dbraw/zinc/64/55/80/1131645580.db2.gz AUOUAGWWFRWBFZ-UHFFFAOYSA-N 1 0 279.383 3.828 20 10 CHCDRO CC(C)CC[NH+](CCC(C)C)Cc1c(O)cc(O)cc1O ZINC001144516461 1131651107 /nfs/dbraw/zinc/65/11/07/1131651107.db2.gz YVKYLFSTBRWQPB-UHFFFAOYSA-N 1 0 295.423 3.698 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)Cc2cc3cnccc3o2)cc1 ZINC000845903869 1131669116 /nfs/dbraw/zinc/66/91/16/1131669116.db2.gz URSDIXFPZWWBGR-UHFFFAOYSA-N 1 0 295.386 3.526 20 10 CHCDRO Cc1ccc(C)c(C[N@H+](C)CCc2ccccc2)c1O ZINC001140181514 1131672986 /nfs/dbraw/zinc/67/29/86/1131672986.db2.gz VSTGQEJSDNBBOT-UHFFFAOYSA-N 1 0 269.388 3.684 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCc3sccc3C2)c1O ZINC001140180936 1131673314 /nfs/dbraw/zinc/67/33/14/1131673314.db2.gz NVQWLSXXDLHEFF-UHFFFAOYSA-N 1 0 273.401 3.629 20 10 CHCDRO COC[C@H](CC(C)(C)C)[NH2+][C@@H](C)c1cc(OC)ccc1O ZINC000845970843 1131674164 /nfs/dbraw/zinc/67/41/64/1131674164.db2.gz DBEZWYLXMNTUDI-STQMWFEESA-N 1 0 295.423 3.503 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(OC)ccc1F)c1ccccc1O ZINC000845991234 1131675744 /nfs/dbraw/zinc/67/57/44/1131675744.db2.gz AICFWIOALZQCLD-INIZCTEOSA-N 1 0 289.350 3.781 20 10 CHCDRO COc1cccc(C[NH2+]C2(c3ccccc3C)CCC2)c1O ZINC000845995145 1131678935 /nfs/dbraw/zinc/67/89/35/1131678935.db2.gz PSHAYQJGRFSDLZ-UHFFFAOYSA-N 1 0 297.398 3.878 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2cc(Cl)ccc2O)cc1C ZINC000846058821 1131679375 /nfs/dbraw/zinc/67/93/75/1131679375.db2.gz UXZVASSJVBAOFP-UHFFFAOYSA-N 1 0 275.779 3.952 20 10 CHCDRO C[C@@H](C[NH2+][C@H]1CCc2cccc(O)c21)c1cccc(F)c1 ZINC000834537485 1131681590 /nfs/dbraw/zinc/68/15/90/1131681590.db2.gz DQLRHDPYAOAKRL-LRDDRELGSA-N 1 0 285.362 3.912 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH+]1CCC2(CC2(F)F)CC1 ZINC000846054770 1131685508 /nfs/dbraw/zinc/68/55/08/1131685508.db2.gz QKHQUZFRRJLMGN-UHFFFAOYSA-N 1 0 294.389 3.682 20 10 CHCDRO CC1=CC[C@H]([NH2+]Cc2cc(Cl)ccc2O)CC1 ZINC000846055782 1131685723 /nfs/dbraw/zinc/68/57/23/1131685723.db2.gz NSKZBBLNXSRKHT-ZDUSSCGKSA-N 1 0 251.757 3.634 20 10 CHCDRO Cc1cccc(F)c1C[NH2+][C@H]1CCc2cccc(O)c21 ZINC000834602237 1131687261 /nfs/dbraw/zinc/68/72/61/1131687261.db2.gz MJVQZIDVUBYLTG-HNNXBMFYSA-N 1 0 271.335 3.617 20 10 CHCDRO Oc1c(C[N@@H+]2CC[C@]3(CC3(F)F)C2)ccc2ccccc21 ZINC000846115988 1131688148 /nfs/dbraw/zinc/68/81/48/1131688148.db2.gz CTHKDWYYYCDPQW-INIZCTEOSA-N 1 0 289.325 3.777 20 10 CHCDRO CCOc1ccccc1CC[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000834639816 1131690041 /nfs/dbraw/zinc/69/00/41/1131690041.db2.gz COKQNSYWDKVTCU-MRXNPFEDSA-N 1 0 297.398 3.611 20 10 CHCDRO Cc1cccc2c1CC[C@H]2[NH2+][C@H]1CCc2cccc(O)c21 ZINC000834641056 1131690213 /nfs/dbraw/zinc/69/02/13/1131690213.db2.gz VSUJHMFLYRQOIP-SJORKVTESA-N 1 0 279.383 3.965 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H]2c3ccccc3C[C@@H]2C)c1O ZINC000846151274 1131692141 /nfs/dbraw/zinc/69/21/41/1131692141.db2.gz YSLBREMFFSHCQR-LXIYXOSZSA-N 1 0 297.398 3.985 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@H]2CCC(C)(C)C2)c1O ZINC000846157238 1131692366 /nfs/dbraw/zinc/69/23/66/1131692366.db2.gz BSJKAMPNRQKWCM-NEPJUHHUSA-N 1 0 263.381 3.630 20 10 CHCDRO CC[C@H](CC(F)(F)F)[NH2+][C@@H](C)c1cccc(OC)c1O ZINC000846161699 1131692976 /nfs/dbraw/zinc/69/29/76/1131692976.db2.gz BBGINCUXKLHNCM-VHSXEESVSA-N 1 0 291.313 3.782 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]C[C@@H]2CCCC(F)(F)C2)c1O ZINC000846166873 1131693074 /nfs/dbraw/zinc/69/30/74/1131693074.db2.gz DSAKGDWLFGHICS-NWDGAFQWSA-N 1 0 299.361 3.877 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H]2CCC[C@@H](C)C2)c1O ZINC000846141833 1131694635 /nfs/dbraw/zinc/69/46/35/1131694635.db2.gz AKBASQLMMAJAIG-AGIUHOORSA-N 1 0 263.381 3.630 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]Cc2ccc(F)cc2F)c1O ZINC000846141672 1131694693 /nfs/dbraw/zinc/69/46/93/1131694693.db2.gz MIOKFVPZIMEAAA-JTQLQIEISA-N 1 0 293.313 3.530 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]Cc2cc(F)ccc2F)c1O ZINC000846148062 1131695783 /nfs/dbraw/zinc/69/57/83/1131695783.db2.gz WZCIEXHXGPYRGB-SNVBAGLBSA-N 1 0 293.313 3.530 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C2CC3(CCC3)C2)c(O)c1 ZINC000846210681 1131698627 /nfs/dbraw/zinc/69/86/27/1131698627.db2.gz BJHSHYOTHVSVCL-ZDUSSCGKSA-N 1 0 259.393 3.992 20 10 CHCDRO CO[C@@H]1CCCC[C@H]1[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000846200624 1131699455 /nfs/dbraw/zinc/69/94/55/1131699455.db2.gz GOWSUFYEIJDJSZ-XTWPYSKKSA-N 1 0 293.382 3.627 20 10 CHCDRO Oc1cccc(Cl)c1C[N@H+]1C[C@@H]2CC(F)(F)C[C@@H]2C1 ZINC001140337738 1131702850 /nfs/dbraw/zinc/70/28/50/1131702850.db2.gz BQUKOBPVGLJVDD-AOOOYVTPSA-N 1 0 287.737 3.523 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CCC[C@H](C(F)F)C1 ZINC001140341510 1131703376 /nfs/dbraw/zinc/70/33/76/1131703376.db2.gz SATIVZHQRPWNDB-VIFPVBQESA-N 1 0 275.726 3.523 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CC[C@H](c2ccccc2)O1)c1ccccc1O ZINC000846210219 1131703491 /nfs/dbraw/zinc/70/34/91/1131703491.db2.gz LQAOJSDYFQZANJ-URLQWDBASA-N 1 0 297.398 3.963 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2c(O)cccc2Cl)cc1 ZINC001140345500 1131704638 /nfs/dbraw/zinc/70/46/38/1131704638.db2.gz VLHABVFZGDDZJK-UHFFFAOYSA-N 1 0 275.779 3.986 20 10 CHCDRO COC1(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)CCCC1 ZINC000834814084 1131707760 /nfs/dbraw/zinc/70/77/60/1131707760.db2.gz DUUMMAYORQTVCY-NSHDSACASA-N 1 0 283.799 3.655 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCn2ccnc21)c1ccc2ccccc2c1O ZINC000834832811 1131710242 /nfs/dbraw/zinc/71/02/42/1131710242.db2.gz RNPDTSYTIKDVIZ-BLLLJJGKSA-N 1 0 293.370 3.538 20 10 CHCDRO CCC[C@@H](C[NH2+][C@H](CC)c1ccc(C)cc1O)OC ZINC000834841497 1131710833 /nfs/dbraw/zinc/71/08/33/1131710833.db2.gz VAJDUNGWAGYZDM-DZGCQCFKSA-N 1 0 265.397 3.556 20 10 CHCDRO Cc1cc(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)ccn1 ZINC000834859569 1131712969 /nfs/dbraw/zinc/71/29/69/1131712969.db2.gz DJLUSZGUABJCJP-YGRLFVJLSA-N 1 0 286.350 3.573 20 10 CHCDRO CO[C@@H](C[NH2+][C@H](C)c1cc(C)ccc1O)Cc1ccccc1 ZINC000834856069 1131713323 /nfs/dbraw/zinc/71/33/23/1131713323.db2.gz KJEWEDGCUVTYBQ-NVXWUHKLSA-N 1 0 299.414 3.609 20 10 CHCDRO Cc1cc(C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)ccn1 ZINC000834860929 1131713805 /nfs/dbraw/zinc/71/38/05/1131713805.db2.gz VOQALEVMSBBVQP-LBPRGKRZSA-N 1 0 290.794 3.908 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H](C)CC(C)(C)O)c1O ZINC000834877064 1131716125 /nfs/dbraw/zinc/71/61/25/1131716125.db2.gz SGEQJLZFJAMUST-WDEREUQCSA-N 1 0 285.815 3.554 20 10 CHCDRO CC[C@H]([NH2+]Cc1nccn1CC)c1cc(Cl)ccc1O ZINC000834878425 1131717000 /nfs/dbraw/zinc/71/70/00/1131717000.db2.gz CPAZVKMYXROWGE-ZDUSSCGKSA-N 1 0 293.798 3.503 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@](C)(CC)OC)cc1 ZINC000834882176 1131717114 /nfs/dbraw/zinc/71/71/14/1131717114.db2.gz KCWNCMILNGCCMS-YOEHRIQHSA-N 1 0 278.440 3.608 20 10 CHCDRO C[C@@H]([NH2+]C[C@]1(C)CC1(Cl)Cl)c1cc(F)ccc1O ZINC000834884571 1131717760 /nfs/dbraw/zinc/71/77/60/1131717760.db2.gz NQLDLTILOOTYFF-PELKAZGASA-N 1 0 292.181 3.766 20 10 CHCDRO CO[C@](C)(C[NH2+][C@H](C)c1ccccc1O)c1ccccc1 ZINC000834885076 1131718572 /nfs/dbraw/zinc/71/85/72/1131718572.db2.gz SVWLEXSMWYOCGY-RDTXWAMCSA-N 1 0 285.387 3.605 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CCC[C@H]1OC)c1cc(Cl)ccc1O ZINC000834886441 1131718876 /nfs/dbraw/zinc/71/88/76/1131718876.db2.gz LDYIXWWCCLWTPY-UMVBOHGHSA-N 1 0 283.799 3.654 20 10 CHCDRO Cc1ccncc1C[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000834887300 1131719353 /nfs/dbraw/zinc/71/93/53/1131719353.db2.gz RVNBJVSKEKDGJB-NSHDSACASA-N 1 0 276.767 3.600 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2cnccc2C)c(O)c1 ZINC000834887237 1131719402 /nfs/dbraw/zinc/71/94/02/1131719402.db2.gz QHWIFFLBDIXFAR-CQSZACIVSA-N 1 0 270.376 3.563 20 10 CHCDRO C[C@H]([NH2+][C@H]1C[C@@H](C)n2ccnc21)c1cc(Cl)ccc1O ZINC000834892698 1131719529 /nfs/dbraw/zinc/71/95/29/1131719529.db2.gz CSHULWRKEPQQRS-NRUUGDAUSA-N 1 0 291.782 3.599 20 10 CHCDRO COc1ccc(C)cc1C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000772950384 1131720423 /nfs/dbraw/zinc/72/04/23/1131720423.db2.gz GTLGAAAVXIZYPV-OAHLLOKOSA-N 1 0 298.430 3.920 20 10 CHCDRO CCCc1ncc(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)o1 ZINC000834898795 1131722799 /nfs/dbraw/zinc/72/27/99/1131722799.db2.gz GULPNMDZJGOJEP-ZDUSSCGKSA-N 1 0 288.391 3.800 20 10 CHCDRO COc1cccc([C@H]2C[C@H]([NH2+][C@H](C)c3ccccc3O)C2)c1 ZINC000834906284 1131728795 /nfs/dbraw/zinc/72/87/95/1131728795.db2.gz YSIRJDFEVXMLQK-FVQBIDKESA-N 1 0 297.398 3.998 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C2CCC(OC(F)F)CC2)c(O)c1 ZINC000834906760 1131729173 /nfs/dbraw/zinc/72/91/73/1131729173.db2.gz ZCVORCRPZIRTAA-PNESKVBLSA-N 1 0 299.361 3.902 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2CCOC(C)(C)C2)c1 ZINC000834909970 1131731477 /nfs/dbraw/zinc/73/14/77/1131731477.db2.gz MUBFYVXZWIFQPG-ZIAGYGMSSA-N 1 0 277.408 3.556 20 10 CHCDRO CCO[C@@H]1CCC[C@H]1[NH2+][C@H](CC)c1ccc(N(C)C)cc1 ZINC000834913135 1131731484 /nfs/dbraw/zinc/73/14/84/1131731484.db2.gz OPEBQRHKGXTAOC-KZNAEPCWSA-N 1 0 290.451 3.751 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCOC(C)(C)C2)c1 ZINC000834909966 1131731888 /nfs/dbraw/zinc/73/18/88/1131731888.db2.gz MUBFYVXZWIFQPG-UONOGXRCSA-N 1 0 277.408 3.556 20 10 CHCDRO CCO[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000834914852 1131733737 /nfs/dbraw/zinc/73/37/37/1131733737.db2.gz WWXIIDDAMAEYNY-YSVLISHTSA-N 1 0 277.408 3.699 20 10 CHCDRO C[C@H]1C[N@H+](Cc2ccc(Cl)cc2O)CCC1(F)F ZINC001140461380 1131747091 /nfs/dbraw/zinc/74/70/91/1131747091.db2.gz JZEDKQGAGFKOLS-VIFPVBQESA-N 1 0 275.726 3.523 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]C[C@@H]2CCCC2(F)F)cc1 ZINC000835055294 1131765994 /nfs/dbraw/zinc/76/59/94/1131765994.db2.gz UKUNFWXOQQRHDC-XVWMLYKFSA-N 1 0 294.389 3.791 20 10 CHCDRO CC[N@H+](C/C=C\c1ccc(N(C)C)cc1)Cc1ccncc1 ZINC000835054829 1131767029 /nfs/dbraw/zinc/76/70/29/1131767029.db2.gz ZKALTQKUCAPAFY-WAYWQWQTSA-N 1 0 295.430 3.683 20 10 CHCDRO Oc1cccc2c1CN(Cc1cc(F)cc(Cl)c1)CC2 ZINC001140542605 1131786058 /nfs/dbraw/zinc/78/60/58/1131786058.db2.gz PTRVTRMHZLXYGT-UHFFFAOYSA-N 1 0 291.753 3.743 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCSc3ccccc3C2)c1 ZINC001140623701 1131832311 /nfs/dbraw/zinc/83/23/11/1131832311.db2.gz QPNWRXZESIVAEJ-UHFFFAOYSA-N 1 0 285.412 3.809 20 10 CHCDRO Cc1ccncc1[C@H](C)[NH2+]Cc1ccc(N(C)C)c(C)c1 ZINC000772996747 1131877442 /nfs/dbraw/zinc/87/74/42/1131877442.db2.gz GZBXWZWKDMMWRB-HNNXBMFYSA-N 1 0 283.419 3.615 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H]2CC=CCC2)cc1 ZINC000772999036 1131910855 /nfs/dbraw/zinc/91/08/55/1131910855.db2.gz HVSIBKLBLDUEKK-GDBMZVCRSA-N 1 0 258.409 3.902 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@H](F)CC2)c(O)c1 ZINC001140850037 1131945843 /nfs/dbraw/zinc/94/58/43/1131945843.db2.gz BBYYARNJNRCZMJ-HNNXBMFYSA-N 1 0 294.414 3.562 20 10 CHCDRO CCN(CC)c1ccc(C[NH+]2Cc3ccccc3C2)c(O)c1 ZINC001140851106 1131947015 /nfs/dbraw/zinc/94/70/15/1131947015.db2.gz BVOFIIOZDXPHAE-UHFFFAOYSA-N 1 0 296.414 3.754 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1ccc[nH]1)c1ccc(N(C)C)cc1 ZINC000773113996 1131948095 /nfs/dbraw/zinc/94/80/95/1131948095.db2.gz CCQPHVWTTCDWCR-CJNGLKHVSA-N 1 0 271.408 3.883 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@H]2C(C)C)c(O)c1 ZINC001140856477 1131948462 /nfs/dbraw/zinc/94/84/62/1131948462.db2.gz CJOONTBWEKJNQI-KRWDZBQOSA-N 1 0 290.451 3.859 20 10 CHCDRO Cc1c[nH]c(C[N@@H+](C)Cc2ccc(N3CCCC3)cc2)c1C ZINC001140859595 1131949165 /nfs/dbraw/zinc/94/91/65/1131949165.db2.gz BFPOQEJKCJWJGQ-UHFFFAOYSA-N 1 0 297.446 3.864 20 10 CHCDRO CN(C)c1ccc(CN2CCCC[C@H](F)C2)c(Cl)c1 ZINC001140922548 1131963253 /nfs/dbraw/zinc/96/32/53/1131963253.db2.gz UGOJGBLFGZBVCU-ZDUSSCGKSA-N 1 0 284.806 3.730 20 10 CHCDRO CC[C@@H]1CCC[N@@H+]1Cc1ccc(N(C)C)cc1Cl ZINC001140923657 1131966372 /nfs/dbraw/zinc/96/63/72/1131966372.db2.gz GCPUZHNOGHLYCK-CYBMUJFWSA-N 1 0 266.816 3.780 20 10 CHCDRO Cc1cccc(C[N@@H+](C)Cc2ccc(C)cc2O)c1 ZINC001140948611 1131969210 /nfs/dbraw/zinc/96/92/10/1131969210.db2.gz QXLBTZBFOXNURQ-UHFFFAOYSA-N 1 0 255.361 3.641 20 10 CHCDRO COc1ccc([C@@H](C)[N@H+](C)Cc2ccc(C)cc2O)cc1 ZINC001140951010 1131971848 /nfs/dbraw/zinc/97/18/48/1131971848.db2.gz SXUSIZUJDZCWRZ-CQSZACIVSA-N 1 0 285.387 3.902 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)OCO2)c1ccccc1O ZINC000036982037 1131985977 /nfs/dbraw/zinc/98/59/77/1131985977.db2.gz MZXIFUIRUKYDSY-NWDGAFQWSA-N 1 0 285.343 3.533 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CC[C@@H]2CCCS2)c1 ZINC000715700261 1131990656 /nfs/dbraw/zinc/99/06/56/1131990656.db2.gz XWDUTNBMDOUBKP-OLZOCXBDSA-N 1 0 265.422 3.637 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1ccns1 ZINC000715897691 1131995139 /nfs/dbraw/zinc/99/51/39/1131995139.db2.gz DAFCMDSWWVZZIF-RYUDHWBXSA-N 1 0 275.421 3.621 20 10 CHCDRO CC(C)[NH+](CCN[C@@H](C)c1ccc(N(C)C)cc1)C(C)C ZINC000037188684 1132009958 /nfs/dbraw/zinc/00/99/58/1132009958.db2.gz KHYZTVMWXYZFEA-INIZCTEOSA-N 1 0 291.483 3.522 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)cc1 ZINC000037214538 1132022235 /nfs/dbraw/zinc/02/22/35/1132022235.db2.gz RRGCZYDKDRYUCS-OAHLLOKOSA-N 1 0 268.404 3.912 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccccc1)c1ccc(N(C)C)cc1 ZINC000037202138 1132022421 /nfs/dbraw/zinc/02/24/21/1132022421.db2.gz YOZQYXSCQDDQPM-OAHLLOKOSA-N 1 0 268.404 3.646 20 10 CHCDRO Cc1ccc(CC[C@H](C)[NH2+]Cc2ccc(O)cc2O)cc1 ZINC001171659423 1132070916 /nfs/dbraw/zinc/07/09/16/1132070916.db2.gz CAOFRXXUDFDTMS-AWEZNQCLSA-N 1 0 285.387 3.517 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H]2CSc3ccccc3C2)cc1 ZINC001172196803 1132147125 /nfs/dbraw/zinc/14/71/25/1132147125.db2.gz LPWUSTVBMNPISS-MRXNPFEDSA-N 1 0 298.455 3.559 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(C)nc1Cl)c1ccccc1O ZINC000838912158 1132158167 /nfs/dbraw/zinc/15/81/67/1132158167.db2.gz DBBYNFDOMLKDKH-AWEZNQCLSA-N 1 0 290.794 3.990 20 10 CHCDRO C[C@@H]1CC[C@@H]([N@@H+]2CCCc3cc(O)c(O)cc3C2)C[C@H]1C ZINC001172379415 1132171548 /nfs/dbraw/zinc/17/15/48/1132171548.db2.gz OGJDVXGEPJBOSU-XJKCOSOUSA-N 1 0 289.419 3.671 20 10 CHCDRO Oc1ccc(Br)cc1C[NH+]1CC2(C1)CCCC2 ZINC000839104116 1132181727 /nfs/dbraw/zinc/18/17/27/1132181727.db2.gz HGJLIMQACBGVLD-UHFFFAOYSA-N 1 0 296.208 3.531 20 10 CHCDRO CCOCc1cc(C[NH2+][C@@]2(C)CC=CCC2)ccc1OC ZINC000839192144 1132190303 /nfs/dbraw/zinc/19/03/03/1132190303.db2.gz LLUWWNCNLFYHOW-SFHVURJKSA-N 1 0 289.419 3.820 20 10 CHCDRO Oc1ccc2ccncc2c1C[N@@H+]1CC[C@@H](C2CCC2)C1 ZINC000840187172 1132249360 /nfs/dbraw/zinc/24/93/60/1132249360.db2.gz ACFOLSZCFIFSGA-OAHLLOKOSA-N 1 0 282.387 3.562 20 10 CHCDRO CC[C@H]([NH2+]CCCSc1nccs1)[C@@H]1C[C@@H]1C ZINC000840720952 1132277186 /nfs/dbraw/zinc/27/71/86/1132277186.db2.gz BENSIGSOPMAWIN-TUAOUCFPSA-N 1 0 270.467 3.650 20 10 CHCDRO CO[C@@H]1C[C@H]([NH2+][C@@H](C)c2c(C)cc(C)cc2O)C12CCC2 ZINC000840805859 1132288807 /nfs/dbraw/zinc/28/88/07/1132288807.db2.gz CCFXKQRYTGMCGY-CWRNSKLLSA-N 1 0 289.419 3.617 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]C1CCC(C(F)F)CC1)CC2 ZINC000840806552 1132289004 /nfs/dbraw/zinc/28/90/04/1132289004.db2.gz INXGRIRVCFFFCF-BPCQOVAHSA-N 1 0 281.346 3.793 20 10 CHCDRO CO[C@@H]1C[C@H]([NH2+][C@H](C)c2cc(Cl)ccc2O)C12CCC2 ZINC000840807285 1132290756 /nfs/dbraw/zinc/29/07/56/1132290756.db2.gz SCCZATCKSRTBJJ-WKPIXPDZSA-N 1 0 295.810 3.654 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)CS1 ZINC000840860665 1132295960 /nfs/dbraw/zinc/29/59/60/1132295960.db2.gz VIIDBWXKGOGSER-WYFGTUCQSA-N 1 0 281.396 3.563 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCCC[C@H]2F)c(O)c1C ZINC000840875712 1132299371 /nfs/dbraw/zinc/29/93/71/1132299371.db2.gz JDNBCFVXGWXYAK-NWANDNLSSA-N 1 0 265.372 3.940 20 10 CHCDRO Cc1cc(O)c(C[NH2+]Cc2ccccc2C)c(Cl)c1 ZINC000840876337 1132299912 /nfs/dbraw/zinc/29/99/12/1132299912.db2.gz MBXFWDQASJTYKX-UHFFFAOYSA-N 1 0 275.779 3.952 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CC(C)(C)OCC2CC2)c(O)c1 ZINC000840876331 1132300127 /nfs/dbraw/zinc/30/01/27/1132300127.db2.gz LXXUKCOJTQAJAL-CQSZACIVSA-N 1 0 291.435 3.865 20 10 CHCDRO Oc1cccc2c1C[N@@H+]([C@H]1Cc3ccc(Cl)cc3C1)CC2 ZINC001172726460 1132300058 /nfs/dbraw/zinc/30/00/58/1132300058.db2.gz WNVGSWFDVPSCKJ-INIZCTEOSA-N 1 0 299.801 3.571 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CC)c1cccc(Cl)c1[O-])[C@@H](O)C(C)C ZINC000840880776 1132301163 /nfs/dbraw/zinc/30/11/63/1132301163.db2.gz FACQXOBVIDULLS-ZNMIVQPWSA-N 1 0 299.842 3.882 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)C1(OC)CCC1)c1ccc(N(C)C)cc1 ZINC000840883708 1132301893 /nfs/dbraw/zinc/30/18/93/1132301893.db2.gz HOMBKQOIZSHWLT-RHSMWYFYSA-N 1 0 290.451 3.751 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1c2ccccc2O[C@@H]1C ZINC000840947210 1132311432 /nfs/dbraw/zinc/31/14/32/1132311432.db2.gz RCOOFSDQYWFIBR-KUHUBIRLSA-N 1 0 296.414 3.673 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@H]2CCCC2(F)F)c(Cl)c1 ZINC000840951302 1132311855 /nfs/dbraw/zinc/31/18/55/1132311855.db2.gz VVMWFEJZMYSKQH-SNVBAGLBSA-N 1 0 289.753 3.879 20 10 CHCDRO Cc1cc(O)c(C[NH+]2CCC(F)(F)CC2)c(Cl)c1 ZINC000840941047 1132311933 /nfs/dbraw/zinc/31/19/33/1132311933.db2.gz OSPXYADHHYBVLW-UHFFFAOYSA-N 1 0 275.726 3.585 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@H]2CCC(F)(F)C2)c(Cl)c1 ZINC000840942019 1132312565 /nfs/dbraw/zinc/31/25/65/1132312565.db2.gz ZEYBEZKYTLGRHO-JTQLQIEISA-N 1 0 289.753 3.879 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H](C)[C@@H]2CC2(F)F)cc1 ZINC000840965298 1132313924 /nfs/dbraw/zinc/31/39/24/1132313924.db2.gz BRXOLHJSLBIEMS-DOMZBBRYSA-N 1 0 282.378 3.666 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)[C@@H]2CC2(F)F)cc1 ZINC000840965301 1132315060 /nfs/dbraw/zinc/31/50/60/1132315060.db2.gz BRXOLHJSLBIEMS-WFASDCNBSA-N 1 0 282.378 3.666 20 10 CHCDRO C[C@H]1C[C@@H](CF)[N@H+](Cc2c(O)ccc3ccccc32)C1 ZINC001231588875 1132317253 /nfs/dbraw/zinc/31/72/53/1132317253.db2.gz XOMBHIDIFSBGLI-JSGCOSHPSA-N 1 0 273.351 3.725 20 10 CHCDRO COC(C)(C)[C@H]1CCC[N@@H+]1Cc1c(O)ccc2ccccc21 ZINC001231589324 1132317711 /nfs/dbraw/zinc/31/77/11/1132317711.db2.gz BXCALENGCWRAMG-GOSISDBHSA-N 1 0 299.414 3.935 20 10 CHCDRO CC1(F)CC[NH+](Cc2c(O)ccc3ccccc32)CC1 ZINC001231588854 1132317741 /nfs/dbraw/zinc/31/77/41/1132317741.db2.gz WJGROFVMYDCIIQ-UHFFFAOYSA-N 1 0 273.351 3.869 20 10 CHCDRO Cc1cccc(C[NH+]2CCC3(CC(F)(F)C3)CC2)c1O ZINC001231592035 1132320340 /nfs/dbraw/zinc/32/03/40/1132320340.db2.gz ONZBWZRWSNUIDS-UHFFFAOYSA-N 1 0 281.346 3.712 20 10 CHCDRO Nc1ccc(CC[NH2+][C@@H]2CCC[C@H]2c2ccc(F)cc2)cc1 ZINC000841034610 1132321227 /nfs/dbraw/zinc/32/12/27/1132321227.db2.gz IDWTWYRUZOZVPX-RBUKOAKNSA-N 1 0 298.405 3.876 20 10 CHCDRO Cc1cccc(C[N@@H+](CC(=O)c2ccccc2)C(C)C)c1O ZINC001231594134 1132321367 /nfs/dbraw/zinc/32/13/67/1132321367.db2.gz SZPNQUVYGQWPPE-UHFFFAOYSA-N 1 0 297.398 3.794 20 10 CHCDRO Nc1ccc(CC[NH2+]Cc2ccc(C(F)(F)F)cc2)cc1 ZINC000841034432 1132322012 /nfs/dbraw/zinc/32/20/12/1132322012.db2.gz AYRZEWMIIJPVBS-UHFFFAOYSA-N 1 0 294.320 3.620 20 10 CHCDRO Nc1ccc(CC[NH2+]C2CCC(C(F)(F)F)CC2)cc1 ZINC000841038259 1132322455 /nfs/dbraw/zinc/32/24/55/1132322455.db2.gz IFEDDAGECRDPHX-UHFFFAOYSA-N 1 0 286.341 3.522 20 10 CHCDRO Nc1ccc(CC[NH2+]CCCCCOc2ccccc2)cc1 ZINC000841038619 1132322543 /nfs/dbraw/zinc/32/25/43/1132322543.db2.gz MHCLGFRETHPCQG-UHFFFAOYSA-N 1 0 298.430 3.650 20 10 CHCDRO C[C@H](C[NH2+]CCc1ccc(N)cc1)c1cccc(Cl)c1 ZINC000841038630 1132323224 /nfs/dbraw/zinc/32/32/24/1132323224.db2.gz MNDYYLLQPQDVON-CYBMUJFWSA-N 1 0 288.822 3.858 20 10 CHCDRO Nc1ccc(CC[NH2+][C@H]2CC[C@@H](Cc3ccccc3)C2)cc1 ZINC000841038780 1132323480 /nfs/dbraw/zinc/32/34/80/1132323480.db2.gz QEAMDDYKBXGRFE-ICSRJNTNSA-N 1 0 294.442 3.812 20 10 CHCDRO Cc1ccc2c(c1)C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)CC2 ZINC001172844696 1132334932 /nfs/dbraw/zinc/33/49/32/1132334932.db2.gz YFEASBDFRMCMKJ-IBGZPJMESA-N 1 0 294.442 3.708 20 10 CHCDRO Cc1cc(C)c(C[N@H+]2CC[C@@H](C)C(F)(F)CC2)c(O)c1 ZINC001231842248 1132376225 /nfs/dbraw/zinc/37/62/25/1132376225.db2.gz LRJKSIHILUWYEC-CYBMUJFWSA-N 1 0 283.362 3.876 20 10 CHCDRO Cc1cc(C)c(C[N@H+](C)CCc2ccccc2F)c(O)c1 ZINC001231850219 1132377713 /nfs/dbraw/zinc/37/77/13/1132377713.db2.gz MJWMQYAMTWJOQG-UHFFFAOYSA-N 1 0 287.378 3.823 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2Cc3ccc(F)cc3C2)c(O)c1 ZINC001231846517 1132378324 /nfs/dbraw/zinc/37/83/24/1132378324.db2.gz NHWQXKYWWNEUHU-UHFFFAOYSA-N 1 0 271.335 3.664 20 10 CHCDRO Cc1cc(C)c(C[NH+]2CC3CCC(CC3)C2)c(O)c1 ZINC001231846166 1132378527 /nfs/dbraw/zinc/37/85/27/1132378527.db2.gz COTVNPQJNGMNHS-UHFFFAOYSA-N 1 0 259.393 3.631 20 10 CHCDRO Cc1cc(C)c(C[NH+]2CCc3ccccc3CC2)c(O)c1 ZINC001231843880 1132378638 /nfs/dbraw/zinc/37/86/38/1132378638.db2.gz CKHLCERDNNWKON-UHFFFAOYSA-N 1 0 281.399 3.610 20 10 CHCDRO COc1cc(N(C)C)ccc1C[N@@H+]1CCC2(CCCC2)C1 ZINC001231853480 1132378773 /nfs/dbraw/zinc/37/87/73/1132378773.db2.gz KWLXMHOLNMNBCY-UHFFFAOYSA-N 1 0 288.435 3.527 20 10 CHCDRO COc1cc(N(C)C)ccc1C[NH+]1CCCCCCC1 ZINC001231853880 1132379614 /nfs/dbraw/zinc/37/96/14/1132379614.db2.gz SXMXGPNYRRGGQH-UHFFFAOYSA-N 1 0 276.424 3.527 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CC[C@@](C)(CF)C2)cc1Cl ZINC001231867142 1132380512 /nfs/dbraw/zinc/38/05/12/1132380512.db2.gz HVYDFIQSERKOSS-AWEZNQCLSA-N 1 0 271.763 3.536 20 10 CHCDRO C[N@H+](Cc1ccccc1O)C1CCC2(CCOCC2)CC1 ZINC001173052002 1132382897 /nfs/dbraw/zinc/38/28/97/1132382897.db2.gz SGLWZAMKIXDUAM-UHFFFAOYSA-N 1 0 289.419 3.563 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC[C@H](C(F)F)C2)cc1Cl ZINC001231870850 1132382922 /nfs/dbraw/zinc/38/29/22/1132382922.db2.gz VFSWXWWGDMLORH-JTQLQIEISA-N 1 0 289.753 3.831 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2CCC[C@H](C)[C@H]2C)cc1Cl ZINC001231871110 1132383302 /nfs/dbraw/zinc/38/33/02/1132383302.db2.gz YKNOIQRRYBBWSE-CMPLNLGQSA-N 1 0 267.800 3.974 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CC[C@H](C(F)(F)F)C2)cc1Cl ZINC001231870608 1132384590 /nfs/dbraw/zinc/38/45/90/1132384590.db2.gz LSRXWGFHNWCUJY-JTQLQIEISA-N 1 0 293.716 3.738 20 10 CHCDRO CCCOC1CC[NH+](Cc2ccc3ccccc3c2O)CC1 ZINC001231883136 1132389007 /nfs/dbraw/zinc/38/90/07/1132389007.db2.gz ZLUBWWUGTDVQNL-UHFFFAOYSA-N 1 0 299.414 3.936 20 10 CHCDRO Oc1c(C[N@@H+]2CCC[C@@H]3C[C@@H]32)ccc2ccccc21 ZINC001231883781 1132389424 /nfs/dbraw/zinc/38/94/24/1132389424.db2.gz UJHJOSCGARIWFN-CJNGLKHVSA-N 1 0 253.345 3.530 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCC(F)(F)C1)c1ccc(Cl)cc1O ZINC000841749897 1132390918 /nfs/dbraw/zinc/39/09/18/1132390918.db2.gz JMPCZQXMDCFORQ-PSASIEDQSA-N 1 0 275.726 3.884 20 10 CHCDRO O=C1C[C@H]2CCC[C@@H](C1)[N@H+]2Cc1ccc2ccccc2c1O ZINC001231880334 1132390869 /nfs/dbraw/zinc/39/08/69/1132390869.db2.gz BZRXARAILQTGPW-IYBDPMFKSA-N 1 0 295.382 3.631 20 10 CHCDRO CO[C@H](C[NH2+][C@@H](C)c1ccc(Cl)cc1O)C(C)(C)C ZINC000841756178 1132391598 /nfs/dbraw/zinc/39/15/98/1132391598.db2.gz USXCGUDSGUMFEM-IINYFYTJSA-N 1 0 285.815 3.757 20 10 CHCDRO Oc1c(C[N@@H+]2C[C@H]3CC[C@@H]2C3)ccc2ccccc21 ZINC001231880953 1132392183 /nfs/dbraw/zinc/39/21/83/1132392183.db2.gz OYSWQLSCRMTYCC-SWLSCSKDSA-N 1 0 253.345 3.530 20 10 CHCDRO CC[C@](C)(C[NH2+][C@H](C)c1ccc(Cl)cc1O)OC ZINC000841759015 1132393492 /nfs/dbraw/zinc/39/34/92/1132393492.db2.gz WXEKQMWKJXHUQM-QMTHXVAHSA-N 1 0 271.788 3.511 20 10 CHCDRO Cc1ccccc1C[N@@H+](C)Cc1cc(Cl)c(O)cc1O ZINC001232261931 1132444003 /nfs/dbraw/zinc/44/40/03/1132444003.db2.gz UVFNJOMXKVTVHI-UHFFFAOYSA-N 1 0 291.778 3.692 20 10 CHCDRO C[C@@H]1CCCCC[N@@H+]1Cc1cc(Cl)c(O)cc1O ZINC001232261781 1132444236 /nfs/dbraw/zinc/44/42/36/1132444236.db2.gz PGOISXOQGKDPOF-SNVBAGLBSA-N 1 0 269.772 3.516 20 10 CHCDRO C[N@H+](Cc1ccc(F)cc1)Cc1cc(Cl)c(O)cc1O ZINC001232259481 1132445142 /nfs/dbraw/zinc/44/51/42/1132445142.db2.gz JWZBBZQEHYGLKF-UHFFFAOYSA-N 1 0 295.741 3.522 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CCC[C@H](C)[C@H](C)C2)cc1Cl ZINC001232267100 1132446461 /nfs/dbraw/zinc/44/64/61/1132446461.db2.gz WIXUZAURVWWOFK-NWDGAFQWSA-N 1 0 297.826 3.922 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CC[C@H](C)C[C@H]2C)cc1Cl ZINC001232270217 1132446480 /nfs/dbraw/zinc/44/64/80/1132446480.db2.gz YQXHUUKFGMTATI-WDEREUQCSA-N 1 0 283.799 3.675 20 10 CHCDRO CC(C)C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccncc1 ZINC000842836408 1132467993 /nfs/dbraw/zinc/46/79/93/1132467993.db2.gz ANLANWZQXXEMCE-GOSISDBHSA-N 1 0 296.414 3.894 20 10 CHCDRO CCCCOCC[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC000040506504 1132472917 /nfs/dbraw/zinc/47/29/17/1132472917.db2.gz DABXSXAFOQJTNB-ZIAGYGMSSA-N 1 0 277.408 3.655 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+][C@H]2CCS[C@H]2C)c2c1c(F)ccc2O ZINC000842929962 1132477411 /nfs/dbraw/zinc/47/74/11/1132477411.db2.gz RAWMUMAXUZVUIW-QCZKYFFMSA-N 1 0 281.396 3.563 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)Cc2cc3ccoc3cn2)cc1 ZINC001232556632 1132487942 /nfs/dbraw/zinc/48/79/42/1132487942.db2.gz KBHJNHKZOHQJDE-UHFFFAOYSA-N 1 0 295.386 3.526 20 10 CHCDRO C[C@@H]1C[C@@H](F)C[N@@H+]1Cc1cccc(C(C)(C)C)c1O ZINC001143103855 1132502532 /nfs/dbraw/zinc/50/25/32/1132502532.db2.gz LXMYJEGWQKZJTE-DGCLKSJQSA-N 1 0 265.372 3.622 20 10 CHCDRO CC(C)(C)c1cccc(C[N@@H+]2CC[C@](C)(CF)C2)c1O ZINC001143104509 1132502632 /nfs/dbraw/zinc/50/26/32/1132502632.db2.gz UMMCBESQNNRHES-QGZVFWFLSA-N 1 0 279.399 3.871 20 10 CHCDRO CC(C)[C@H]1COCC[N@@H+]1Cc1cccc(C(C)(C)C)c1O ZINC001143111569 1132504811 /nfs/dbraw/zinc/50/48/11/1132504811.db2.gz DDCKZZFIMYHDMN-MRXNPFEDSA-N 1 0 291.435 3.547 20 10 CHCDRO C[C@@H]1c2ccccc2CC[N@H+]1Cc1ccc(N(C)C)cc1O ZINC001232833743 1132527958 /nfs/dbraw/zinc/52/79/58/1132527958.db2.gz DMXCCIREEJIFCP-CQSZACIVSA-N 1 0 296.414 3.578 20 10 CHCDRO C[C@@H]1SCC[C@@H]1[NH2+]Cc1ccc2ccccc2c1O ZINC000843435487 1132535574 /nfs/dbraw/zinc/53/55/74/1132535574.db2.gz UXBBJGZVDCYRQV-NHYWBVRUSA-N 1 0 273.401 3.529 20 10 CHCDRO Oc1cccc2c1C[N@H+](Cc1ccc(C3CC3)cc1)CC2 ZINC001232986661 1132557719 /nfs/dbraw/zinc/55/77/19/1132557719.db2.gz WKVJNEMPJIQPQF-UHFFFAOYSA-N 1 0 279.383 3.828 20 10 CHCDRO Oc1cc(C[N@@H+]2CCCC[C@H]2c2ccccc2)cc(O)c1O ZINC001233010369 1132561888 /nfs/dbraw/zinc/56/18/88/1132561888.db2.gz PZXGUKFDVIEINE-HNNXBMFYSA-N 1 0 299.370 3.531 20 10 CHCDRO Oc1cc(C[N@@H+]2CCCC[C@@H]2c2ccccc2)cc(O)c1O ZINC001233010370 1132563294 /nfs/dbraw/zinc/56/32/94/1132563294.db2.gz PZXGUKFDVIEINE-OAHLLOKOSA-N 1 0 299.370 3.531 20 10 CHCDRO CC[C@@H]1CCCC[N@@H+]1Cc1c(O)cccc1Cl ZINC000131540591 1132568724 /nfs/dbraw/zinc/56/87/24/1132568724.db2.gz XXYNHXLOSRYUOJ-LLVKDONJSA-N 1 0 253.773 3.810 20 10 CHCDRO Cc1cc(Br)cc(C[N@H+](C)CC2CCC2)c1O ZINC001233111000 1132571679 /nfs/dbraw/zinc/57/16/79/1132571679.db2.gz XBWRLPUWTYCDMF-UHFFFAOYSA-N 1 0 298.224 3.695 20 10 CHCDRO COC1(C)CC[NH+](Cc2cc(C(C)(C)C)ccc2O)CC1 ZINC001233284043 1132594151 /nfs/dbraw/zinc/59/41/51/1132594151.db2.gz FTIZEGYPAZCMAZ-UHFFFAOYSA-N 1 0 291.435 3.691 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CCC[C@H](C)[C@H](C)C2)c1O ZINC001233287886 1132597918 /nfs/dbraw/zinc/59/79/18/1132597918.db2.gz LJLQVHFZKLLPGD-NWDGAFQWSA-N 1 0 297.826 3.922 20 10 CHCDRO C[C@@H]1CCC[N@H+](Cc2c(O)cccc2Cl)[C@@H]1C ZINC000133716101 1132602271 /nfs/dbraw/zinc/60/22/71/1132602271.db2.gz KBABVAXFGHJEAR-GHMZBOCLSA-N 1 0 253.773 3.666 20 10 CHCDRO Oc1cc(C(F)(F)F)ccc1C[N@@H+]1CCc2occc2C1 ZINC001233454883 1132624363 /nfs/dbraw/zinc/62/43/63/1132624363.db2.gz NOSARAQHEALHKV-UHFFFAOYSA-N 1 0 297.276 3.562 20 10 CHCDRO C[C@@H]1CCC[N@H+](Cc2ccc(C(F)(F)F)cc2O)C1 ZINC001233451400 1132625337 /nfs/dbraw/zinc/62/53/37/1132625337.db2.gz JDOSTEYDPKKMJW-SNVBAGLBSA-N 1 0 273.298 3.643 20 10 CHCDRO Cc1c[nH+]ccc1Nc1cc(C(C)(C)C)ccc1O ZINC001174540198 1132900687 /nfs/dbraw/zinc/90/06/87/1132900687.db2.gz XPWMJPNWOWOPLG-UHFFFAOYSA-N 1 0 256.349 3.559 20 10 CHCDRO Cc1cc(C)[nH+]c(NCc2c(C)cc(C)cc2O)c1 ZINC001160807808 1132982242 /nfs/dbraw/zinc/98/22/42/1132982242.db2.gz FMUNZTFPLNSEHP-UHFFFAOYSA-N 1 0 256.349 3.633 20 10 CHCDRO Cc1cc(C)c(CNc2ccc3c([nH+]2)CCCC3)c(O)c1 ZINC001160810077 1132982603 /nfs/dbraw/zinc/98/26/03/1132982603.db2.gz IRIRGTAMBFEZCN-UHFFFAOYSA-N 1 0 282.387 3.895 20 10 CHCDRO Cc1cc(C)c(CNc2cc(OC(C)C)cc[nH+]2)c(O)c1 ZINC001160810552 1132983014 /nfs/dbraw/zinc/98/30/14/1132983014.db2.gz SEDMUTJRECZBST-UHFFFAOYSA-N 1 0 286.375 3.803 20 10 CHCDRO CCCOc1ccc(C[NH2+]CC[C@H]2CCCOC2)cc1C ZINC001203227561 1133306630 /nfs/dbraw/zinc/30/66/30/1133306630.db2.gz AVFGVFOIRDJHDX-MRXNPFEDSA-N 1 0 291.435 3.690 20 10 CHCDRO C[C@H]([NH2+]Cc1cccc2[nH]ccc21)c1ccccc1O ZINC001203541795 1133339268 /nfs/dbraw/zinc/33/92/68/1133339268.db2.gz HVDOVHOXSXNEFJ-LBPRGKRZSA-N 1 0 266.344 3.724 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCc3cccc(O)c3C2)c(C)c1 ZINC001203746854 1133364477 /nfs/dbraw/zinc/36/44/77/1133364477.db2.gz XWYIPVNIDAFBNG-UHFFFAOYSA-N 1 0 281.399 3.876 20 10 CHCDRO COc1ccc(C[NH2+]CC[C@H]2CCC(C)(C)CO2)cc1C ZINC001203865493 1133377098 /nfs/dbraw/zinc/37/70/98/1133377098.db2.gz XEKHIAQNFBTXRV-MRXNPFEDSA-N 1 0 291.435 3.689 20 10 CHCDRO Cc1cccc([C@H]2CCC[N@@H+]2Cc2ccc(O)c(O)c2)c1 ZINC001203873290 1133378889 /nfs/dbraw/zinc/37/88/89/1133378889.db2.gz BFMGTBGIEZNOAF-MRXNPFEDSA-N 1 0 283.371 3.743 20 10 CHCDRO CCN(CC)c1ccc(C[NH+]2CCC(SC)CC2)cc1 ZINC001203939167 1133386553 /nfs/dbraw/zinc/38/65/53/1133386553.db2.gz MHKQUKSZBTXFQK-UHFFFAOYSA-N 1 0 292.492 3.860 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCCC[C@@H]2COC)cc1 ZINC001203940788 1133386468 /nfs/dbraw/zinc/38/64/68/1133386468.db2.gz ZIEAWYUOYKXOES-GOSISDBHSA-N 1 0 290.451 3.534 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2C[C@@H]3C[C@H]2C[C@@H]3F)c2ccccc21 ZINC001204240340 1133423738 /nfs/dbraw/zinc/42/37/38/1133423738.db2.gz PFPNTRURXFJONL-MPGHIAIKSA-N 1 0 298.405 3.838 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H]2CF)c2ccccc21 ZINC001204241165 1133424585 /nfs/dbraw/zinc/42/45/85/1133424585.db2.gz YITQVXMKCKWTHE-OAHLLOKOSA-N 1 0 286.394 3.840 20 10 CHCDRO Oc1ccc(C[NH+]2CCC(Cc3ccccc3)CC2)c(O)c1 ZINC001204272777 1133426893 /nfs/dbraw/zinc/42/68/93/1133426893.db2.gz RUGNMAODAPVBLH-UHFFFAOYSA-N 1 0 297.398 3.553 20 10 CHCDRO C[C@H]1CCC[N@H+](Cc2ccc(N3CCCC3)cc2)CC1 ZINC001204324925 1133437720 /nfs/dbraw/zinc/43/77/20/1133437720.db2.gz PKKHSRXRPSDYES-INIZCTEOSA-N 1 0 272.436 3.909 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[NH+]1CC2(C1)CCCC2 ZINC001204326344 1133438584 /nfs/dbraw/zinc/43/85/84/1133438584.db2.gz XEYXMDHAEVQKCZ-UHFFFAOYSA-N 1 0 270.420 3.663 20 10 CHCDRO CCc1cccc(C[N@H+](C)Cc2ccccc2F)c1O ZINC001204714658 1133478348 /nfs/dbraw/zinc/47/83/48/1133478348.db2.gz XESOYZXAXDGOCU-UHFFFAOYSA-N 1 0 273.351 3.726 20 10 CHCDRO CCC[C@@H](C[N@H+](Cc1ccccc1O)C1CCCC1)OC ZINC001204923353 1133500149 /nfs/dbraw/zinc/50/01/49/1133500149.db2.gz KUJHFNJBBCJQAQ-KRWDZBQOSA-N 1 0 291.435 3.952 20 10 CHCDRO COc1cc(C)cc(C[NH+]2CC(C)(C)CC(C)(C)C2)c1O ZINC001205237713 1133548440 /nfs/dbraw/zinc/54/84/40/1133548440.db2.gz NKVXOZZUXIWVHH-UHFFFAOYSA-N 1 0 291.435 3.967 20 10 CHCDRO C[C@@H]1CC[C@H]([NH2+]Cc2ccc3c(c2)CCO3)C[C@@H]1C ZINC000085041965 1133584791 /nfs/dbraw/zinc/58/47/91/1133584791.db2.gz SGSUOSCKQZCNRU-WWGRRREGSA-N 1 0 259.393 3.536 20 10 CHCDRO COc1cc(C)cc(C[NH2+]CC[C@@H](C)c2ccccc2)c1O ZINC001205556001 1133588008 /nfs/dbraw/zinc/58/80/08/1133588008.db2.gz ZKWRYAXKENRXJP-OAHLLOKOSA-N 1 0 299.414 3.993 20 10 CHCDRO CCC[C@@]1(CO)CCC[N@@H+]1Cc1cc(C(C)C)ccc1O ZINC001205589535 1133591491 /nfs/dbraw/zinc/59/14/91/1133591491.db2.gz QKBNOYMEGCODME-SFHVURJKSA-N 1 0 291.435 3.643 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H](C)CC1CCC1 ZINC001205656126 1133599956 /nfs/dbraw/zinc/59/99/56/1133599956.db2.gz MTQJDAKYZLDKKQ-AWEZNQCLSA-N 1 0 260.425 3.940 20 10 CHCDRO Cc1nc(C)c(C[N@@H+](C)Cc2ccc(N3CCCC3)cc2)o1 ZINC001205708967 1133604740 /nfs/dbraw/zinc/60/47/40/1133604740.db2.gz MVVIHXOMTWIAAN-UHFFFAOYSA-N 1 0 299.418 3.524 20 10 CHCDRO Cc1cccnc1C[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001205793705 1133613958 /nfs/dbraw/zinc/61/39/58/1133613958.db2.gz ZWUAYVOHNBQRFG-UHFFFAOYSA-N 1 0 295.430 3.622 20 10 CHCDRO Nc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)cc1 ZINC001206049659 1133649509 /nfs/dbraw/zinc/64/95/09/1133649509.db2.gz QHMVFEQJJNSTOA-QGZVFWFLSA-N 1 0 270.351 3.745 20 10 CHCDRO CCC1C[NH+](Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC001206159870 1133665383 /nfs/dbraw/zinc/66/53/83/1133665383.db2.gz UDCKSDIXGGGQDP-UHFFFAOYSA-N 1 0 286.341 3.613 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@]1(C)CC=CCC1 ZINC001206240051 1133674612 /nfs/dbraw/zinc/67/46/12/1133674612.db2.gz RZQZDKXUQHQEIY-KRWDZBQOSA-N 1 0 258.409 3.649 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+][C@@H]2C[C@H]2CC(C)(C)C)c1O ZINC001206568217 1133719741 /nfs/dbraw/zinc/71/97/41/1133719741.db2.gz KEDUTUBSSJWICG-GXFFZTMASA-N 1 0 297.826 3.969 20 10 CHCDRO Cc1ccc(CNc2[nH+]ccc(C)c2C2CC2)c(O)c1 ZINC001206590087 1133723703 /nfs/dbraw/zinc/72/37/03/1133723703.db2.gz IMMGMIYUXNNOBE-UHFFFAOYSA-N 1 0 268.360 3.894 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2ccc3occc3c2)c(O)c1 ZINC001206605181 1133726755 /nfs/dbraw/zinc/72/67/55/1133726755.db2.gz MSKISXFBHXAWRQ-UHFFFAOYSA-N 1 0 267.328 3.737 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)CC2(c3ccccc3)CC2)cc1 ZINC001207839909 1133852976 /nfs/dbraw/zinc/85/29/76/1133852976.db2.gz YSTXVISFAKRKEX-UHFFFAOYSA-N 1 0 294.442 3.916 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)CC1(c2ccccc2)CC1 ZINC001207839187 1133853071 /nfs/dbraw/zinc/85/30/71/1133853071.db2.gz ITFSSLRNAFKRKV-UHFFFAOYSA-N 1 0 281.399 3.946 20 10 CHCDRO CC/C=C\CC[N@H+](CC)Cc1ccc(N(C)C)cc1 ZINC001208734571 1133937107 /nfs/dbraw/zinc/93/71/07/1133937107.db2.gz PXUTUYMTADALCE-FPLPWBNLSA-N 1 0 260.425 3.931 20 10 CHCDRO Oc1cccc2c1C[N@H+](CCc1ccc(Cl)cc1)CC2 ZINC001208741598 1133939967 /nfs/dbraw/zinc/93/99/67/1133939967.db2.gz GKJNMWCMMYFNQN-UHFFFAOYSA-N 1 0 287.790 3.646 20 10 CHCDRO CC(=O)[C@H]1CC[N@H+](Cc2ccc(-n3c(C)ccc3C)cc2)C1 ZINC001209519695 1134034733 /nfs/dbraw/zinc/03/47/33/1134034733.db2.gz FLECPAMIBHTMKC-SFHVURJKSA-N 1 0 296.414 3.505 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+]CCc1ncccc1C ZINC000404991527 1134954152 /nfs/dbraw/zinc/95/41/52/1134954152.db2.gz KAHHFIJRJJSZCC-UHFFFAOYSA-N 1 0 293.414 3.522 20 10 CHCDRO O=C1C=CC=CC1=NNc1ccccc1OC1CC[NH2+]CC1 ZINC001217964425 1135032481 /nfs/dbraw/zinc/03/24/81/1135032481.db2.gz YGPQQPKHFCAOFQ-FMQUCBEESA-N 1 0 297.358 3.938 20 10 CHCDRO Cc1ccoc1C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC000312869629 1135135844 /nfs/dbraw/zinc/13/58/44/1135135844.db2.gz UAMXUMWBHZQOBI-OLZOCXBDSA-N 1 0 271.360 3.940 20 10 CHCDRO CCOc1cccc(C[NH2+][C@H](C)c2ccc(C#N)cc2)c1O ZINC000315527999 1135156391 /nfs/dbraw/zinc/15/63/91/1135156391.db2.gz VEVLKZUXBGTUBS-CYBMUJFWSA-N 1 0 296.370 3.513 20 10 CHCDRO C[C@H]([NH2+]CCCOc1ccccc1)c1ccc(N(C)C)cc1 ZINC000315671546 1135158302 /nfs/dbraw/zinc/15/83/02/1135158302.db2.gz WKKLVHUZKVOXGU-INIZCTEOSA-N 1 0 298.430 3.872 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)CCc2ccco2)cc1C ZINC000035052676 260006360 /nfs/dbraw/zinc/00/63/60/260006360.db2.gz AJUQDVQQTYLZOH-CQSZACIVSA-N 1 0 273.376 3.708 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]C2CCCCCC2)c1 ZINC000020122636 171003386 /nfs/dbraw/zinc/00/33/86/171003386.db2.gz ZJICBTPVGGEMBL-LBPRGKRZSA-N 1 0 263.381 3.774 20 10 CHCDRO COc1ccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2)cc1 ZINC000020146066 171031760 /nfs/dbraw/zinc/03/17/60/171031760.db2.gz XQMNENCFWNKABT-CQSZACIVSA-N 1 0 284.403 3.612 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2)o1 ZINC000020146070 171031831 /nfs/dbraw/zinc/03/18/31/171031831.db2.gz QFGZJVFXQLZGNI-ZDUSSCGKSA-N 1 0 258.365 3.505 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2c(C)noc2C)cc1 ZINC000153921203 261084834 /nfs/dbraw/zinc/08/48/34/261084834.db2.gz MNVODEWDNMYXQZ-LBPRGKRZSA-N 1 0 287.407 3.598 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(Cl)cn1)c1ccccc1O ZINC000155205920 261099380 /nfs/dbraw/zinc/09/93/80/261099380.db2.gz NZADKPYQMSQAQM-AWEZNQCLSA-N 1 0 276.767 3.682 20 10 CHCDRO CC[C@H]([NH2+]CCC[C@@H]1CCCCO1)c1ccccc1O ZINC000158114936 261158719 /nfs/dbraw/zinc/15/87/19/261158719.db2.gz AWYNCXORBDEHBF-HOCLYGCPSA-N 1 0 277.408 3.782 20 10 CHCDRO COCCCC[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000158312785 261163582 /nfs/dbraw/zinc/16/35/82/261163582.db2.gz YBWVMBGXMFIBEF-MRXNPFEDSA-N 1 0 290.451 3.754 20 10 CHCDRO Oc1ccccc1C[N@H+](CCC(F)(F)F)CC1CC1 ZINC000179585630 261800393 /nfs/dbraw/zinc/80/03/93/261800393.db2.gz MRMNUNRFQMHFIU-UHFFFAOYSA-N 1 0 273.298 3.557 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccco1)c1cc2c(cc1O)CCCC2 ZINC000184843408 262030640 /nfs/dbraw/zinc/03/06/40/262030640.db2.gz VHKKFEMRXGPOLM-GFCCVEGCSA-N 1 0 271.360 3.715 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCCCNc2ccccn2)c1 ZINC000185325383 262050630 /nfs/dbraw/zinc/05/06/30/262050630.db2.gz PRXFICFHYRKVGX-OAHLLOKOSA-N 1 0 299.418 3.639 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](CCCO)c2ccccc2)c1 ZINC000185532086 262058907 /nfs/dbraw/zinc/05/89/07/262058907.db2.gz KIUFWTGEGCQBMI-QAPCUYQASA-N 1 0 299.414 3.865 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1[C@@H]2CCO[C@@H]2C1(C)C)c1cc(Cl)ccc1O ZINC000185534247 262059125 /nfs/dbraw/zinc/05/91/25/262059125.db2.gz KQRHFUGRCSJOEH-QFEPDWEUSA-N 1 0 295.810 3.510 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CC2(CCO)CCCCC2)c1 ZINC000185669240 262065181 /nfs/dbraw/zinc/06/51/81/262065181.db2.gz LDFIHYFNAFRRCP-HNNXBMFYSA-N 1 0 291.435 3.684 20 10 CHCDRO C[C@@H]([NH2+]CCCc1ccccn1)c1cc(Cl)ccc1O ZINC000186140583 262080805 /nfs/dbraw/zinc/08/08/05/262080805.db2.gz HSEPBPUFEPTIFA-GFCCVEGCSA-N 1 0 290.794 3.724 20 10 CHCDRO COCCC1(C[NH2+][C@H](C)c2cc(Cl)ccc2O)CC1 ZINC000186133907 262081336 /nfs/dbraw/zinc/08/13/36/262081336.db2.gz PESLXTRHDXQREW-LLVKDONJSA-N 1 0 283.799 3.513 20 10 CHCDRO C/C=C/C[C@@H](CO)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000186519426 262096343 /nfs/dbraw/zinc/09/63/43/262096343.db2.gz QSZKQLBNYLOJNH-LNMOPNHASA-N 1 0 285.387 3.523 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(C(C)(C)O)cc1)c1ccccc1O ZINC000186602834 262101504 /nfs/dbraw/zinc/10/15/04/262101504.db2.gz APFDNCDCKOVMTG-KRWDZBQOSA-N 1 0 299.414 3.861 20 10 CHCDRO Cc1cnc([C@@H](C)C[NH2+][C@@H](C)c2cc(C)ccc2O)s1 ZINC000186766213 262109306 /nfs/dbraw/zinc/10/93/06/262109306.db2.gz ZYIXKVVLSNVZNA-AAEUAGOBSA-N 1 0 290.432 3.920 20 10 CHCDRO CC[C@H]([NH2+]CCCCCSC)c1ccccc1O ZINC000186771018 262109628 /nfs/dbraw/zinc/10/96/28/262109628.db2.gz NRWDXCZFBKZQFH-AWEZNQCLSA-N 1 0 267.438 3.966 20 10 CHCDRO CCc1ccc(C[NH2+][C@@H](C)c2cc(OC)ccc2O)s1 ZINC000185026429 262301152 /nfs/dbraw/zinc/30/11/52/262301152.db2.gz WPFVTKPRKZXXCT-NSHDSACASA-N 1 0 291.416 3.876 20 10 CHCDRO C[C@H]([NH2+]CCc1cc(F)cc(F)c1)c1ccccc1O ZINC000060717651 262391671 /nfs/dbraw/zinc/39/16/71/262391671.db2.gz FPXPTKRWUAQYHG-NSHDSACASA-N 1 0 277.314 3.564 20 10 CHCDRO Cc1ccncc1[C@H](C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000271561293 262997142 /nfs/dbraw/zinc/99/71/42/262997142.db2.gz VZOFCLVONFQRLV-INIZCTEOSA-N 1 0 295.430 3.841 20 10 CHCDRO C[C@@H]([NH2+]CCc1cccc(F)c1F)c1ccccc1O ZINC000272837245 263009252 /nfs/dbraw/zinc/00/92/52/263009252.db2.gz IWDQFDOWJSKGJD-LLVKDONJSA-N 1 0 277.314 3.564 20 10 CHCDRO Cc1ccc2c(c1C)OC[C@H]2[NH2+][C@H]1CCc2cccc(O)c21 ZINC000297056654 263200371 /nfs/dbraw/zinc/20/03/71/263200371.db2.gz VTHZHXGSVLNAJL-JKSUJKDBSA-N 1 0 295.382 3.720 20 10 CHCDRO Cc1cccc(C[NH2+]C[C@H]2CC[C@H](c3ccccc3)O2)c1O ZINC000367684277 267108762 /nfs/dbraw/zinc/10/87/62/267108762.db2.gz HPIKBKUNZDKEQP-QZTJIDSGSA-N 1 0 297.398 3.711 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCc2ccc(Cl)nc2)c(O)c1 ZINC000185751283 327844144 /nfs/dbraw/zinc/84/41/44/327844144.db2.gz FRAFFKLQPLUXSS-GFCCVEGCSA-N 1 0 290.794 3.642 20 10 CHCDRO COCCC1(C[NH2+][C@@H](C)c2cc(C)ccc2O)CCCC1 ZINC000185747408 327844263 /nfs/dbraw/zinc/84/42/63/327844263.db2.gz UXPKSZKKMSVKTL-HNNXBMFYSA-N 1 0 291.435 3.948 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(F)ccc1O)c1ccccc1 ZINC000083432499 326936349 /nfs/dbraw/zinc/93/63/49/326936349.db2.gz JAVWMJDDXILLSH-HNNXBMFYSA-N 1 0 259.324 3.772 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H]2CCOc3c(C)cccc32)c1 ZINC000188879350 329373940 /nfs/dbraw/zinc/37/39/40/329373940.db2.gz ZIVJYROHIHGEEH-MRXNPFEDSA-N 1 0 283.371 3.622 20 10 CHCDRO Cc1cccc2c1OCC[C@H]2[NH2+]Cc1ccc2c(c1)CCO2 ZINC000188881192 329374165 /nfs/dbraw/zinc/37/41/65/329374165.db2.gz MWBXITRCZKKNRT-QGZVFWFLSA-N 1 0 295.382 3.543 20 10 CHCDRO CN(C)c1ccc(C[NH+]2CCC(c3ccncc3)CC2)cc1 ZINC000193583557 329531289 /nfs/dbraw/zinc/53/12/89/329531289.db2.gz CKTXPHAUJYXWQC-UHFFFAOYSA-N 1 0 295.430 3.527 20 10 CHCDRO CC[C@H]([NH2+]Cc1cccnc1C)c1ccc(C)cc1O ZINC000527984778 330298535 /nfs/dbraw/zinc/29/85/35/330298535.db2.gz DRDVBCPGSRQQCP-INIZCTEOSA-N 1 0 270.376 3.645 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+][C@@H]1CCSc2ccccc21 ZINC000226582086 333265249 /nfs/dbraw/zinc/26/52/49/333265249.db2.gz BXNYWCHNTLRGID-CQSZACIVSA-N 1 0 289.375 3.858 20 10 CHCDRO CC(C)[C@@H](CCO)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000230664216 333320037 /nfs/dbraw/zinc/32/00/37/333320037.db2.gz SVLDXMFOWJHGCX-SUMWQHHRSA-N 1 0 287.403 3.603 20 10 CHCDRO C[C@@H](CO)CCC[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000230669755 333320326 /nfs/dbraw/zinc/32/03/26/333320326.db2.gz PIUWDLMAGWQSDW-KGLIPLIRSA-N 1 0 287.403 3.605 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@@H]2CCSC2)cc1 ZINC000280208434 520283590 /nfs/dbraw/zinc/28/35/90/520283590.db2.gz VZDGMEOXBGCOKH-KGLIPLIRSA-N 1 0 278.465 3.546 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2ccccn2)cc1 ZINC000020123843 520910337 /nfs/dbraw/zinc/91/03/37/520910337.db2.gz RACMQQBAJKQTTO-OAHLLOKOSA-N 1 0 283.419 3.779 20 10 CHCDRO CCCc1nc(C)c(C[NH2+][C@H](C)c2ccc(C)cc2O)o1 ZINC000293276045 521499193 /nfs/dbraw/zinc/49/91/93/521499193.db2.gz CPJZUDLYWUNRLG-GFCCVEGCSA-N 1 0 288.391 3.800 20 10 CHCDRO CC[C@H](CCO)C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000094936317 522146659 /nfs/dbraw/zinc/14/66/59/522146659.db2.gz BAEKVJVUDXQGJY-ZIAGYGMSSA-N 1 0 287.403 3.605 20 10 CHCDRO CC[C@H]([NH2+]CC1(CCOC)CC1)c1ccc(C)cc1O ZINC000280030457 522574110 /nfs/dbraw/zinc/57/41/10/522574110.db2.gz IAPLEJVUBZRYKB-HNNXBMFYSA-N 1 0 277.408 3.558 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccccc1O)c1ccc(OC)cc1 ZINC000037062609 522656177 /nfs/dbraw/zinc/65/61/77/522656177.db2.gz PFVBKAFPRKRIRY-INIZCTEOSA-N 1 0 271.360 3.642 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccccc1)c1ccc(C)cc1O ZINC000280221002 522656262 /nfs/dbraw/zinc/65/62/62/522656262.db2.gz USONZRXMGAJUNX-INIZCTEOSA-N 1 0 255.361 3.942 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)C1CCOCC1)c1ccc(N(C)C)cc1 ZINC000126181198 522689371 /nfs/dbraw/zinc/68/93/71/522689371.db2.gz IPSCVVZBDWTYPB-KSSFIOAISA-N 1 0 290.451 3.608 20 10 CHCDRO CC[C@@H]([NH2+]CC1(CCOC)CC1)c1ccc(C)cc1O ZINC000280030460 522818946 /nfs/dbraw/zinc/81/89/46/522818946.db2.gz IAPLEJVUBZRYKB-OAHLLOKOSA-N 1 0 277.408 3.558 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(Cl)nc1)c1ccc(C)cc1O ZINC000280235188 522875664 /nfs/dbraw/zinc/87/56/64/522875664.db2.gz VMMUWUDDIAZZME-CQSZACIVSA-N 1 0 290.794 3.990 20 10 CHCDRO CC[C@H](c1ccncc1)[N@H+](C)Cc1cc(C)ccc1O ZINC000290557638 522967783 /nfs/dbraw/zinc/96/77/83/522967783.db2.gz SECUUHOCXZHXDJ-MRXNPFEDSA-N 1 0 270.376 3.679 20 10 CHCDRO COCCC(C)(C)C[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000274187371 522987981 /nfs/dbraw/zinc/98/79/81/522987981.db2.gz JNUOJYVXSJHSQO-CQSZACIVSA-N 1 0 279.424 3.722 20 10 CHCDRO CO[C@](C)(C[NH2+][C@@H](C)c1cc(Cl)ccc1O)C1CC1 ZINC000291207760 524027812 /nfs/dbraw/zinc/02/78/12/524027812.db2.gz MNQLGYFJAMPGGB-ZUZCIYMTSA-N 1 0 283.799 3.511 20 10 CHCDRO COc1ccc(F)cc1[C@@H](C)[NH2+][C@@H](C)c1ccccc1O ZINC000037089975 524329812 /nfs/dbraw/zinc/32/98/12/524329812.db2.gz FGUOKRHABNFKMW-NWDGAFQWSA-N 1 0 289.350 3.952 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)c2cc(C)ccc2O)s1 ZINC000050225242 524591714 /nfs/dbraw/zinc/59/17/14/524591714.db2.gz NQJDDIMULQYRJA-LBPRGKRZSA-N 1 0 261.390 3.921 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2sccc2C)c1 ZINC000094874954 524765038 /nfs/dbraw/zinc/76/50/38/524765038.db2.gz XQNBTALVGXCQCL-LLVKDONJSA-N 1 0 277.389 3.622 20 10 CHCDRO C[C@@H](Cc1cccs1)[NH2+][C@@H](C)c1ccccc1O ZINC000036993102 524933222 /nfs/dbraw/zinc/93/32/22/524933222.db2.gz MTBDAUBWCHPXFY-RYUDHWBXSA-N 1 0 261.390 3.736 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(F)cc1F)c1ccc(N(C)C)cc1 ZINC000051016883 525524575 /nfs/dbraw/zinc/52/45/75/525524575.db2.gz GNMWDNCGCGGIFZ-GFCCVEGCSA-N 1 0 290.357 3.882 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)c1cccnc1)c1ccc(N(C)C)cc1 ZINC000037228905 525536986 /nfs/dbraw/zinc/53/69/86/525536986.db2.gz XJJFHFZFAHXKGX-KBPBESRZSA-N 1 0 269.392 3.559 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1cccnc1 ZINC000037228907 525608190 /nfs/dbraw/zinc/60/81/90/525608190.db2.gz XJJFHFZFAHXKGX-UONOGXRCSA-N 1 0 269.392 3.559 20 10 CHCDRO Cc1ccoc1C[NH2+]Cc1cc(Cl)cc(C)c1O ZINC000292848475 525805608 /nfs/dbraw/zinc/80/56/08/525805608.db2.gz SYIBNOGKROHVRU-UHFFFAOYSA-N 1 0 265.740 3.545 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC(C)(C)c2ccccn2)c(O)c1 ZINC000297477653 525916834 /nfs/dbraw/zinc/91/68/34/525916834.db2.gz ZAFOUKOVRMLPFH-AWEZNQCLSA-N 1 0 284.403 3.724 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C2CCSCC2)c(O)c1C ZINC000273528080 525917095 /nfs/dbraw/zinc/91/70/95/525917095.db2.gz VRJNCLWRZIXDMW-LBPRGKRZSA-N 1 0 265.422 3.555 20 10 CHCDRO COc1cccc(C[NH2+]C2CC(c3ccc(C)cc3)C2)c1O ZINC000289417052 526010975 /nfs/dbraw/zinc/01/09/75/526010975.db2.gz IPVJLCFZSUBIKI-UHFFFAOYSA-N 1 0 297.398 3.745 20 10 CHCDRO FC1(F)CC([NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000277601031 526274044 /nfs/dbraw/zinc/27/40/44/526274044.db2.gz IPLYYHFERAWGBW-UHFFFAOYSA-N 1 0 280.362 3.564 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000127428115 526364068 /nfs/dbraw/zinc/36/40/68/526364068.db2.gz QKFHNVMMTFPMDZ-AWEZNQCLSA-N 1 0 276.767 3.711 20 10 CHCDRO Cc1noc(C)c1[C@H](C)C[NH2+]Cc1c(O)cccc1Cl ZINC000128451057 526576661 /nfs/dbraw/zinc/57/66/61/526576661.db2.gz RZYHQWCRCOMJFL-SECBINFHSA-N 1 0 294.782 3.544 20 10 CHCDRO C[C@@H](c1ccc(F)cc1)[N@H+](C)Cc1ccccc1O ZINC000109772796 1125469591 /nfs/dbraw/zinc/46/95/91/1125469591.db2.gz AQNCPDDOYUYUNL-LBPRGKRZSA-N 1 0 259.324 3.724 20 10 CHCDRO CCOc1cccc(C[N@H+](C)CC2CCCCC2)c1O ZINC000133574332 1125475704 /nfs/dbraw/zinc/47/57/04/1125475704.db2.gz KETSVUWADTWTBK-UHFFFAOYSA-N 1 0 277.408 3.803 20 10 CHCDRO CN(Cc1csc(C(C)(C)C)n1)Cc1ccccc1O ZINC000111235225 1125481379 /nfs/dbraw/zinc/48/13/79/1125481379.db2.gz ZOXPUTLEFUQARG-UHFFFAOYSA-N 1 0 290.432 3.778 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccc(C)o1)c1ccccc1O ZINC000689792758 1120380010 /nfs/dbraw/zinc/38/00/10/1120380010.db2.gz GFQPEMIDSUSPTP-HNNXBMFYSA-N 1 0 259.349 3.577 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@@H](CCF)C1 ZINC000689882082 1120436247 /nfs/dbraw/zinc/43/62/47/1120436247.db2.gz MDZMFWIIDATQAV-NSHDSACASA-N 1 0 271.763 3.617 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C2(C)CC(F)(F)C2)cc1Cl ZINC000877833283 1121755284 /nfs/dbraw/zinc/75/52/84/1121755284.db2.gz FKTQNCCTTZBFTP-UHFFFAOYSA-N 1 0 275.726 3.631 20 10 CHCDRO CCC(CC)[C@@H](O)C[NH2+][C@H](CC)c1cc(Cl)ccc1O ZINC000775503160 1122630641 /nfs/dbraw/zinc/63/06/41/1122630641.db2.gz CTLRWNNUFFIVTQ-ZBFHGGJFSA-N 1 0 299.842 3.883 20 10 CHCDRO Cc1ccc(C[N@@H+](C)[C@@H](C)c2cccs2)c(O)c1 ZINC000876589790 1124964347 /nfs/dbraw/zinc/96/43/47/1124964347.db2.gz OUMCMDIQHBKZJY-LBPRGKRZSA-N 1 0 261.390 3.955 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(C)cc2O)s1 ZINC000876964798 1124992803 /nfs/dbraw/zinc/99/28/03/1124992803.db2.gz QKJCAGQEHONVTJ-LBPRGKRZSA-N 1 0 261.390 3.921 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CC2CCSCC2)cc1Cl ZINC000825260273 1131504496 /nfs/dbraw/zinc/50/44/96/1131504496.db2.gz OPXGOCYKAVRNBJ-UHFFFAOYSA-N 1 0 285.840 3.587 20 10 CHCDRO C[C@@]1(CC[NH2+]Cc2cc(Cl)ccc2O)C[C@@]1(F)Cl ZINC000846036670 1131681902 /nfs/dbraw/zinc/68/19/02/1131681902.db2.gz NLYIBLYLXULRMR-OLZOCXBDSA-N 1 0 292.181 3.840 20 10 CHCDRO C[C@@]1(C[NH2+][C@@H]2CCc3cccc(O)c32)CC1(Cl)Cl ZINC000834884051 1131717294 /nfs/dbraw/zinc/71/72/94/1131717294.db2.gz IRVJOGHYFHNFAC-MFKMUULPSA-N 1 0 286.202 3.553 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CCS[C@@H]2C)cc1 ZINC000842926923 1132475512 /nfs/dbraw/zinc/47/55/12/1132475512.db2.gz BEWKNZYZNQPNMD-WOSRLPQWSA-N 1 0 278.465 3.687 20 10 CHCDRO CC1CC([N@H+](C)Cc2cccc(C(C)(C)C)c2O)C1 ZINC001143103642 1132501233 /nfs/dbraw/zinc/50/12/33/1132501233.db2.gz IHGWJMDCJWMGCW-UHFFFAOYSA-N 1 0 261.409 3.920 20 10 CHCDRO C[C@@H]1C[C@@H](C)CC[N@@H+]1Cc1c(O)cccc1Cl ZINC000133736688 1132604638 /nfs/dbraw/zinc/60/46/38/1132604638.db2.gz SGLNQFCQLWLWRT-WDEREUQCSA-N 1 0 253.773 3.666 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@H](C(F)F)C1 ZINC001203657424 1133349816 /nfs/dbraw/zinc/34/98/16/1133349816.db2.gz KWPGIFOOWDZPCE-VIFPVBQESA-N 1 0 275.726 3.523 20 10 CHCDRO Oc1ccccc1C[NH2+]C[C@H]1CCCc2ccccc21 ZINC000134226012 1125543896 /nfs/dbraw/zinc/54/38/96/1125543896.db2.gz JZYNXWFITCLBAP-OAHLLOKOSA-N 1 0 267.372 3.602 20 10 CHCDRO Oc1ccccc1C[NH2+]Cc1ccc(F)cc1C(F)(F)F ZINC000134226541 1125544750 /nfs/dbraw/zinc/54/47/50/1125544750.db2.gz ULTSONDEROUBRP-UHFFFAOYSA-N 1 0 299.267 3.840 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@H]2CCCC[C@H]2C(C)C)c1 ZINC000214933532 1125547597 /nfs/dbraw/zinc/54/75/97/1125547597.db2.gz NVVHAGFYXIWMRZ-HOTGVXAUSA-N 1 0 277.408 3.705 20 10 CHCDRO C[C@H](Cc1ccco1)[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841743613 1125568590 /nfs/dbraw/zinc/56/85/90/1125568590.db2.gz IRSLPNZIVHZYNZ-MNOVXSKESA-N 1 0 279.767 3.920 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CC2CCSCC2)cc1 ZINC000134612138 1125565220 /nfs/dbraw/zinc/56/52/20/1125565220.db2.gz NTLYVMPUIDRAEH-UHFFFAOYSA-N 1 0 292.492 3.766 20 10 CHCDRO COc1ccc(C[NH2+]C2(c3ccc(F)cc3)CC2)cc1C ZINC000729685999 1125570582 /nfs/dbraw/zinc/57/05/82/1125570582.db2.gz ZMNYNFTVVKMOAB-UHFFFAOYSA-N 1 0 285.362 3.922 20 10 CHCDRO CC[C@H](C[NH2+][C@H](C)c1ccc(Cl)cc1[O-])N1CCCC1 ZINC000841746228 1125571074 /nfs/dbraw/zinc/57/10/74/1125571074.db2.gz WFZMOZYWQBVEDD-TZMCWYRMSA-N 1 0 296.842 3.571 20 10 CHCDRO Cc1coc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)c1 ZINC000886070766 1125645211 /nfs/dbraw/zinc/64/52/11/1125645211.db2.gz XDAKXLPATWDHLB-CYBMUJFWSA-N 1 0 258.365 3.505 20 10 CHCDRO Cc1ccc([C@@H](C)C[NH2+]Cc2cc(C)ccc2O)cc1 ZINC000237355719 1125646920 /nfs/dbraw/zinc/64/69/20/1125646920.db2.gz NRXFXDWVGSXFEB-HNNXBMFYSA-N 1 0 269.388 3.902 20 10 CHCDRO Cc1ccccc1[C@@H](C)[N@H+](C)Cc1ccccc1O ZINC000137278390 1125657281 /nfs/dbraw/zinc/65/72/81/1125657281.db2.gz VVEHKOLCSQTJQO-CQSZACIVSA-N 1 0 255.361 3.894 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCCC2(C)C)c1 ZINC000094321595 1129442844 /nfs/dbraw/zinc/44/28/44/1129442844.db2.gz BBHUUZUMGPHOJU-XHDPSFHLSA-N 1 0 263.381 3.630 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc([C@H](C)O)cc1)c1ccc(N(C)C)cc1 ZINC000178546999 1126816377 /nfs/dbraw/zinc/81/63/77/1126816377.db2.gz KIXBMOWSJJGNCK-CABCVRRESA-N 1 0 298.430 3.657 20 10 CHCDRO O=C(C[C@H]1CCC[N@H+]1Cc1ccccc1O)c1ccccc1 ZINC000179580176 1126830939 /nfs/dbraw/zinc/83/09/39/1126830939.db2.gz GAWAOEMWSXRRBI-QGZVFWFLSA-N 1 0 295.382 3.630 20 10 CHCDRO C[C@H](c1cccs1)[N@H+](C)Cc1cc(F)ccc1O ZINC000179935616 1126836850 /nfs/dbraw/zinc/83/68/50/1126836850.db2.gz PKFXDMQKKHZUSV-SNVBAGLBSA-N 1 0 265.353 3.786 20 10 CHCDRO Cc1csc(CCCC[NH2+][C@@H](C)c2ccccc2O)n1 ZINC000183485548 1126887470 /nfs/dbraw/zinc/88/74/70/1126887470.db2.gz XLFWIPYFQAKDSO-ZDUSSCGKSA-N 1 0 290.432 3.831 20 10 CHCDRO COCCC1(C[NH2+][C@@H](C)c2ccccc2O)CCCC1 ZINC000183560731 1126888322 /nfs/dbraw/zinc/88/83/22/1126888322.db2.gz LVTGWIRQNNKVAP-AWEZNQCLSA-N 1 0 277.408 3.640 20 10 CHCDRO C[C@H]([NH2+][C@H](CCCO)c1ccccc1)c1ccccc1O ZINC000183527385 1126888454 /nfs/dbraw/zinc/88/84/54/1126888454.db2.gz IAMRWERTWKTRCU-WMLDXEAASA-N 1 0 285.387 3.557 20 10 CHCDRO C[C@H](C[NH2+][C@H](C)c1ccccc1O)Oc1ccccc1 ZINC000183605596 1126889316 /nfs/dbraw/zinc/88/93/16/1126889316.db2.gz UHGRBRQGDOXHSO-ZIAGYGMSSA-N 1 0 271.360 3.510 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC[C@](C)(O)c2ccccc2)c(O)c1 ZINC000187927048 1126917708 /nfs/dbraw/zinc/91/77/08/1126917708.db2.gz MGJOUWPESOIRTI-KXBFYZLASA-N 1 0 299.414 3.649 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+][C@H](C)c2cccc(O)c2)c1O ZINC000192035468 1126957587 /nfs/dbraw/zinc/95/75/87/1126957587.db2.gz UCKIJBNJZQJFNQ-LLVKDONJSA-N 1 0 291.778 3.910 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2CCCNc3ccccc32)cc1 ZINC000192616241 1126962538 /nfs/dbraw/zinc/96/25/38/1126962538.db2.gz QWGQQMMHZDGYAA-LJQANCHMSA-N 1 0 295.430 3.789 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)C2CCCCCC2)c(O)c1 ZINC000149790015 1127025366 /nfs/dbraw/zinc/02/53/66/1127025366.db2.gz JKMJQFWBMJIEFZ-ZDUSSCGKSA-N 1 0 277.408 3.849 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CCO[C@@H](C(C)(C)C)C2)cc1C ZINC000270659874 1127059648 /nfs/dbraw/zinc/05/96/48/1127059648.db2.gz OCDHYHYSAGBPKQ-NVXWUHKLSA-N 1 0 291.435 3.687 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCC(C)=C(Br)C2)c1O ZINC000797604156 1130994607 /nfs/dbraw/zinc/99/46/07/1130994607.db2.gz AGZWTMZGVGDCLK-UHFFFAOYSA-N 1 0 296.208 3.575 20 10 CHCDRO CCN(CC)c1ccc(CN[C@@H](C)c2cscn2)cc1 ZINC000271113213 1127068552 /nfs/dbraw/zinc/06/85/52/1127068552.db2.gz HQOUVYWLEUUSBA-ZDUSSCGKSA-N 1 0 289.448 3.840 20 10 CHCDRO CC[C@@H]([NH2+][C@H](CCO)c1ccccc1)c1ccccc1O ZINC000155986116 1127091417 /nfs/dbraw/zinc/09/14/17/1127091417.db2.gz BEYULNZSYXFMIK-IAGOWNOFSA-N 1 0 285.387 3.557 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)CSC)c1ccc(N(C)C)cc1 ZINC000151002569 1127117494 /nfs/dbraw/zinc/11/74/94/1127117494.db2.gz FEZHVYWQFLTJBU-SWLSCSKDSA-N 1 0 266.454 3.545 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)Cc2ccc(F)c(F)c2)cc1C ZINC000913064362 1127120808 /nfs/dbraw/zinc/12/08/08/1127120808.db2.gz PZKMXZCYQQQLJE-UHFFFAOYSA-N 1 0 291.341 3.919 20 10 CHCDRO CCCCC[N@H+](C)Cc1c(O)cccc1OC(F)(F)F ZINC001237121594 1131057042 /nfs/dbraw/zinc/05/70/42/1131057042.db2.gz XZNSFUVIBJTDNQ-UHFFFAOYSA-N 1 0 291.313 3.913 20 10 CHCDRO CC[C@H](CSC)[NH2+]Cc1ccc(N(CC)CC)cc1 ZINC000163863845 1127146828 /nfs/dbraw/zinc/14/68/28/1127146828.db2.gz AOLGYMXBGKPVGL-OAHLLOKOSA-N 1 0 280.481 3.764 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](C)Oc1ccccc1)c1ccccc1O ZINC000156588545 1127160060 /nfs/dbraw/zinc/16/00/60/1127160060.db2.gz RSSOXHWJIAWPHC-YOEHRIQHSA-N 1 0 285.387 3.900 20 10 CHCDRO Cc1cccc(CCC[NH2+][C@@H](C)c2ccc(C)c(C)c2O)n1 ZINC000287292456 1127299504 /nfs/dbraw/zinc/29/95/04/1127299504.db2.gz DGUJXEICBSFCJU-INIZCTEOSA-N 1 0 298.430 3.996 20 10 CHCDRO CC[C@@H](CC(F)(F)F)[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000760902650 1127324754 /nfs/dbraw/zinc/32/47/54/1127324754.db2.gz HHFAZAHARVFUJG-WPRPVWTQSA-N 1 0 279.277 3.913 20 10 CHCDRO CC[C@H](CC(F)(F)F)[NH2+][C@@H](C)c1ccccc1O ZINC000760903765 1127325314 /nfs/dbraw/zinc/32/53/14/1127325314.db2.gz YRGTXWGIIAEOBV-VHSXEESVSA-N 1 0 261.287 3.774 20 10 CHCDRO CC(C)(C[NH2+]Cc1cc(F)ccc1O)c1ccccc1 ZINC000226584478 1127412590 /nfs/dbraw/zinc/41/25/90/1127412590.db2.gz BGCBMMGPNWBCHE-UHFFFAOYSA-N 1 0 273.351 3.599 20 10 CHCDRO CC1(C[NH2+]Cc2ccc(N3CCCCC3)cc2)CCC1 ZINC000226787185 1127425589 /nfs/dbraw/zinc/42/55/89/1127425589.db2.gz FEJPUHAOGGLNFD-UHFFFAOYSA-N 1 0 272.436 3.957 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2occc2C)cc1 ZINC000293694306 1127512977 /nfs/dbraw/zinc/51/29/77/1127512977.db2.gz NYIGJANEQUZDPO-CQSZACIVSA-N 1 0 272.392 3.895 20 10 CHCDRO Cc1cc(C[N@@H+]2CC[C@]3(C)[C@H](C2)C3(F)F)ccc1N(C)C ZINC000293700792 1127513536 /nfs/dbraw/zinc/51/35/36/1127513536.db2.gz XDISFGPGSDMVPG-JKSUJKDBSA-N 1 0 294.389 3.538 20 10 CHCDRO COc1ccc(O)c(C[NH2+]C(C)(C)c2ccccc2C)c1 ZINC000293717498 1127514889 /nfs/dbraw/zinc/51/48/89/1127514889.db2.gz SWWLXSWFUMMGED-UHFFFAOYSA-N 1 0 285.387 3.734 20 10 CHCDRO CC[N@H+](Cc1ccoc1)Cc1cc(Cl)cc(OC)c1O ZINC000761194348 1127517597 /nfs/dbraw/zinc/51/75/97/1127517597.db2.gz ZFCPERWQNRDAQD-UHFFFAOYSA-N 1 0 295.766 3.669 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@@H]2CCC[C@H]21 ZINC000228172128 1127535727 /nfs/dbraw/zinc/53/57/27/1127535727.db2.gz MTUKZRQVZJZBKJ-SMDDNHRTSA-N 1 0 265.784 3.810 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@H]2CCCSC2)c(O)c1 ZINC000294008516 1127541558 /nfs/dbraw/zinc/54/15/58/1127541558.db2.gz DENOTHUTCZRINO-ZIAGYGMSSA-N 1 0 279.449 3.803 20 10 CHCDRO CC[C@H]([NH2+]CCCc1ncccc1C)c1ccccc1O ZINC000295087196 1127619518 /nfs/dbraw/zinc/61/95/18/1127619518.db2.gz SQZMINFDYJKZTK-INIZCTEOSA-N 1 0 284.403 3.769 20 10 CHCDRO Oc1cc(O)c(C[NH+]2CCC3(CCC3)CC2)cc1Cl ZINC001232259974 1127650885 /nfs/dbraw/zinc/65/08/85/1127650885.db2.gz OCQIEJGSMJDQRF-UHFFFAOYSA-N 1 0 281.783 3.517 20 10 CHCDRO Cc1cc(C[NH2+][C@@H]2CCc3cccc(O)c32)ccc1F ZINC000295886039 1127656636 /nfs/dbraw/zinc/65/66/36/1127656636.db2.gz HXQIDADZADVWBR-OAHLLOKOSA-N 1 0 271.335 3.617 20 10 CHCDRO CC[C@H]([NH2+]CCc1scnc1C)c1ccc(C)cc1O ZINC000296390795 1127670317 /nfs/dbraw/zinc/67/03/17/1127670317.db2.gz KBENSUYUJCAVTP-AWEZNQCLSA-N 1 0 290.432 3.749 20 10 CHCDRO Cc1cc(Cl)nc(C[NH2+][C@@H]2CCc3cccc(O)c32)c1 ZINC000296495850 1127673808 /nfs/dbraw/zinc/67/38/08/1127673808.db2.gz PVIRQBBFYRPRKV-CYBMUJFWSA-N 1 0 288.778 3.526 20 10 CHCDRO CCCNc1ccc(C[NH2+][C@@H]2CCc3cccc(O)c32)cc1 ZINC000296611538 1127678662 /nfs/dbraw/zinc/67/86/62/1127678662.db2.gz YNBUSUYFFQGIKV-QGZVFWFLSA-N 1 0 296.414 3.991 20 10 CHCDRO C[C@H]([NH2+]CC1(C)CC1)c1ccc2ccccc2c1O ZINC000230668019 1127770936 /nfs/dbraw/zinc/77/09/36/1127770936.db2.gz TVBBUVGLIRLKOB-LBPRGKRZSA-N 1 0 255.361 3.996 20 10 CHCDRO CS[C@@H]1CCC[C@H]([NH2+][C@@H](C)c2cc(F)ccc2O)C1 ZINC000230662616 1127771369 /nfs/dbraw/zinc/77/13/69/1127771369.db2.gz RWLOIORZDBHVMN-WCFLWFBJSA-N 1 0 283.412 3.856 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H]2CC[C@@H](SC)C2)cc1 ZINC000230697894 1127772523 /nfs/dbraw/zinc/77/25/23/1127772523.db2.gz ZCTPGVYSOIKTQC-DOTOQJQBSA-N 1 0 292.492 3.907 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]CC2(C(C)C)CC2)c1O ZINC000230935112 1127784571 /nfs/dbraw/zinc/78/45/71/1127784571.db2.gz WXQNLTWOUYJGAN-UHFFFAOYSA-N 1 0 283.799 3.580 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)CC(F)(F)F)c1 ZINC000231790771 1127854123 /nfs/dbraw/zinc/85/41/23/1127854123.db2.gz HGPXKSMSXYSZBR-UWVGGRQHSA-N 1 0 261.287 3.692 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)CC(F)(F)F)c1ccc(N(C)C)cc1 ZINC000231790920 1127854274 /nfs/dbraw/zinc/85/42/74/1127854274.db2.gz LDRSGJIHBGMWLK-WDEREUQCSA-N 1 0 274.330 3.744 20 10 CHCDRO CN(C)c1ccc(CN2CCC[C@@H]2c2nccs2)cc1 ZINC000374302213 1127887944 /nfs/dbraw/zinc/88/79/44/1127887944.db2.gz NVLKOEOHHQZYTM-OAHLLOKOSA-N 1 0 287.432 3.546 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(C)cc(Cl)n1)c1ccccc1O ZINC000800492511 1127900042 /nfs/dbraw/zinc/90/00/42/1127900042.db2.gz JYCABQOCXLBIQD-AWEZNQCLSA-N 1 0 290.794 3.990 20 10 CHCDRO COc1ccc(C[NH2+]CC(C2CC2)C2CC2)cc1C ZINC000088456183 1127938598 /nfs/dbraw/zinc/93/85/98/1127938598.db2.gz POLJDRCXDFZIMW-UHFFFAOYSA-N 1 0 259.393 3.529 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]CCC1=CCCCC1)CC2 ZINC000311903458 1127962359 /nfs/dbraw/zinc/96/23/59/1127962359.db2.gz QDPIPFLSKXVZSW-HNNXBMFYSA-N 1 0 257.377 3.860 20 10 CHCDRO C[N@H+](Cc1ccccc1O)[C@H]1CCc2cc(F)ccc2C1 ZINC001168440946 1128067432 /nfs/dbraw/zinc/06/74/32/1128067432.db2.gz NQGVBKDWBKSSSY-KRWDZBQOSA-N 1 0 285.362 3.521 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cnn(C2CCC2)c1 ZINC000924573889 1128105697 /nfs/dbraw/zinc/10/56/97/1128105697.db2.gz LDZGIHPGNKCTJA-CQSZACIVSA-N 1 0 298.434 3.525 20 10 CHCDRO COc1ccc(O)c(C[NH2+]Cc2cc3cc(C)ccc3o2)c1 ZINC000152257845 1128112574 /nfs/dbraw/zinc/11/25/74/1128112574.db2.gz CTEAHEHSBLCKBH-UHFFFAOYSA-N 1 0 297.354 3.745 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]Cc1ccc(F)c(Cl)c1)CC2 ZINC000297495674 1129225266 /nfs/dbraw/zinc/22/52/66/1129225266.db2.gz BRMFTWYFEPIEQP-AWEZNQCLSA-N 1 0 291.753 3.962 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H](C)Cc2cccc(F)c2)c1O ZINC001168464881 1128166583 /nfs/dbraw/zinc/16/65/83/1128166583.db2.gz LZQCBEIZTBYRDX-ZDUSSCGKSA-N 1 0 273.351 3.561 20 10 CHCDRO CC(C)[C@H]1C[C@@H]([NH2+]Cc2ccc(N(C)C)c(F)c2)CS1 ZINC000754120423 1128196619 /nfs/dbraw/zinc/19/66/19/1128196619.db2.gz HVKMZNXGGMGXLV-CZUORRHYSA-N 1 0 296.455 3.511 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]([C@@H](C)C2CC2)C2CC2)cc1C ZINC000914850615 1128254101 /nfs/dbraw/zinc/25/41/01/1128254101.db2.gz MUGIUFXBHBPHTG-ZDUSSCGKSA-N 1 0 259.393 3.772 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc3c(c2)C[C@@H](C)O3)c(O)c1 ZINC000926917659 1128202196 /nfs/dbraw/zinc/20/21/96/1128202196.db2.gz CQNDVIYWGSNZDO-ZIAGYGMSSA-N 1 0 297.398 3.875 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCS[C@H](C)C1)c1ccc(N(C)C)cc1 ZINC000927032449 1128209461 /nfs/dbraw/zinc/20/94/61/1128209461.db2.gz NLAZLYOFNDIQOI-IPYPFGDCSA-N 1 0 278.465 3.687 20 10 CHCDRO C[C@@H]([N@H+](C)Cc1c(O)ccc2ccncc21)C(C)(C)C ZINC000914569538 1128211327 /nfs/dbraw/zinc/21/13/27/1128211327.db2.gz XMNNAIPQNKABCT-GFCCVEGCSA-N 1 0 272.392 3.807 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCCc3cccnc32)c1 ZINC000927060399 1128212595 /nfs/dbraw/zinc/21/25/95/1128212595.db2.gz BHNSGIAKJTWARP-BLLLJJGKSA-N 1 0 298.386 3.524 20 10 CHCDRO COc1cc(C)cc(C[N@H+](C)[C@@H]2CCC[C@H](C)C2)c1O ZINC000754726796 1128299112 /nfs/dbraw/zinc/29/91/12/1128299112.db2.gz UBUFENZRIUMOPA-SWLSCSKDSA-N 1 0 277.408 3.720 20 10 CHCDRO CC[N@H+](Cc1c2ccccc2n(C)c1C)Cc1cccnc1 ZINC001138256838 1128303412 /nfs/dbraw/zinc/30/34/12/1128303412.db2.gz MLBUQPRYAXFRQQ-UHFFFAOYSA-N 1 0 293.414 3.904 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C(C)(C)CC(F)(F)F)cc1 ZINC000780587110 1128314159 /nfs/dbraw/zinc/31/41/59/1128314159.db2.gz JKGMBOASPJONLB-UHFFFAOYSA-N 1 0 274.330 3.573 20 10 CHCDRO C[C@H]([NH2+]C1Cc2ccccc2C1)c1cc(Cl)ccc1O ZINC000762784778 1128317888 /nfs/dbraw/zinc/31/78/88/1128317888.db2.gz ZEGWSGPJWNSRMZ-NSHDSACASA-N 1 0 287.790 3.864 20 10 CHCDRO C[N@H+](Cc1ccc(F)cc1)Cc1cc2c(cc1O)CCC2 ZINC000915826224 1128350184 /nfs/dbraw/zinc/35/01/84/1128350184.db2.gz XVGLMDIUUGQPFU-UHFFFAOYSA-N 1 0 285.362 3.652 20 10 CHCDRO CCN(C)c1ccc(C[NH2+][C@@H](c2ccccn2)C2CC2)cc1 ZINC000932382600 1128406070 /nfs/dbraw/zinc/40/60/70/1128406070.db2.gz AHRIIGOEZDCJEI-LJQANCHMSA-N 1 0 295.430 3.779 20 10 CHCDRO Oc1ccccc1C[NH2+][C@H]1CCc2ccc(Cl)cc21 ZINC000763394894 1128432501 /nfs/dbraw/zinc/43/25/01/1128432501.db2.gz HFGOIWSDGURORX-HNNXBMFYSA-N 1 0 273.763 3.823 20 10 CHCDRO COc1ccc(C[NH2+]CCO[C@H]2CCCC[C@@H]2C)cc1C ZINC000916838468 1128457130 /nfs/dbraw/zinc/45/71/30/1128457130.db2.gz CVDGCXPSCNOZPH-KSSFIOAISA-N 1 0 291.435 3.689 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C2(Cc3ccccc3)CC2)c1 ZINC000187492440 1128460350 /nfs/dbraw/zinc/46/03/50/1128460350.db2.gz PHGBYLKZJUOPNJ-UHFFFAOYSA-N 1 0 267.372 3.566 20 10 CHCDRO COc1cc(C)cc(C[N@H+](C)[C@@H](C)c2ccccc2)c1O ZINC000917075127 1128474736 /nfs/dbraw/zinc/47/47/36/1128474736.db2.gz HCMDFSPRKZZGQB-AWEZNQCLSA-N 1 0 285.387 3.902 20 10 CHCDRO CC(C)=CC[N@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000917075415 1128475137 /nfs/dbraw/zinc/47/51/37/1128475137.db2.gz VMNLGPOBKTUMMQ-UHFFFAOYSA-N 1 0 260.425 3.929 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccco1)c1ccc(N(C)C)cc1 ZINC000155972543 1128621399 /nfs/dbraw/zinc/62/13/99/1128621399.db2.gz WFKCOOAEHJLLHA-QGZVFWFLSA-N 1 0 272.392 3.629 20 10 CHCDRO COc1cccc(CC[NH2+][C@H](C)c2ccc(N(C)C)cc2)c1 ZINC000158950146 1128672789 /nfs/dbraw/zinc/67/27/89/1128672789.db2.gz SVRUIGHICPQOBW-OAHLLOKOSA-N 1 0 298.430 3.655 20 10 CHCDRO COc1ccc2c(c1)CCC[C@@H]2[N@H+](C)Cc1ccccc1O ZINC000778995527 1128674815 /nfs/dbraw/zinc/67/48/15/1128674815.db2.gz BFFAYGZIGUCHMN-SFHVURJKSA-N 1 0 297.398 3.910 20 10 CHCDRO CCC(CC)[N@H+](Cc1cc(F)ccc1O)C1CC1 ZINC000778996436 1128675229 /nfs/dbraw/zinc/67/52/29/1128675229.db2.gz ONWBADXFVAPBIM-UHFFFAOYSA-N 1 0 251.345 3.684 20 10 CHCDRO CC[N@H+](CCc1cccs1)Cc1cc(F)ccc1O ZINC000778999625 1128675343 /nfs/dbraw/zinc/67/53/43/1128675343.db2.gz IZLSNVRRMGSPFB-UHFFFAOYSA-N 1 0 279.380 3.657 20 10 CHCDRO C[C@]1(c2ccccc2)CC[N@H+](Cc2ccccc2O)C1 ZINC000779022977 1128686881 /nfs/dbraw/zinc/68/68/81/1128686881.db2.gz MZWXBEISTRFVAZ-SFHVURJKSA-N 1 0 267.372 3.556 20 10 CHCDRO COc1ccc(C[NH2+]Cc2ccc3ccccc3n2)cc1C ZINC000921065338 1128699725 /nfs/dbraw/zinc/69/97/25/1128699725.db2.gz CYEGGRYQTPYFAZ-UHFFFAOYSA-N 1 0 292.382 3.842 20 10 CHCDRO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1cc(F)ccc1O)CC2 ZINC000779075171 1128718693 /nfs/dbraw/zinc/71/86/93/1128718693.db2.gz XSAWJMNWKRYLDT-INIZCTEOSA-N 1 0 271.335 3.617 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCC(C)(C)O1)c1ccc(N(C)C)cc1 ZINC000779079343 1128722900 /nfs/dbraw/zinc/72/29/00/1128722900.db2.gz MPDZXYYLVMQNAM-IRXDYDNUSA-N 1 0 290.451 3.751 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@H]2CCC(C)(C)O2)cc1 ZINC000779080193 1128723376 /nfs/dbraw/zinc/72/33/76/1128723376.db2.gz VBAQVCCTESSJIJ-RHSMWYFYSA-N 1 0 290.451 3.751 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCSC(F)(F)F)c(O)c1 ZINC000185086491 1117761088 /nfs/dbraw/zinc/76/10/88/1117761088.db2.gz GUPJACXUVCKPCW-VIFPVBQESA-N 1 0 279.327 3.604 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc([C@@H](C)O)cc2)c1 ZINC000185119573 1117765448 /nfs/dbraw/zinc/76/54/48/1117765448.db2.gz VQCZIFUVEBYVPF-ZIAGYGMSSA-N 1 0 285.387 3.605 20 10 CHCDRO C[C@@H]([NH2+]Cc1cscn1)c1cc2c(cc1O)CCCC2 ZINC000185246626 1117795999 /nfs/dbraw/zinc/79/59/99/1117795999.db2.gz PYUJMZCXOVCLCF-LLVKDONJSA-N 1 0 288.416 3.578 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)CCc2ccco2)c1 ZINC000035628884 1117811513 /nfs/dbraw/zinc/81/15/13/1117811513.db2.gz KSMBQZCDSPYQIZ-KGLIPLIRSA-N 1 0 273.376 3.966 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCc2ccc3c(c2)CCO3)c1 ZINC000185451862 1117824393 /nfs/dbraw/zinc/82/43/93/1117824393.db2.gz XHQJUIDCIMYDQO-AWEZNQCLSA-N 1 0 297.398 3.529 20 10 CHCDRO CCCC[C@@H](COC)[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000185494397 1117829972 /nfs/dbraw/zinc/82/99/72/1117829972.db2.gz WGILMHJTFTWSBC-KBPBESRZSA-N 1 0 265.397 3.556 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C2CC2)C2CCC2)c1 ZINC000325064051 1117842226 /nfs/dbraw/zinc/84/22/26/1117842226.db2.gz UCQRPVVUNFEKPB-YVEFUNNKSA-N 1 0 259.393 3.930 20 10 CHCDRO CCC(CC)(CCO)C[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000185620769 1117858283 /nfs/dbraw/zinc/85/82/83/1117858283.db2.gz URRYWCPAMFBOLZ-AWEZNQCLSA-N 1 0 279.424 3.540 20 10 CHCDRO C[C@@H]([NH2+]C[C@H](C)Oc1ccccc1)c1cc(F)ccc1O ZINC000186041279 1117974441 /nfs/dbraw/zinc/97/44/41/1117974441.db2.gz SUEZFCDEPYAQKV-QWHCGFSZSA-N 1 0 289.350 3.649 20 10 CHCDRO COc1ccccc1C[C@H]1CCC[N@@H+]1Cc1ccccc1O ZINC000179564979 1128748698 /nfs/dbraw/zinc/74/86/98/1128748698.db2.gz IDRDXRRRCOIDGZ-QGZVFWFLSA-N 1 0 297.398 3.608 20 10 CHCDRO C[C@@H]1C[C@H](c2ccccc2)C[N@@H+]1Cc1ccccc1O ZINC000179576727 1128749591 /nfs/dbraw/zinc/74/95/91/1128749591.db2.gz YLCRFNSYHOGBER-PBHICJAKSA-N 1 0 267.372 3.770 20 10 CHCDRO CC[C@@H](O)C[N@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000179646443 1128751672 /nfs/dbraw/zinc/75/16/72/1128751672.db2.gz MJSQBUXBCPQAHC-CRAIPNDOSA-N 1 0 299.414 3.726 20 10 CHCDRO C[C@@H]1CCC[N@H+](Cc2c(O)cccc2Cl)CC1 ZINC000211526890 1118072116 /nfs/dbraw/zinc/07/21/16/1118072116.db2.gz OUYJVIKGTWFAEU-LLVKDONJSA-N 1 0 253.773 3.668 20 10 CHCDRO Cc1cc(C[N@H+]2CCO[C@H](C)[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC000765098297 1118134961 /nfs/dbraw/zinc/13/49/61/1118134961.db2.gz GITHWOWKYGYYHN-UONOGXRCSA-N 1 0 291.435 3.607 20 10 CHCDRO CC[C@H]([NH2+]CCOC1CCCC1)c1ccc(N(C)C)cc1 ZINC000765420091 1118151479 /nfs/dbraw/zinc/15/14/79/1118151479.db2.gz NHCNVNHPGWBKGL-SFHVURJKSA-N 1 0 290.451 3.753 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1ccncc1OC)c1ccccc1O ZINC000188763241 1128765319 /nfs/dbraw/zinc/76/53/19/1128765319.db2.gz SMNMKAYQTVLEMP-WFASDCNBSA-N 1 0 286.375 3.598 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CCSCC(C)C)c(Cl)c1 ZINC001650905240 1118197297 /nfs/dbraw/zinc/19/72/97/1118197297.db2.gz AACCWGQMSHSUFC-UHFFFAOYSA-N 1 0 287.856 3.833 20 10 CHCDRO COc1ccc(Cl)cc1C[NH2+][C@H](C)c1ccccc1O ZINC000179873271 1128763860 /nfs/dbraw/zinc/76/38/60/1128763860.db2.gz FXFBMAJCDQOTBP-LLVKDONJSA-N 1 0 291.778 3.905 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@](C)(O)C2CCCCC2)c(O)c1 ZINC000188661195 1128764006 /nfs/dbraw/zinc/76/40/06/1128764006.db2.gz LJRNTZHXSUEXFD-KBXCAEBGSA-N 1 0 291.435 3.683 20 10 CHCDRO Cc1ccc(C)c(C[NH+]2CCC3(CCC3)CC2)c1O ZINC001140178352 1118242368 /nfs/dbraw/zinc/24/23/68/1118242368.db2.gz JFQVBFAUNLGIJE-UHFFFAOYSA-N 1 0 259.393 3.775 20 10 CHCDRO CC(C)[N@H+](Cc1ccc(C#N)cc1)Cc1cc(F)ccc1O ZINC000179933637 1128767411 /nfs/dbraw/zinc/76/74/11/1128767411.db2.gz RYUZJVPTORYVQA-UHFFFAOYSA-N 1 0 298.361 3.814 20 10 CHCDRO COc1cccc(C[NH2+][C@@H](C)c2cc3ccccc3o2)c1O ZINC000189091013 1128767509 /nfs/dbraw/zinc/76/75/09/1128767509.db2.gz CTLCUPUJVCTGGV-LBPRGKRZSA-N 1 0 297.354 3.998 20 10 CHCDRO Oc1ccc(F)cc1C[N@H+](Cc1cccs1)C1CC1 ZINC000179926519 1128768062 /nfs/dbraw/zinc/76/80/62/1128768062.db2.gz PWJJEVAOASXMIA-UHFFFAOYSA-N 1 0 277.364 3.757 20 10 CHCDRO Cc1cncc(C[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)c1 ZINC000186191871 1118311042 /nfs/dbraw/zinc/31/10/42/1118311042.db2.gz HBYDDCCOQNKCGT-CQSZACIVSA-N 1 0 296.414 3.825 20 10 CHCDRO CC[N@H+](Cc1ccccn1)Cc1cc2c(cc1O)CCCC2 ZINC000160380418 1118381006 /nfs/dbraw/zinc/38/10/06/1118381006.db2.gz QXRSZIFLZWEKQS-UHFFFAOYSA-N 1 0 296.414 3.688 20 10 CHCDRO Cc1nnsc1C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000293751074 1118447697 /nfs/dbraw/zinc/44/76/97/1118447697.db2.gz RINBKSOHWGVSIP-SNVBAGLBSA-N 1 0 299.399 3.556 20 10 CHCDRO CC[C@H]([NH2+]C1CCC1)c1cc(Br)ccc1O ZINC000052207263 1118448938 /nfs/dbraw/zinc/44/89/38/1118448938.db2.gz SFAJYWGIOFNKEZ-LBPRGKRZSA-N 1 0 284.197 3.748 20 10 CHCDRO CC1(C)CC[C@H]([NH2+]Cc2c(O)cccc2Br)C1 ZINC000706834290 1118548867 /nfs/dbraw/zinc/54/88/67/1118548867.db2.gz UCDORHFGLIQWLZ-JTQLQIEISA-N 1 0 298.224 3.823 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH+]1CCC(C(F)F)CC1 ZINC000307882213 1118549688 /nfs/dbraw/zinc/54/96/88/1118549688.db2.gz SINPGQQCGFBILL-UHFFFAOYSA-N 1 0 275.726 3.523 20 10 CHCDRO C[C@H]1CCC[C@@H]1C[NH2+]Cc1c(O)cccc1Br ZINC000706847071 1118553206 /nfs/dbraw/zinc/55/32/06/1118553206.db2.gz VFDUJDUGCHTQQM-WDEREUQCSA-N 1 0 298.224 3.681 20 10 CHCDRO Oc1ccccc1C[N@H+](Cc1nccs1)C1CCCC1 ZINC000749513253 1118573374 /nfs/dbraw/zinc/57/33/74/1118573374.db2.gz AYAXVHMFHAZVJK-UHFFFAOYSA-N 1 0 288.416 3.794 20 10 CHCDRO CC[C@H]([NH2+]Cc1cnccc1C)c1cc(Cl)ccc1O ZINC000834887870 1118611660 /nfs/dbraw/zinc/61/16/60/1118611660.db2.gz XVMFKFJPVJEVHC-HNNXBMFYSA-N 1 0 290.794 3.990 20 10 CHCDRO COc1ccc(C[NH2+]CC2CCC(F)(F)CC2)cc1C ZINC000693405030 1118629265 /nfs/dbraw/zinc/62/92/65/1118629265.db2.gz YWULSQRIUINXJC-UHFFFAOYSA-N 1 0 283.362 3.919 20 10 CHCDRO C[C@@H]1CCC[N@H+](Cc2c(O)cccc2Br)[C@H]1C ZINC000707147313 1118648103 /nfs/dbraw/zinc/64/81/03/1118648103.db2.gz YHBHIUDHHFLRGD-MNOVXSKESA-N 1 0 298.224 3.775 20 10 CHCDRO CC1(C)CC[NH+](Cc2c(O)cccc2Br)CC1 ZINC000707147299 1118648436 /nfs/dbraw/zinc/64/84/36/1118648436.db2.gz XVFUUFNXWNDVDF-UHFFFAOYSA-N 1 0 298.224 3.777 20 10 CHCDRO CC[C@H]1CCC[N@H+](Cc2c(O)cccc2Br)C1 ZINC000707141273 1118648835 /nfs/dbraw/zinc/64/88/35/1118648835.db2.gz XFUNLARYAOMVIS-NSHDSACASA-N 1 0 298.224 3.777 20 10 CHCDRO C[C@@H]([NH2+]C/C=C\c1ccccc1)c1ccccc1O ZINC000588424096 1118667376 /nfs/dbraw/zinc/66/73/76/1118667376.db2.gz WDVPTBKWXMSDLB-JKEYDSJLSA-N 1 0 253.345 3.756 20 10 CHCDRO CC[C@H]([NH2+]CCCOCC(C)C)c1ccc(F)cc1[O-] ZINC000796676492 1118685447 /nfs/dbraw/zinc/68/54/47/1118685447.db2.gz RUUIOFYEXNKXFW-HNNXBMFYSA-N 1 0 283.387 3.635 20 10 CHCDRO COc1ccc(C[N@H+](C)C2CCCCCC2)c(O)c1OC ZINC000891533748 1118704903 /nfs/dbraw/zinc/70/49/03/1118704903.db2.gz DOWFRHQSFBWJCQ-UHFFFAOYSA-N 1 0 293.407 3.564 20 10 CHCDRO CCS[C@@H]1CC[C@H]([N@H+](C)Cc2cccc(C)c2O)C1 ZINC000180667996 1128801963 /nfs/dbraw/zinc/80/19/63/1128801963.db2.gz GDHRUIZDRNBNCX-LSDHHAIUSA-N 1 0 279.449 3.807 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCC[C@@H]2C2CCCC2)c1O ZINC000132830657 1118856388 /nfs/dbraw/zinc/85/63/88/1118856388.db2.gz VLXBQQRRTRPULO-MRXNPFEDSA-N 1 0 289.419 3.946 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)CCSC)c1ccccc1O ZINC000129683717 1118880348 /nfs/dbraw/zinc/88/03/48/1118880348.db2.gz DMEUGFPGKAJMBB-WCQYABFASA-N 1 0 253.411 3.575 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCc3ccccc3C2)c(O)c1 ZINC000051630741 1119061593 /nfs/dbraw/zinc/06/15/93/1119061593.db2.gz IRQWBDUFNAHYGW-PBHICJAKSA-N 1 0 281.399 3.909 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)Cc2ccsc2)c1 ZINC000049154884 1119087395 /nfs/dbraw/zinc/08/73/95/1119087395.db2.gz WSSNLLDDFKOYDP-NEPJUHHUSA-N 1 0 291.416 3.744 20 10 CHCDRO CCCC1CCC([NH2+]Cc2cc(OC)ccc2O)CC1 ZINC000049543549 1119103274 /nfs/dbraw/zinc/10/32/74/1119103274.db2.gz USZRMUYPMZYWCO-UHFFFAOYSA-N 1 0 277.408 3.849 20 10 CHCDRO CC[C@@H](C)[C@@H](C)[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC000152833064 1119128348 /nfs/dbraw/zinc/12/83/48/1119128348.db2.gz PTEWYPZWJWXFSY-HUUCEWRRSA-N 1 0 290.451 3.688 20 10 CHCDRO Cc1cc(C[N@@H+]2CC[C@@H]2Cc2ccccc2)ccc1N(C)C ZINC001167593939 1119141083 /nfs/dbraw/zinc/14/10/83/1119141083.db2.gz GDELTQGBQYGZOB-LJQANCHMSA-N 1 0 294.442 3.878 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CC[C@@H]2CCCC[C@@H]2C1 ZINC000226561853 1119157390 /nfs/dbraw/zinc/15/73/90/1119157390.db2.gz LPMLKPNHKOSOPK-QWHCGFSZSA-N 1 0 263.356 3.543 20 10 CHCDRO C[C@H](O)C[C@H](C)C[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000077428688 1119195336 /nfs/dbraw/zinc/19/53/36/1119195336.db2.gz UGNCYYJWUPFHHA-GJZGRUSLSA-N 1 0 299.414 3.556 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+][C@@H]1CCCc2ccccc21 ZINC000226582160 1119208598 /nfs/dbraw/zinc/20/85/98/1119208598.db2.gz GCYFEUXYRUVNME-MRXNPFEDSA-N 1 0 271.335 3.699 20 10 CHCDRO CCCC[C@@H](CCC)[NH2+]Cc1ccc(O)c(O)c1 ZINC000226759959 1119323203 /nfs/dbraw/zinc/32/32/03/1119323203.db2.gz ZZOQGYWKSWCVMV-CYBMUJFWSA-N 1 0 251.370 3.546 20 10 CHCDRO CO[C@@H](C)C[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000188123764 1119460281 /nfs/dbraw/zinc/46/02/81/1119460281.db2.gz CQNQKCDZIFTIAC-JKSUJKDBSA-N 1 0 290.451 3.753 20 10 CHCDRO C[C@H]([NH2+]Cc1ccoc1)c1ccc2ccccc2c1O ZINC000168737578 1119473565 /nfs/dbraw/zinc/47/35/65/1119473565.db2.gz BGCKPCFTPRVPSI-LBPRGKRZSA-N 1 0 267.328 3.989 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CC[C@H]1C)c1cc(Br)ccc1O ZINC000309587832 1119522768 /nfs/dbraw/zinc/52/27/68/1119522768.db2.gz SQJNWIPLYVMSRD-VDDIYKPWSA-N 1 0 284.197 3.604 20 10 CHCDRO Oc1ccccc1C[N@H+](Cc1ccc(F)cc1F)C1CC1 ZINC000179556785 1119751367 /nfs/dbraw/zinc/75/13/67/1119751367.db2.gz DWNYFVWOIKCPRX-UHFFFAOYSA-N 1 0 289.325 3.835 20 10 CHCDRO Cn1cccc1[C@@H]1CCC[N@@H+]1Cc1cc(Cl)ccc1O ZINC000179706600 1119758012 /nfs/dbraw/zinc/75/80/12/1119758012.db2.gz SCAZZNKMYDKYGS-HNNXBMFYSA-N 1 0 290.794 3.721 20 10 CHCDRO CSc1ccc(C[NH2+][C@H](C)c2ccccc2O)cc1 ZINC000179887223 1119790824 /nfs/dbraw/zinc/79/08/24/1119790824.db2.gz LQSDIXSZKAQKMV-GFCCVEGCSA-N 1 0 273.401 3.965 20 10 CHCDRO CCOc1cccc(C[NH2+][C@H](C)C2CCCCC2)c1O ZINC000052332743 1119814288 /nfs/dbraw/zinc/81/42/88/1119814288.db2.gz WZEFBBQDLIZBIM-CYBMUJFWSA-N 1 0 277.408 3.849 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C[C@H]2CCCCC2(F)F)c1 ZINC000295077239 1119850283 /nfs/dbraw/zinc/85/02/83/1119850283.db2.gz HWNLHXFTSXPNFY-CYBMUJFWSA-N 1 0 269.335 3.616 20 10 CHCDRO C[C@@H]([NH2+]CC1CC1)c1ccc(N2CCCCC2)c(F)c1 ZINC000177834323 1119867752 /nfs/dbraw/zinc/86/77/52/1119867752.db2.gz RXEUPCMXJHASLT-CYBMUJFWSA-N 1 0 276.399 3.877 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCCOC(C)C)cc1 ZINC000178191804 1119944952 /nfs/dbraw/zinc/94/49/52/1119944952.db2.gz WQNSPFNLWHVBAP-OAHLLOKOSA-N 1 0 278.440 3.608 20 10 CHCDRO Cc1nc2c(s1)[C@H]([NH2+][C@@H](C)c1ccccc1O)CCC2 ZINC000376351224 1119951507 /nfs/dbraw/zinc/95/15/07/1119951507.db2.gz JXXNQBQJUFMWSV-GXFFZTMASA-N 1 0 288.416 3.885 20 10 CHCDRO CCc1cccc(C[N@@H+]2CC[C@@H](C3CCCC3)C2)c1O ZINC000708869433 1120038972 /nfs/dbraw/zinc/03/89/72/1120038972.db2.gz LLWJUJBMTAHCSJ-MRXNPFEDSA-N 1 0 273.420 3.967 20 10 CHCDRO CC(C)n1cc2c(n1)[C@@H]([NH2+][C@H](C)c1ccccc1O)CCC2 ZINC000765817430 1120062994 /nfs/dbraw/zinc/06/29/94/1120062994.db2.gz LIDYMJYNTBQFKJ-CJNGLKHVSA-N 1 0 299.418 3.898 20 10 CHCDRO Cc1ccc([C@@H](C)[N@H+](C)Cc2cc3c(cc2O)OCO3)cc1 ZINC000130814432 1120091235 /nfs/dbraw/zinc/09/12/35/1120091235.db2.gz KPJXYGCSZZYZQX-CYBMUJFWSA-N 1 0 299.370 3.622 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCC3(C2)CCCCC3)c1O ZINC000311640904 1120097492 /nfs/dbraw/zinc/09/74/92/1120097492.db2.gz XNPRVUPMKHSIBO-UHFFFAOYSA-N 1 0 259.393 3.857 20 10 CHCDRO C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1ccc(N2CCCC2)cc1 ZINC001116444440 1120120834 /nfs/dbraw/zinc/12/08/34/1120120834.db2.gz SVPKESUXFGXILR-JKSUJKDBSA-N 1 0 272.436 3.907 20 10 CHCDRO Oc1ccccc1C[NH2+][C@@H]1CC[C@@H](Cc2ccccc2)C1 ZINC000780520391 1120159457 /nfs/dbraw/zinc/15/94/57/1120159457.db2.gz OMVJJOBLOXKYJU-FUHWJXTLSA-N 1 0 281.399 3.893 20 10 CHCDRO CCC1(CC)CC[N@H+](Cc2cc(F)cc(C(C)=O)c2O)C1 ZINC000094806046 1120167114 /nfs/dbraw/zinc/16/71/14/1120167114.db2.gz JFFGNKLDBINACC-UHFFFAOYSA-N 1 0 293.382 3.746 20 10 CHCDRO COc1cc(C)cc(C[N@H+](C)Cc2ccc(C)cc2)c1O ZINC000119539869 1120198427 /nfs/dbraw/zinc/19/84/27/1120198427.db2.gz DXFYDYWPUVVJLS-UHFFFAOYSA-N 1 0 285.387 3.650 20 10 CHCDRO C[C@H]([NH2+][C@H]1CC[C@@H]1C)c1ccc2ccccc2c1O ZINC000312026335 1120255442 /nfs/dbraw/zinc/25/54/42/1120255442.db2.gz XMGBFAVMFDTXIU-MKBNYLNASA-N 1 0 255.361 3.995 20 10 CHCDRO CC[C@@H](C)[NH2+][C@@H](C)c1cc(Br)cc(C)c1O ZINC000309409036 1120294321 /nfs/dbraw/zinc/29/43/21/1120294321.db2.gz BKIJVLIYXKGCHA-ZJUUUORDSA-N 1 0 286.213 3.912 20 10 CHCDRO COc1ccc(N2CC[NH+]([C@H](C)c3ccccc3)CC2)cc1 ZINC000078224899 1128907410 /nfs/dbraw/zinc/90/74/10/1128907410.db2.gz MVDSWWAQXCKIES-MRXNPFEDSA-N 1 0 296.414 3.578 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@@H+](C)C[C@@H](C)c2nccs2)c1 ZINC000182846391 1120329525 /nfs/dbraw/zinc/32/95/25/1120329525.db2.gz FDEHZTCSFZHJIL-CYBMUJFWSA-N 1 0 290.432 3.701 20 10 CHCDRO Cc1cncc([C@H](C)[NH2+]CCCSc2nccs2)c1 ZINC000184361618 1120355285 /nfs/dbraw/zinc/35/52/85/1120355285.db2.gz DMCNXYXTPUQXNL-LBPRGKRZSA-N 1 0 293.461 3.680 20 10 CHCDRO CSC[C@H](C)[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000185494985 1120377884 /nfs/dbraw/zinc/37/78/84/1120377884.db2.gz AEYMVKWRHXRZLZ-RYUDHWBXSA-N 1 0 279.449 3.673 20 10 CHCDRO COc1ccc(C[NH2+]C2CCC3(CC3)CC2)cc1C ZINC000695722013 1120406473 /nfs/dbraw/zinc/40/64/73/1120406473.db2.gz GRGFRTDQIXVZBT-UHFFFAOYSA-N 1 0 259.393 3.816 20 10 CHCDRO CCOC1(C[NH2+][C@H](CC)c2ccccc2O)CCCC1 ZINC000312487717 1120448445 /nfs/dbraw/zinc/44/84/45/1120448445.db2.gz QMAOVHPRIAVSNO-OAHLLOKOSA-N 1 0 277.408 3.782 20 10 CHCDRO CC[N@H+](Cc1cccc(Cl)c1[O-])CC(C)(C)C ZINC000310422804 1120455575 /nfs/dbraw/zinc/45/55/75/1120455575.db2.gz QYJFWTLLPARUEJ-UHFFFAOYSA-N 1 0 255.789 3.914 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H](C)c2ccccn2)c1 ZINC000692689431 1120488755 /nfs/dbraw/zinc/48/87/55/1120488755.db2.gz GAFSRQYFOLSKLJ-UONOGXRCSA-N 1 0 270.376 3.550 20 10 CHCDRO C[C@@H]1CC[C@H](C[NH2+]Cc2c(O)cccc2Cl)C1 ZINC000230413688 1120506490 /nfs/dbraw/zinc/50/64/90/1120506490.db2.gz LQWVOCHDNKXHDO-MNOVXSKESA-N 1 0 253.773 3.571 20 10 CHCDRO C[C@H]1CC[C@H](C[NH2+]Cc2c(O)cccc2Cl)C1 ZINC000230413690 1120506905 /nfs/dbraw/zinc/50/69/05/1120506905.db2.gz LQWVOCHDNKXHDO-QWRGUYRKSA-N 1 0 253.773 3.571 20 10 CHCDRO CC(C)SCC[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000310978443 1120507548 /nfs/dbraw/zinc/50/75/48/1120507548.db2.gz XHNCXWNSIBWOOT-ZDUSSCGKSA-N 1 0 266.454 3.545 20 10 CHCDRO Cc1ccc2c(CC[NH2+]Cc3ccccc3O)cn(C)c2c1 ZINC000186547500 1120558896 /nfs/dbraw/zinc/55/88/96/1120558896.db2.gz VMKAACOTUWVADH-UHFFFAOYSA-N 1 0 294.398 3.525 20 10 CHCDRO C[C@@H]([NH2+]Cc1cc(F)ccc1O)C1CCC(F)(F)CC1 ZINC000690837754 1120588975 /nfs/dbraw/zinc/58/89/75/1120588975.db2.gz AWPJSFJMYNYZAS-SNVBAGLBSA-N 1 0 287.325 3.835 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+][C@@H]2CCCSC2)c2c1c(F)ccc2O ZINC000756636638 1120644475 /nfs/dbraw/zinc/64/44/75/1120644475.db2.gz FLUFGTIJNDPQRA-FOGDFJRCSA-N 1 0 281.396 3.565 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@@H](C)C1CC1 ZINC000168745349 1120657173 /nfs/dbraw/zinc/65/71/73/1120657173.db2.gz MNRDALCVTOWBAY-BZPMIXESSA-N 1 0 259.393 3.885 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCc2c1cccc2F ZINC000766029578 1120673030 /nfs/dbraw/zinc/67/30/30/1120673030.db2.gz OGFWELCOBVWAPC-IBGZPJMESA-N 1 0 298.405 3.977 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCC[C@H]2CCCC[C@H]2O)c1 ZINC000756758507 1120802524 /nfs/dbraw/zinc/80/25/24/1120802524.db2.gz HCMRUHCFIQRJSV-ZMSDIMECSA-N 1 0 291.435 3.683 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2C[C@@H](C)O[C@@H](C)C2)c(O)c1C ZINC000756778060 1120833552 /nfs/dbraw/zinc/83/35/52/1120833552.db2.gz COLRXAABRGQFCA-AYRXBEOTSA-N 1 0 277.408 3.616 20 10 CHCDRO CC(C)[C@@](C)(O)C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000185434126 1120911887 /nfs/dbraw/zinc/91/18/87/1120911887.db2.gz ZLSZNWIZNXLKCN-UGSOOPFHSA-N 1 0 287.403 3.603 20 10 CHCDRO CCOc1cccc(C[NH2+]Cc2ccc(C3CC3)cc2)c1O ZINC000191683382 1128950631 /nfs/dbraw/zinc/95/06/31/1128950631.db2.gz VGEMSDIOFOGOHC-UHFFFAOYSA-N 1 0 297.398 3.958 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)COc2ccc(C)cc2)cc1C ZINC000314935725 1120981711 /nfs/dbraw/zinc/98/17/11/1120981711.db2.gz PWBLJKSNBQETQT-INIZCTEOSA-N 1 0 299.414 3.869 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cc(C)sc2C)c1 ZINC000182321150 1128958191 /nfs/dbraw/zinc/95/81/91/1128958191.db2.gz FMXPCQPCUXHZPZ-NSHDSACASA-N 1 0 291.416 3.930 20 10 CHCDRO C[C@H]([NH2+]C1CC2(CCC2)C1)c1ccc(N(C)C)cc1 ZINC000700085703 1121078168 /nfs/dbraw/zinc/07/81/68/1121078168.db2.gz RNEYFHYQXOEUEV-ZDUSSCGKSA-N 1 0 258.409 3.736 20 10 CHCDRO Oc1ccc(Br)cc1C[NH2+]C1(C2CCC2)CC1 ZINC000700095446 1121078208 /nfs/dbraw/zinc/07/82/08/1121078208.db2.gz HGZIACSKPNCPKV-UHFFFAOYSA-N 1 0 296.208 3.577 20 10 CHCDRO CCc1cnccc1[C@@H](C)[NH2+]Cc1cc(C)ccc1O ZINC000773426864 1121095826 /nfs/dbraw/zinc/09/58/26/1121095826.db2.gz HUQLTMOWQLEVRD-CYBMUJFWSA-N 1 0 270.376 3.509 20 10 CHCDRO C[C@H](C[NH2+]Cc1c(O)cccc1Cl)Oc1ccccc1 ZINC000700351787 1121099015 /nfs/dbraw/zinc/09/90/15/1121099015.db2.gz IAKMUEGSKQRCEP-GFCCVEGCSA-N 1 0 291.778 3.603 20 10 CHCDRO CCOc1ccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)o1 ZINC000893683549 1121166176 /nfs/dbraw/zinc/16/61/76/1121166176.db2.gz JLGCBVKFONAVPM-CYBMUJFWSA-N 1 0 288.391 3.595 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCc2cc(F)cc(F)c2)c1 ZINC000060717814 1121173445 /nfs/dbraw/zinc/17/34/45/1121173445.db2.gz CEDDFJDVFVIDFG-LBPRGKRZSA-N 1 0 291.341 3.872 20 10 CHCDRO CCc1cccc(C[NH2+][C@@H]2CCCC(F)(F)C2)c1O ZINC000702566235 1121204336 /nfs/dbraw/zinc/20/43/36/1121204336.db2.gz UNLPLDKACDMFLC-CYBMUJFWSA-N 1 0 269.335 3.622 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+][C@H](C)C2CCCCC2)c1 ZINC000236849346 1121214317 /nfs/dbraw/zinc/21/43/17/1121214317.db2.gz FKWMSFIRZAAAQJ-CYBMUJFWSA-N 1 0 277.408 3.849 20 10 CHCDRO CCc1cccc(C[N@@H+]2CCCC(F)(F)CC2)c1O ZINC000702823504 1121214567 /nfs/dbraw/zinc/21/45/67/1121214567.db2.gz IHNBDWFTOJKXJE-UHFFFAOYSA-N 1 0 269.335 3.576 20 10 CHCDRO Cc1cc(F)ccc1CC[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000094950972 1121247719 /nfs/dbraw/zinc/24/77/19/1121247719.db2.gz FHFJWLFDQUMUOT-LBPRGKRZSA-N 1 0 291.341 3.872 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@@H+]2CC[C@@H](CC(F)(F)F)C2)c1 ZINC000766116903 1121266516 /nfs/dbraw/zinc/26/65/16/1121266516.db2.gz JBZIPMLOAJAIIN-LBPRGKRZSA-N 1 0 287.325 3.783 20 10 CHCDRO Cc1ccc(O)c(Nc2cc(C)[nH+]c3ccccc23)c1 ZINC001214217369 1121299387 /nfs/dbraw/zinc/29/93/87/1121299387.db2.gz WCMBQJMSMQPCQA-UHFFFAOYSA-N 1 0 264.328 3.723 20 10 CHCDRO CCc1cc(C[NH2+][C@@H](C)c2ccc(N(C)CC)cc2)on1 ZINC000766134674 1121304391 /nfs/dbraw/zinc/30/43/91/1121304391.db2.gz GOHFEZIGSXPEEJ-ZDUSSCGKSA-N 1 0 287.407 3.544 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccncc1Cl)c1ccc(N(C)C)cc1 ZINC000704394253 1121341549 /nfs/dbraw/zinc/34/15/49/1121341549.db2.gz KZFVFWTULMOMAD-GFCCVEGCSA-N 1 0 289.810 3.652 20 10 CHCDRO [O-]c1cccc(F)c1C[N@@H+]1CC[C@@H](C2CCCCC2)C1 ZINC001137838880 1121424232 /nfs/dbraw/zinc/42/42/32/1121424232.db2.gz MBPOFSUOMGLFLI-CQSZACIVSA-N 1 0 277.383 3.934 20 10 CHCDRO CCC[C@@H]1CCC[N@H+](Cc2cc(F)ccc2O)C1 ZINC000708466418 1121464020 /nfs/dbraw/zinc/46/40/20/1121464020.db2.gz HSDTULNTLZNRRT-GFCCVEGCSA-N 1 0 251.345 3.543 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCC2(CCCC2)O1)c1ccccc1O ZINC000709496881 1121470532 /nfs/dbraw/zinc/47/05/32/1121470532.db2.gz BOWIYYZXVZHCMW-UONOGXRCSA-N 1 0 275.392 3.535 20 10 CHCDRO CCc1cccc(C[NH2+][C@H](C)c2cccc(O)c2)c1O ZINC000709426755 1121470832 /nfs/dbraw/zinc/47/08/32/1121470832.db2.gz HVOYANUFOMXKIH-GFCCVEGCSA-N 1 0 271.360 3.511 20 10 CHCDRO COc1ccc(C[NH2+][C@H]2CCOC23CCCCC3)cc1C ZINC001176760586 1121693223 /nfs/dbraw/zinc/69/32/23/1121693223.db2.gz BKVMDGDRJZIBGG-KRWDZBQOSA-N 1 0 289.419 3.585 20 10 CHCDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]C[C@@H]1CCCCO1 ZINC000727467624 1121720693 /nfs/dbraw/zinc/72/06/93/1121720693.db2.gz JDGGWNHMLSIIBX-SFHVURJKSA-N 1 0 297.398 3.718 20 10 CHCDRO CCO[C@H](CC[NH2+]Cc1c(O)cc(C)cc1Cl)C(C)C ZINC001177942943 1121759771 /nfs/dbraw/zinc/75/97/71/1121759771.db2.gz KFTQFJPVOCEULT-MRXNPFEDSA-N 1 0 299.842 3.895 20 10 CHCDRO COc1ccc(C)cc1C[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001648951453 1121783813 /nfs/dbraw/zinc/78/38/13/1121783813.db2.gz VZNSTPSYFPBXCO-UHFFFAOYSA-N 1 0 297.398 3.618 20 10 CHCDRO CCC(CC)(C[NH2+]C/C=C\c1ccc(N(C)C)cc1)OC ZINC001178831605 1121822074 /nfs/dbraw/zinc/82/20/74/1121822074.db2.gz WYJJOWCEDQXYHB-HJWRWDBZSA-N 1 0 290.451 3.561 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)[C@H]1CC1(C)C ZINC001178977454 1121831808 /nfs/dbraw/zinc/83/18/08/1121831808.db2.gz MBFUYOIKRYIKOO-DOMZBBRYSA-N 1 0 296.405 3.945 20 10 CHCDRO CCN(C)c1ccc(C[N@H+](C)[C@@H](C)c2ccccn2)cc1 ZINC000773802873 1121856659 /nfs/dbraw/zinc/85/66/59/1121856659.db2.gz AGKHQMDBXJMFFM-HNNXBMFYSA-N 1 0 283.419 3.731 20 10 CHCDRO CCN(C)c1ccc(C[NH2+][C@@H](C)c2cccc(O)c2)cc1 ZINC000773809999 1121868298 /nfs/dbraw/zinc/86/82/98/1121868298.db2.gz HCMHLFUZKANZKD-AWEZNQCLSA-N 1 0 284.403 3.699 20 10 CHCDRO CCCOc1ccc(C[NH2+]CCC(C)(C)OC)cc1C ZINC001179397377 1121873944 /nfs/dbraw/zinc/87/39/44/1121873944.db2.gz WLGUFOJCZQNPEX-UHFFFAOYSA-N 1 0 279.424 3.689 20 10 CHCDRO Cc1cc(C)cc(C[N@@H+](C)Cc2ccccc2O)c1 ZINC000731843044 1121888177 /nfs/dbraw/zinc/88/81/77/1121888177.db2.gz PEBCQCPXCVBXQY-UHFFFAOYSA-N 1 0 255.361 3.641 20 10 CHCDRO C[C@H](CCc1ccccc1)[N@H+](C)Cc1ccccc1O ZINC000731842774 1121888358 /nfs/dbraw/zinc/88/83/58/1121888358.db2.gz AIDZHBKQDDNZMV-OAHLLOKOSA-N 1 0 269.388 3.845 20 10 CHCDRO CCCN(CCC)c1ccc(C[NH2+]C[C@@](C)(O)CC)cc1 ZINC000732229208 1121911609 /nfs/dbraw/zinc/91/16/09/1121911609.db2.gz IJJQCKKQCZTLEX-SFHVURJKSA-N 1 0 292.467 3.564 20 10 CHCDRO CC1(C)CCC[N@H+](Cc2cc3c(cc2O)CCC3)C1 ZINC000732979992 1121949186 /nfs/dbraw/zinc/94/91/86/1121949186.db2.gz OOKYEXDFSPNODB-UHFFFAOYSA-N 1 0 259.393 3.503 20 10 CHCDRO CC(C)CC[C@H]1CCC[N@@H+]1Cc1cc(F)ccc1O ZINC001180136554 1121951106 /nfs/dbraw/zinc/95/11/06/1121951106.db2.gz GHUAVVXZXPFPBK-OAHLLOKOSA-N 1 0 265.372 3.932 20 10 CHCDRO CC(C)C[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000733322757 1121975820 /nfs/dbraw/zinc/97/58/20/1121975820.db2.gz SLRDABFYACDKCX-UHFFFAOYSA-N 1 0 255.361 3.805 20 10 CHCDRO C[C@H]1CCCC[C@H]1OCC[NH2+]Cc1c(O)cccc1Cl ZINC000733324782 1121976266 /nfs/dbraw/zinc/97/62/66/1121976266.db2.gz CGHKRUMFHXLDFJ-BLLLJJGKSA-N 1 0 297.826 3.731 20 10 CHCDRO COc1ccc(C)cc1C[NH2+]Cc1c(O)cccc1Cl ZINC000733322905 1121976677 /nfs/dbraw/zinc/97/66/77/1121976677.db2.gz XAMJJRWIALBPNZ-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO COc1cccc(O)c1C[NH2+]C1CC(C)(c2ccccc2)C1 ZINC000733326660 1121977980 /nfs/dbraw/zinc/97/79/80/1121977980.db2.gz RSFWCWHQIXFHEF-UHFFFAOYSA-N 1 0 297.398 3.611 20 10 CHCDRO CC[C@H]1[C@@H](C)CC[N@@H+]1Cc1ccc(N(C)C)cc1C ZINC001181102713 1122032675 /nfs/dbraw/zinc/03/26/75/1122032675.db2.gz RYWXQRCVCSWNNA-GUYCJALGSA-N 1 0 260.425 3.681 20 10 CHCDRO Cc1ncsc1C[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2C ZINC000071212512 1122032974 /nfs/dbraw/zinc/03/29/74/1122032974.db2.gz IPKKCWLUXQBJBE-JQWIXIFHSA-N 1 0 288.416 3.804 20 10 CHCDRO Cc1ccc(C[NH+]2CCC(C)(C(C)C)CC2)c(O)c1 ZINC001181090558 1122033134 /nfs/dbraw/zinc/03/31/34/1122033134.db2.gz XXUCKOORBYPHHP-UHFFFAOYSA-N 1 0 261.409 3.959 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@H]1CC[C@@H]1C1CCC1 ZINC001181446289 1122055351 /nfs/dbraw/zinc/05/53/51/1122055351.db2.gz XDHSVXFIKDRWMD-MSOLQXFVSA-N 1 0 272.436 3.940 20 10 CHCDRO CCCC[C@H]([NH2+]Cc1cc(F)ccc1O)C1CCC1 ZINC001181534272 1122062513 /nfs/dbraw/zinc/06/25/13/1122062513.db2.gz IHGSVLVJBLAZAB-HNNXBMFYSA-N 1 0 265.372 3.980 20 10 CHCDRO CSC[C@H]1CCC[N@H+](Cc2ccc(Cl)cc2O)C1 ZINC001182044232 1122105812 /nfs/dbraw/zinc/10/58/12/1122105812.db2.gz VZWOWCMHJFVGIB-NSHDSACASA-N 1 0 285.840 3.621 20 10 CHCDRO CC(C)[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cccnc1 ZINC000774407708 1122162136 /nfs/dbraw/zinc/16/21/36/1122162136.db2.gz XZJGFHCIOBPDPS-SFHVURJKSA-N 1 0 282.387 3.503 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+][C@H]1CC[C@@H]1C1CCC1 ZINC001182684097 1122182466 /nfs/dbraw/zinc/18/24/66/1122182466.db2.gz JQSHMMCAZGMGIM-KGLIPLIRSA-N 1 0 265.784 3.714 20 10 CHCDRO Cc1csc(C2([NH2+]Cc3cccc(C)c3O)CCC2)n1 ZINC000271917297 1122182868 /nfs/dbraw/zinc/18/28/68/1122182868.db2.gz ZFCFWLODINAGFS-UHFFFAOYSA-N 1 0 288.416 3.635 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+]CCCc2nccs2)c1O ZINC000271950838 1122184371 /nfs/dbraw/zinc/18/43/71/1122184371.db2.gz BRDUPOGQPIKXAH-UHFFFAOYSA-N 1 0 296.823 3.533 20 10 CHCDRO COCC[C@@H]([NH2+]Cc1cccc(Cl)c1[O-])c1ccco1 ZINC000272474349 1122203193 /nfs/dbraw/zinc/20/31/93/1122203193.db2.gz AZMCQVOHVJVHGW-CYBMUJFWSA-N 1 0 295.766 3.506 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2cn3ccccc3n2)c(O)c1C ZINC000273303092 1122227379 /nfs/dbraw/zinc/22/73/79/1122227379.db2.gz CBMYRGCMXWRNGO-AWEZNQCLSA-N 1 0 295.386 3.508 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)cn1 ZINC000273363692 1122230057 /nfs/dbraw/zinc/23/00/57/1122230057.db2.gz DLSYWIMSZIQFAY-NSHDSACASA-N 1 0 276.767 3.600 20 10 CHCDRO C[C@H]([NH2+]CC1CCSCC1)c1cc(Cl)ccc1O ZINC000273359608 1122230333 /nfs/dbraw/zinc/23/03/33/1122230333.db2.gz AFMDAMZIXLPNDN-JTQLQIEISA-N 1 0 285.840 3.839 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc([C@H](C)O)cc2)c(O)c1C ZINC000273383896 1122230538 /nfs/dbraw/zinc/23/05/38/1122230538.db2.gz IWODSZLTXMLLIU-CABCVRRESA-N 1 0 299.414 3.913 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](C)c2nccs2)c(O)c1C ZINC000273471423 1122234985 /nfs/dbraw/zinc/23/49/85/1122234985.db2.gz SAYTWTQZCZBJED-WCQYABFASA-N 1 0 290.432 3.920 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]C2(c3ccccc3)CC2)c1 ZINC000273475297 1122235589 /nfs/dbraw/zinc/23/55/89/1122235589.db2.gz KNCGYBBDZOJNEO-CYBMUJFWSA-N 1 0 283.371 3.741 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCO[C@@H](C(C)C)C2)c(O)c1 ZINC000273503724 1122235966 /nfs/dbraw/zinc/23/59/66/1122235966.db2.gz QOVBBXDKOHDWGR-JJRVBVJISA-N 1 0 277.408 3.555 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(Cl)cn2)c(O)c1C ZINC000273542923 1122238010 /nfs/dbraw/zinc/23/80/10/1122238010.db2.gz YRQVRUGCUFUYCP-GFCCVEGCSA-N 1 0 290.794 3.908 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCc2c1cccc2O)c1cc(F)ccc1O ZINC000273562937 1122239190 /nfs/dbraw/zinc/23/91/90/1122239190.db2.gz IPYMCRLKEHMSCA-BONVTDFDSA-N 1 0 287.334 3.575 20 10 CHCDRO COCCC1(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)CCC1 ZINC000273607440 1122240157 /nfs/dbraw/zinc/24/01/57/1122240157.db2.gz UQZLDOQFFJYXPP-HNNXBMFYSA-N 1 0 291.435 3.866 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CSCCS2)c(O)c1C ZINC000273617367 1122241318 /nfs/dbraw/zinc/24/13/18/1122241318.db2.gz XUFRELHLLGIYSI-CHWSQXEVSA-N 1 0 297.489 3.508 20 10 CHCDRO CCc1nc(C[NH2+][C@@H](CC)c2ccccc2O)cs1 ZINC000183322373 1129044870 /nfs/dbraw/zinc/04/48/70/1129044870.db2.gz OKXHNVSJSIVYDV-ZDUSSCGKSA-N 1 0 276.405 3.652 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccc2c(c1)CCO2)c1ccccc1O ZINC000183331899 1129045974 /nfs/dbraw/zinc/04/59/74/1129045974.db2.gz YDCKJZTXYYOSCJ-KRWDZBQOSA-N 1 0 297.398 3.611 20 10 CHCDRO Cc1cc(C[NH2+][C@@H](C)c2ccccc2O)ccc1F ZINC000183393267 1129051457 /nfs/dbraw/zinc/05/14/57/1129051457.db2.gz DAVBINMQSVKEEL-LBPRGKRZSA-N 1 0 259.324 3.691 20 10 CHCDRO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1cc(Cl)ccc1O ZINC001203664382 1122432605 /nfs/dbraw/zinc/43/26/05/1122432605.db2.gz CHGPMEDKGCYMLY-GFCCVEGCSA-N 1 0 287.790 3.992 20 10 CHCDRO C[C@H]([NH2+]CC1(c2ccc(F)cc2)CC1)c1ccccc1O ZINC000183427020 1129054589 /nfs/dbraw/zinc/05/45/89/1129054589.db2.gz IIIHPBBDPMTJAD-ZDUSSCGKSA-N 1 0 285.362 3.914 20 10 CHCDRO CCc1ccc(CC[NH2+][C@@H](C)c2ccccc2O)cc1 ZINC000775131229 1122436379 /nfs/dbraw/zinc/43/63/79/1122436379.db2.gz UFUWXVQTVGDGKU-AWEZNQCLSA-N 1 0 269.388 3.848 20 10 CHCDRO COc1ccc(C)cc1C[NH2+][C@H](C)c1ccccc1O ZINC000775136587 1122437560 /nfs/dbraw/zinc/43/75/60/1122437560.db2.gz LNCBEMWBSQMLRG-CYBMUJFWSA-N 1 0 271.360 3.560 20 10 CHCDRO Cc1cccc(C)c1C[NH2+][C@@H](C)c1ccccc1O ZINC000775135054 1122437628 /nfs/dbraw/zinc/43/76/28/1122437628.db2.gz CORYDFCCWROWBK-AWEZNQCLSA-N 1 0 255.361 3.860 20 10 CHCDRO CCCN(C[C@@H]1CCO[C@@H](CC)C1)c1ccc(C[NH3+])cc1 ZINC000775139640 1122438354 /nfs/dbraw/zinc/43/83/54/1122438354.db2.gz DMOKFXAQQFWHRH-AEFFLSMTSA-N 1 0 290.451 3.567 20 10 CHCDRO CCCN(Cc1ccccc1F)c1ccc(C[NH3+])cc1 ZINC000775140335 1122439396 /nfs/dbraw/zinc/43/93/96/1122439396.db2.gz MAVCOSUGERLMFS-UHFFFAOYSA-N 1 0 272.367 3.701 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@H]1CS[C@H](C(C)C)C1 ZINC000775141093 1122440030 /nfs/dbraw/zinc/44/00/30/1122440030.db2.gz VZOAMGVNJUBOQV-SJORKVTESA-N 1 0 292.492 3.892 20 10 CHCDRO CC(C)[N@@H+](Cc1cc(F)ccc1O)CC1CCC1 ZINC000775178566 1122467695 /nfs/dbraw/zinc/46/76/95/1122467695.db2.gz VGJCKRYGXXCBBM-UHFFFAOYSA-N 1 0 251.345 3.542 20 10 CHCDRO CCCN(CCC)c1ccc(C[NH2+]CCC(C)(C)O)cc1 ZINC000775371890 1122531494 /nfs/dbraw/zinc/53/14/94/1122531494.db2.gz XJRZFXLMBDOPKB-UHFFFAOYSA-N 1 0 292.467 3.564 20 10 CHCDRO CC[C@@H]([NH2+]CCOc1ccc(C)cc1)c1ccccc1O ZINC000775412725 1122554905 /nfs/dbraw/zinc/55/49/05/1122554905.db2.gz OPVJCFPPONMUII-QGZVFWFLSA-N 1 0 285.387 3.820 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@H]2CCC[C@H]2OC)cc1 ZINC000775417564 1122558774 /nfs/dbraw/zinc/55/87/74/1122558774.db2.gz NCSRQESRKCYZMO-YXJHDRRASA-N 1 0 290.451 3.608 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]CCSc2ccccc2)c1 ZINC000071408176 1129062834 /nfs/dbraw/zinc/06/28/34/1129062834.db2.gz LOPCBNMDNHHEFR-UHFFFAOYSA-N 1 0 273.401 3.583 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CCC[C@@H]3CCC[C@H]32)cc1 ZINC001191085823 1122576388 /nfs/dbraw/zinc/57/63/88/1122576388.db2.gz TWNJBDKKVAYKSF-FUHWJXTLSA-N 1 0 272.436 3.907 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1C[C@H]1C)c1cc(Cl)ccc1O ZINC000775488559 1122620159 /nfs/dbraw/zinc/62/01/59/1122620159.db2.gz IZBFUZIMWYLEGE-BREBYQMCSA-N 1 0 253.773 3.742 20 10 CHCDRO CC[C@H]([NH2+]CCc1cccnc1)c1cc(Cl)ccc1O ZINC000775493271 1122622646 /nfs/dbraw/zinc/62/26/46/1122622646.db2.gz WWFJRZWMOLBZJE-HNNXBMFYSA-N 1 0 290.794 3.724 20 10 CHCDRO CC[C@H]([NH2+]CCOCC1CC1)c1cc(Cl)ccc1O ZINC000775503207 1122628817 /nfs/dbraw/zinc/62/88/17/1122628817.db2.gz DJLIMMHOGAKBAI-AWEZNQCLSA-N 1 0 283.799 3.513 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)CSC)c1cc(Cl)ccc1O ZINC000775508624 1122629789 /nfs/dbraw/zinc/62/97/89/1122629789.db2.gz DNOAAHOFQUQIDA-SKDRFNHKSA-N 1 0 273.829 3.838 20 10 CHCDRO CC[C@@H]([NH2+]CC1(C)CCOCC1)c1cc(Cl)ccc1O ZINC000775524565 1122642894 /nfs/dbraw/zinc/64/28/94/1122642894.db2.gz CFFUWGSQFLVTKH-CQSZACIVSA-N 1 0 297.826 3.903 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CCSC1)c1cc(Cl)ccc1O ZINC000775527539 1122644357 /nfs/dbraw/zinc/64/43/57/1122644357.db2.gz QZLQYHFIEGCUBD-ZYHUDNBSSA-N 1 0 271.813 3.592 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)[C@@H]1CCCOC1)c1cc(Cl)ccc1O ZINC000775548490 1122658686 /nfs/dbraw/zinc/65/86/86/1122658686.db2.gz SZETVYNIHMMDIJ-ZOWXZIJZSA-N 1 0 297.826 3.901 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1cncs1 ZINC000775580923 1122681219 /nfs/dbraw/zinc/68/12/19/1122681219.db2.gz DOMOUONRXNMYET-RYUDHWBXSA-N 1 0 275.421 3.621 20 10 CHCDRO Cc1ncc([C@@H](C)[NH2+][C@H](C)c2ccc(N(C)C)cc2)s1 ZINC000775582098 1122682344 /nfs/dbraw/zinc/68/23/44/1122682344.db2.gz LMGDGUPCSJMYEZ-VXGBXAGGSA-N 1 0 289.448 3.929 20 10 CHCDRO CN(C)c1ccc(C[N@H+](CC2CC2)CC2CCC2)cc1 ZINC001193820710 1122723018 /nfs/dbraw/zinc/72/30/18/1122723018.db2.gz SKHQWQCSRWOROW-UHFFFAOYSA-N 1 0 272.436 3.765 20 10 CHCDRO Cc1csc([C@@H](C)[NH2+][C@@H](C)c2ccc(N(C)C)cc2)n1 ZINC000080272817 1129079636 /nfs/dbraw/zinc/07/96/36/1129079636.db2.gz DDHUNIYPNQKNLI-QWHCGFSZSA-N 1 0 289.448 3.929 20 10 CHCDRO Cc1cccc(C[N@@H+]2CC3C[C@@H]4CC2C[C@H](C3)C4)c1O ZINC000775661005 1122874965 /nfs/dbraw/zinc/87/49/65/1122874965.db2.gz JDHIKBVSQHKOQF-KWOWKCNFSA-N 1 0 271.404 3.711 20 10 CHCDRO Cc1cccc(C[N@H+]2CC[C@H](c3ccccc3C)C2)c1O ZINC000775670797 1122888875 /nfs/dbraw/zinc/88/88/75/1122888875.db2.gz OBMIBBGJROGBFZ-INIZCTEOSA-N 1 0 281.399 3.999 20 10 CHCDRO COc1cc(C)cc(C[NH2+]CC2CCC(F)(F)CC2)c1O ZINC000894672383 1122889064 /nfs/dbraw/zinc/88/90/64/1122889064.db2.gz RJWPMHTYENUGIW-UHFFFAOYSA-N 1 0 299.361 3.624 20 10 CHCDRO COc1ccccc1CC[N@H+](C)Cc1cc(C)c(C)cc1O ZINC000729466049 1122891407 /nfs/dbraw/zinc/89/14/07/1122891407.db2.gz LGGMHGZIXFTERI-UHFFFAOYSA-N 1 0 299.414 3.692 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCc3ccccc3[C@H]2C)c1O ZINC000775680168 1122901200 /nfs/dbraw/zinc/90/12/00/1122901200.db2.gz BDWMRAYKSWVVRZ-CQSZACIVSA-N 1 0 267.372 3.820 20 10 CHCDRO Cc1cccc(C[N@@H+]2CC[C@H](c3ccccc3F)C2)c1O ZINC000775686554 1122908319 /nfs/dbraw/zinc/90/83/19/1122908319.db2.gz KLHMLAHHZHEZQG-AWEZNQCLSA-N 1 0 285.362 3.829 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2Cc3ccccc3C(C)(C)C2)c1 ZINC000775701218 1122912090 /nfs/dbraw/zinc/91/20/90/1122912090.db2.gz PBYQLKIQPQBTJY-UHFFFAOYSA-N 1 0 297.398 3.694 20 10 CHCDRO Cc1cccc(C[N@@H+]2CC[C@H](Cc3ccc(F)cc3)C2)c1O ZINC000775698993 1122912388 /nfs/dbraw/zinc/91/23/88/1122912388.db2.gz WXYBTZICQABJNJ-MRXNPFEDSA-N 1 0 299.389 3.904 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+]2CCS[C@@H](C)[C@@H]2C)c1O ZINC000775702384 1122913772 /nfs/dbraw/zinc/91/37/72/1122913772.db2.gz RZDMJBLKPBJJJA-QWRGUYRKSA-N 1 0 285.840 3.680 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2C[C@@H](c3ccccc3)C[C@@H]2C)c1 ZINC000775702332 1122914211 /nfs/dbraw/zinc/91/42/11/1122914211.db2.gz QAIALTXJPQFYDL-HOCLYGCPSA-N 1 0 297.398 3.779 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2C[C@H](C)C[C@@H]2C)c1O ZINC000775716549 1122920880 /nfs/dbraw/zinc/92/08/80/1122920880.db2.gz XQOWBYHXVDIISE-KOLCDFICSA-N 1 0 253.773 3.584 20 10 CHCDRO Cc1cccc(C[N@@H+](C)[C@H](C)[C@@H]2Cc3ccccc3O2)c1O ZINC000775741597 1122933178 /nfs/dbraw/zinc/93/31/78/1122933178.db2.gz TVWKODAQLJFZRM-KDOFPFPSSA-N 1 0 297.398 3.525 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+]2CC[C@@H]2C(C)C)c1O ZINC000775766278 1122952424 /nfs/dbraw/zinc/95/24/24/1122952424.db2.gz VXCDUMBJKGJWMH-CYBMUJFWSA-N 1 0 253.773 3.584 20 10 CHCDRO Oc1ccc(CN2CCC[C@@H]2c2ccccc2F)cc1O ZINC001203882774 1122968857 /nfs/dbraw/zinc/96/88/57/1122968857.db2.gz VEPBXRHZOIKGSJ-OAHLLOKOSA-N 1 0 287.334 3.574 20 10 CHCDRO COc1ccc(C)cc1C[NH2+]Cc1cc(Cl)ccc1O ZINC000775864942 1122995829 /nfs/dbraw/zinc/99/58/29/1122995829.db2.gz TYXHBLNZGGKMTD-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO CCOc1cccc(C[NH2+]Cc2ccc3c(c2)CCCO3)c1 ZINC001199329192 1123027949 /nfs/dbraw/zinc/02/79/49/1123027949.db2.gz PJROETXKHAXWOF-UHFFFAOYSA-N 1 0 297.398 3.700 20 10 CHCDRO C[C@H]1CC[C@H]([NH2+]Cc2ccc(N3CCSCC3)cc2)C1 ZINC001199376882 1123029300 /nfs/dbraw/zinc/02/93/00/1123029300.db2.gz QXIJKYGOPSBKAI-HOCLYGCPSA-N 1 0 290.476 3.518 20 10 CHCDRO COc1ccccc1[C@H](C)[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001203936562 1123032661 /nfs/dbraw/zinc/03/26/61/1123032661.db2.gz GJNLREZXQOVYBY-HNNXBMFYSA-N 1 0 298.430 3.954 20 10 CHCDRO C[C@@H]1[C@@H](C(F)(F)F)CCC[N@@H+]1Cc1ccccc1O ZINC000776014051 1123034847 /nfs/dbraw/zinc/03/48/47/1123034847.db2.gz QGVSAHASFPGBQN-PWSUYJOCSA-N 1 0 273.298 3.555 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]CCc1cccc(F)c1F ZINC000776174646 1123101434 /nfs/dbraw/zinc/10/14/34/1123101434.db2.gz PXAHWDKQJWIYGZ-UHFFFAOYSA-N 1 0 297.732 3.656 20 10 CHCDRO CN(C)c1cc(F)c(C[NH2+]CC2(C3CC3)CCC2)cc1F ZINC001201600920 1123131210 /nfs/dbraw/zinc/13/12/10/1123131210.db2.gz QTONIPUXUSZXIO-UHFFFAOYSA-N 1 0 294.389 3.701 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CC2(SC)CC2)cc1 ZINC000193659186 1129103151 /nfs/dbraw/zinc/10/31/51/1129103151.db2.gz IOYBUUBVZCDRTM-UHFFFAOYSA-N 1 0 278.465 3.518 20 10 CHCDRO COc1ccc(O)c(C[NH2+]C2(Cc3ccccc3)CCC2)c1 ZINC000776239036 1123173714 /nfs/dbraw/zinc/17/37/14/1123173714.db2.gz CRJPLOGEGQSYHY-UHFFFAOYSA-N 1 0 297.398 3.656 20 10 CHCDRO COc1cccc(C[NH2+]C(C)(C)c2ccc(F)cc2)c1O ZINC000237186429 1123176213 /nfs/dbraw/zinc/17/62/13/1123176213.db2.gz HQOCPJPSDHRNLH-UHFFFAOYSA-N 1 0 289.350 3.565 20 10 CHCDRO COc1ccc(N2CC[NH+](CCC(C)(C)C)CC2)c(C)c1 ZINC001202115326 1123176353 /nfs/dbraw/zinc/17/63/53/1123176353.db2.gz SOBVYUBONKRURF-UHFFFAOYSA-N 1 0 290.451 3.562 20 10 CHCDRO C[C@H]1CC[C@@H](C[NH2+]Cc2cc(F)c(N(C)C)cc2F)C1 ZINC001202251576 1123190153 /nfs/dbraw/zinc/19/01/53/1123190153.db2.gz SINODEPRDJGXRD-NWDGAFQWSA-N 1 0 282.378 3.557 20 10 CHCDRO COc1cc(C[NH2+][C@H]2CC[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC000850296915 1123252358 /nfs/dbraw/zinc/25/23/58/1123252358.db2.gz ZWGHMPKKVZALLG-ABAIWWIYSA-N 1 0 277.408 3.586 20 10 CHCDRO CC[C@@H](C)CC[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC000850355049 1123255516 /nfs/dbraw/zinc/25/55/16/1123255516.db2.gz BXGNYLOHITZGHP-OAHLLOKOSA-N 1 0 290.451 3.690 20 10 CHCDRO CCOCc1cc(C[NH2+][C@](C)(CC)C2CC2)ccc1OC ZINC000850384526 1123261075 /nfs/dbraw/zinc/26/10/75/1123261075.db2.gz WNMCMRHMSKSSRH-GOSISDBHSA-N 1 0 291.435 3.900 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]C[C@H]2C(C)(C)C2(F)F)cc1 ZINC000850394250 1123261860 /nfs/dbraw/zinc/26/18/60/1123261860.db2.gz NVDLJDMKBDLWDV-YVACAVLKSA-N 1 0 294.389 3.647 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H](c2ccccc2)[C@@H](O)C(C)C)c1 ZINC000850395049 1123261976 /nfs/dbraw/zinc/26/19/76/1123261976.db2.gz MTECGXCTJXCZSI-OALUTQOASA-N 1 0 299.414 3.548 20 10 CHCDRO COc1cc(C[NH2+][C@@H]2[C@@H]3CCC[C@@H]32)c(O)c(C(C)(C)C)c1 ZINC000850392090 1123262139 /nfs/dbraw/zinc/26/21/39/1123262139.db2.gz GOCFFQRCLOPTHF-MIFYACCESA-N 1 0 289.419 3.586 20 10 CHCDRO CCOCc1cc(C[NH2+]C2CC(C)(C)C2)ccc1OC ZINC000850415852 1123264773 /nfs/dbraw/zinc/26/47/73/1123264773.db2.gz WHBBIRQZGGKWHQ-UHFFFAOYSA-N 1 0 277.408 3.510 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCN(C(C)(C)C)C1)c1ccc(Cl)cc1O ZINC000850495289 1123275178 /nfs/dbraw/zinc/27/51/78/1123275178.db2.gz ZLDMRYHPUUYNSQ-DGCLKSJQSA-N 1 0 296.842 3.569 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCN(C(C)(C)C)C1)c1ccc(Cl)cc1O ZINC000850495290 1123275429 /nfs/dbraw/zinc/27/54/29/1123275429.db2.gz ZLDMRYHPUUYNSQ-WCQYABFASA-N 1 0 296.842 3.569 20 10 CHCDRO CCC(O)(CC)C(C)(C)C[NH2+][C@H](C)c1ccc(C)cc1O ZINC000850501862 1123275502 /nfs/dbraw/zinc/27/55/02/1123275502.db2.gz QIQNEGOCHFUPJT-CQSZACIVSA-N 1 0 293.451 3.929 20 10 CHCDRO CCC(O)(CC)C(C)(C)C[NH2+][C@H](C)c1cc(F)ccc1O ZINC000850501751 1123275506 /nfs/dbraw/zinc/27/55/06/1123275506.db2.gz OYMNAUODYDUILN-GFCCVEGCSA-N 1 0 297.414 3.759 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCN(C(C)(C)C)C2)c(O)c1C ZINC000850495018 1123275515 /nfs/dbraw/zinc/27/55/15/1123275515.db2.gz VBWSRKVSTDHZAW-CABCVRRESA-N 1 0 290.451 3.532 20 10 CHCDRO C[C@H]1c2ccccc2C[C@H]1[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000850518663 1123278849 /nfs/dbraw/zinc/27/88/49/1123278849.db2.gz SMVJBFMSMBGHGU-JCURWCKSSA-N 1 0 279.383 3.698 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1Cc2ccccc2[C@@H]1C)c1ccccc1O ZINC000850518337 1123278995 /nfs/dbraw/zinc/27/89/95/1123278995.db2.gz OWUJENHAVNFCKJ-OGHNNQOOSA-N 1 0 267.372 3.771 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2C[C@@H](O)c3ccccc32)c1 ZINC000850526393 1123281804 /nfs/dbraw/zinc/28/18/04/1123281804.db2.gz BUVJEQKCWRXCJU-BJOOFOGMSA-N 1 0 283.371 3.530 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@H]2CCC[C@@H](C)O2)c(O)c1 ZINC000850534426 1123286392 /nfs/dbraw/zinc/28/63/92/1123286392.db2.gz JIMDWRPREUHKOV-QLFBSQMISA-N 1 0 277.408 3.617 20 10 CHCDRO C[C@H]([NH2+]C[C@@]1(C)CC1(F)F)c1cc2c(cc1O)CCCC2 ZINC000850536654 1123286957 /nfs/dbraw/zinc/28/69/57/1123286957.db2.gz MCSXFIKLQBGFPJ-MEDUHNTESA-N 1 0 295.373 3.967 20 10 CHCDRO CC[C@@H]([NH2+]C[C@]1(C)CC1(F)F)c1ccc(N(C)C)cc1 ZINC000850535281 1123287256 /nfs/dbraw/zinc/28/72/56/1123287256.db2.gz UFHKSEZRDFXCPY-CABCVRRESA-N 1 0 282.378 3.839 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@]2(C)CC2(F)F)c(O)c1C ZINC000850538008 1123287749 /nfs/dbraw/zinc/28/77/49/1123287749.db2.gz ZYGOZQLISMGWJG-BXUZGUMPSA-N 1 0 269.335 3.705 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CC[C@@]2(C)CC2(F)F)c1 ZINC000850537581 1123288242 /nfs/dbraw/zinc/28/82/42/1123288242.db2.gz WBXRGXRTVIHKFM-RISCZKNCSA-N 1 0 269.335 3.787 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+]C[C@H]2C(C)(C)C2(F)F)c2c1c(F)ccc2O ZINC000850552672 1123289842 /nfs/dbraw/zinc/28/98/42/1123289842.db2.gz PJDRAUJCGFZEMJ-QRTLGDNMSA-N 1 0 299.336 3.961 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)C1CCC(F)CC1)c1ccccc1O ZINC000850553982 1123291099 /nfs/dbraw/zinc/29/10/99/1123291099.db2.gz GBPFMNUOKWOELP-FEPKRQSRSA-N 1 0 265.372 3.960 20 10 CHCDRO C[C@@H]([NH2+]CCCc1ccco1)c1ccc(N(C)C)cc1 ZINC000850569412 1123294275 /nfs/dbraw/zinc/29/42/75/1123294275.db2.gz CVDBPRASKPCPEY-CQSZACIVSA-N 1 0 272.392 3.629 20 10 CHCDRO COc1cccc(C[NH2+][C@H](C)c2ccc(C)cc2O)c1C ZINC000850578321 1123296111 /nfs/dbraw/zinc/29/61/11/1123296111.db2.gz KOVDRMXISSKIBW-CQSZACIVSA-N 1 0 285.387 3.868 20 10 CHCDRO CSC1(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)CCC1 ZINC000193810598 1129115008 /nfs/dbraw/zinc/11/50/08/1129115008.db2.gz PIUQIZHIJFPDDD-ZDUSSCGKSA-N 1 0 278.465 3.689 20 10 CHCDRO CC[C@H](CC(F)F)C[N@H+](C)Cc1ccccc1O ZINC000851841501 1123384430 /nfs/dbraw/zinc/38/44/30/1123384430.db2.gz UIQWTCULSQLNPZ-LLVKDONJSA-N 1 0 257.324 3.505 20 10 CHCDRO CC(C)=CCC[N@@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000851841116 1123384948 /nfs/dbraw/zinc/38/49/48/1123384948.db2.gz NFZPNDIZJAWLGB-KRWDZBQOSA-N 1 0 289.419 3.730 20 10 CHCDRO C[C@@]1(C2CC2)C[N@H+](Cc2c(O)ccc3ccccc32)CCO1 ZINC000853527766 1123442817 /nfs/dbraw/zinc/44/28/17/1123442817.db2.gz FFSAJYBOIXAKOF-IBGZPJMESA-N 1 0 297.398 3.546 20 10 CHCDRO CCC(CC)[C@@H](CC[NH2+][C@@H](C)c1ccccc1O)OC ZINC000783519323 1123470151 /nfs/dbraw/zinc/47/01/51/1123470151.db2.gz RLSZAXGZBUUYSB-SUMWQHHRSA-N 1 0 279.424 3.884 20 10 CHCDRO COc1cc(C)cc(C[NH2+]CC[C@@H]2CCCC2(F)F)c1O ZINC000895544821 1123490036 /nfs/dbraw/zinc/49/00/36/1123490036.db2.gz NXMJKYLCGGXUAM-ZDUSSCGKSA-N 1 0 299.361 3.624 20 10 CHCDRO CCc1cccc(C[NH2+]Cc2cc(O)ccc2Cl)c1O ZINC000895633750 1123498212 /nfs/dbraw/zinc/49/82/12/1123498212.db2.gz SJNGGPKQQNZPBM-UHFFFAOYSA-N 1 0 291.778 3.603 20 10 CHCDRO Cc1cc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)c(O)c(C(C)(C)C)c1 ZINC000776767023 1123503066 /nfs/dbraw/zinc/50/30/66/1123503066.db2.gz QQDCWDIWULHTBT-OKILXGFUSA-N 1 0 291.435 3.607 20 10 CHCDRO Oc1ccccc1C[N@@H+]1C[C@@H]2CCC[C@]2(C(F)(F)F)C1 ZINC000895788226 1123514488 /nfs/dbraw/zinc/51/44/88/1123514488.db2.gz MCBBYQDCCZZICY-JSGCOSHPSA-N 1 0 285.309 3.557 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]C[C@]1(C)CCOC2(CCC2)C1 ZINC000895820435 1123518049 /nfs/dbraw/zinc/51/80/49/1123518049.db2.gz FTFIHLFRKCACIH-QGZVFWFLSA-N 1 0 289.419 3.530 20 10 CHCDRO CCC[N@@H+](Cc1ccccc1O)C[C@H]1CCO[C@@H](CC)C1 ZINC000780758817 1123544338 /nfs/dbraw/zinc/54/43/38/1123544338.db2.gz WTEZANFHGIOTLU-RDJZCZTQSA-N 1 0 291.435 3.809 20 10 CHCDRO CCC1([NH2+]Cc2cc(F)c(N(C)C)cc2F)CCCC1 ZINC001202495632 1123557387 /nfs/dbraw/zinc/55/73/87/1123557387.db2.gz PJLLGAPQVVQISF-UHFFFAOYSA-N 1 0 282.378 3.843 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC[C@H]2CC2(F)F)c(O)c1C ZINC000857080586 1123584979 /nfs/dbraw/zinc/58/49/79/1123584979.db2.gz IWLLKJUIVFJUSM-RYUDHWBXSA-N 1 0 269.335 3.705 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC[C@@H]2CC2(F)F)c(O)c1C ZINC000857080585 1123585020 /nfs/dbraw/zinc/58/50/20/1123585020.db2.gz IWLLKJUIVFJUSM-NWDGAFQWSA-N 1 0 269.335 3.705 20 10 CHCDRO C[C@H]([NH2+]CC[C@@H]1CC1(F)F)c1cc2c(cc1O)CCCC2 ZINC000857082833 1123585796 /nfs/dbraw/zinc/58/57/96/1123585796.db2.gz YKNKUTHXAOOHTM-SMDDNHRTSA-N 1 0 295.373 3.967 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CC[C@@H]2CC2(F)F)c(O)c1 ZINC000857081925 1123585860 /nfs/dbraw/zinc/58/58/60/1123585860.db2.gz RKWDCHRBOIBUKJ-VXGBXAGGSA-N 1 0 269.335 3.705 20 10 CHCDRO COc1ccc([C@H](C)[NH2+]Cc2cc(F)ccc2O)cc1C ZINC000896803958 1123625883 /nfs/dbraw/zinc/62/58/83/1123625883.db2.gz PLYAWAMIUHQXCL-LBPRGKRZSA-N 1 0 289.350 3.699 20 10 CHCDRO CCc1cccc(C[NH2+]Cc2ccc(N(C)C)c(F)c2)c1 ZINC001648968389 1123627873 /nfs/dbraw/zinc/62/78/73/1123627873.db2.gz AOMOPQRXWKNLBG-UHFFFAOYSA-N 1 0 286.394 3.744 20 10 CHCDRO COc1cccc(O)c1C[NH2+]Cc1ccccc1CC(C)C ZINC000858205007 1123637800 /nfs/dbraw/zinc/63/78/00/1123637800.db2.gz WFVYZLMVZIEWLD-UHFFFAOYSA-N 1 0 299.414 3.889 20 10 CHCDRO CO[C@H]1C[C@@H](C[NH2+]Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000858330949 1123645891 /nfs/dbraw/zinc/64/58/91/1123645891.db2.gz LQPOMYLLGBIRAT-UJKQEGAGSA-N 1 0 297.398 3.574 20 10 CHCDRO CC[C@H]([NH2+]CC[C@@H]1CCCOC1)c1ccc(N(C)C)cc1 ZINC000858446492 1123655268 /nfs/dbraw/zinc/65/52/68/1123655268.db2.gz WTUVQTYQJGDRIC-YJBOKZPZSA-N 1 0 290.451 3.610 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2cccnc2C)cc1 ZINC000858518116 1123659563 /nfs/dbraw/zinc/65/95/63/1123659563.db2.gz FMHIQCHFVUMITC-AWEZNQCLSA-N 1 0 283.419 3.697 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2CO[C@H](C3CC3)C2)c1O ZINC000858548248 1123661640 /nfs/dbraw/zinc/66/16/40/1123661640.db2.gz RPODEDAHAXRXIK-XEGUGMAKSA-N 1 0 295.810 3.572 20 10 CHCDRO C[C@H]([NH2+][C@H]1CO[C@@H](C2CC2)C1)c1ccc2ccccc2c1O ZINC000858548965 1123661695 /nfs/dbraw/zinc/66/16/95/1123661695.db2.gz YCUWOITWIIHLAO-WBHUJUFNSA-N 1 0 297.398 3.764 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccns2)c(O)c1C ZINC000858575590 1123663819 /nfs/dbraw/zinc/66/38/19/1123663819.db2.gz BLRDDKNFWXWEAS-VXGBXAGGSA-N 1 0 276.405 3.877 20 10 CHCDRO CCCN(Cc1ccc(COC)cc1)c1ccc(C[NH3+])cc1 ZINC000194981410 1129140253 /nfs/dbraw/zinc/14/02/53/1129140253.db2.gz QZQMSKKPULJLDC-UHFFFAOYSA-N 1 0 298.430 3.708 20 10 CHCDRO Cc1cc(Cl)nc(C[NH2+][C@@H](C)c2ccccc2O)c1 ZINC000281930960 1123750743 /nfs/dbraw/zinc/75/07/43/1123750743.db2.gz AYFWZUMPNMOUJJ-NSHDSACASA-N 1 0 276.767 3.600 20 10 CHCDRO Oc1ccc(-c2ccccc2)cc1C[N@@H+]1C[C@@H]2C[C@@H]2C1 ZINC000862440428 1123809840 /nfs/dbraw/zinc/80/98/40/1123809840.db2.gz HMASNYWHLLUYOH-IYBDPMFKSA-N 1 0 265.356 3.511 20 10 CHCDRO CN(Cc1cccs1)c1ccc(C[N@@H+]2C[C@@H]3C[C@@H]3C2)cc1 ZINC000862442759 1123809945 /nfs/dbraw/zinc/80/99/45/1123809945.db2.gz HKCNHWWEWPIGKD-IYBDPMFKSA-N 1 0 298.455 3.836 20 10 CHCDRO [O-]c1c(Cl)cccc1C[NH2+][C@@H]1CCCc2cccnc21 ZINC000897071346 1123810321 /nfs/dbraw/zinc/81/03/21/1123810321.db2.gz ASEJSYXWPOFQFF-CQSZACIVSA-N 1 0 288.778 3.608 20 10 CHCDRO C[C@@H]1C[NH+](Cc2cc(Cl)ccc2O)C[C@@H](C)C1(F)F ZINC000862443420 1123811657 /nfs/dbraw/zinc/81/16/57/1123811657.db2.gz OWZJEDGKOZVMJV-NXEZZACHSA-N 1 0 289.753 3.769 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H]2CS[C@@H](C(C)(C)C)C2)c1 ZINC000862478479 1123813148 /nfs/dbraw/zinc/81/31/48/1123813148.db2.gz HYWJDXHLJJPRMC-UKRRQHHQSA-N 1 0 279.449 3.710 20 10 CHCDRO C[N@H+](Cc1cc(-c2ccccc2)ccc1O)CC1(C)COC1 ZINC000862477767 1123813585 /nfs/dbraw/zinc/81/35/85/1123813585.db2.gz QOHWJPBKSITTDI-UHFFFAOYSA-N 1 0 297.398 3.528 20 10 CHCDRO CC[C@@H]([NH2+]CCCCSC)c1ccccc1O ZINC000119186889 1123835721 /nfs/dbraw/zinc/83/57/21/1123835721.db2.gz HXYUDUWATIWWEW-CYBMUJFWSA-N 1 0 253.411 3.576 20 10 CHCDRO CCOc1cccc(C[NH2+]C(C2CCC2)C2CCC2)c1O ZINC000324968075 1123848838 /nfs/dbraw/zinc/84/88/38/1123848838.db2.gz ZGXSSEBSQICGOX-UHFFFAOYSA-N 1 0 289.419 3.849 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]Cc1cccc2cccnc21 ZINC000083552299 1129150793 /nfs/dbraw/zinc/15/07/93/1129150793.db2.gz ZPUHZWYPKPEXQM-UHFFFAOYSA-N 1 0 298.773 3.884 20 10 CHCDRO CN(C)c1ccc(C[NH2+]CC(C)(C)c2cccs2)cc1 ZINC000083601894 1129150866 /nfs/dbraw/zinc/15/08/66/1129150866.db2.gz NVZLMHNOBPEINN-UHFFFAOYSA-N 1 0 288.460 3.882 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC[C@](C)(O)CC2)cc1C(C)C ZINC000794664289 1123923673 /nfs/dbraw/zinc/92/36/73/1123923673.db2.gz CJGPPGQYZRSFJR-SFHVURJKSA-N 1 0 291.435 3.561 20 10 CHCDRO CC[C@@H]([NH2+]CCN(C(C)C)C(C)C)c1ccccc1O ZINC000084523728 1129153512 /nfs/dbraw/zinc/15/35/12/1129153512.db2.gz VJUKENBSOHYZPQ-MRXNPFEDSA-N 1 0 278.440 3.552 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CC3(CCC3)C[C@H]2C)c1 ZINC000763648395 1129154499 /nfs/dbraw/zinc/15/44/99/1129154499.db2.gz SHKQNVFREAZSDI-CYBMUJFWSA-N 1 0 275.392 3.555 20 10 CHCDRO C[C@H]1CC2(CCC2)C[N@@H+]1Cc1ccc(N(C)C)c(F)c1 ZINC000763647962 1129155166 /nfs/dbraw/zinc/15/51/66/1129155166.db2.gz PHHSRKOCUZMVJY-ZDUSSCGKSA-N 1 0 276.399 3.656 20 10 CHCDRO CC[C@H]([NH2+]Cc1csc(C)n1)c1ccc(C)cc1O ZINC000794797683 1123950270 /nfs/dbraw/zinc/95/02/70/1123950270.db2.gz PRJRERDZSOHKDW-AWEZNQCLSA-N 1 0 276.405 3.706 20 10 CHCDRO CCCC[C@@H](COC)[NH2+][C@H](CC)c1ccc(C)cc1O ZINC000794801662 1123950724 /nfs/dbraw/zinc/95/07/24/1123950724.db2.gz KDKMYNOKASONGL-GOEBONIOSA-N 1 0 279.424 3.947 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](CCO)CC(C)C)c1ccc(C)cc1O ZINC000794802155 1123950741 /nfs/dbraw/zinc/95/07/41/1123950741.db2.gz MVAZOZXNXNENQM-WBVHZDCISA-N 1 0 293.451 3.786 20 10 CHCDRO CC[C@H]([NH2+]CCCCSC)c1ccc(C)cc1O ZINC000794805566 1123954112 /nfs/dbraw/zinc/95/41/12/1123954112.db2.gz XGCDWUDGPHFLCV-AWEZNQCLSA-N 1 0 267.438 3.885 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](O)c1ccccc1C)c1ccc(C)cc1O ZINC000794806395 1123955770 /nfs/dbraw/zinc/95/57/70/1123955770.db2.gz IGRZQFFERPBBPV-MJGOQNOKSA-N 1 0 299.414 3.783 20 10 CHCDRO CC[C@H]([NH2+]C[C@@](C)(O)c1ccccc1)c1ccc(C)cc1O ZINC000794807843 1123956680 /nfs/dbraw/zinc/95/66/80/1123956680.db2.gz MBYBKNIVYVBEMV-PKOBYXMFSA-N 1 0 299.414 3.649 20 10 CHCDRO CC[C@H]([NH2+][C@@H](CO)C1CCCCC1)c1ccc(C)cc1O ZINC000794818363 1123960152 /nfs/dbraw/zinc/96/01/52/1123960152.db2.gz SFUXXTVCLZSCKF-IRXDYDNUSA-N 1 0 291.435 3.683 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H]2CC[C@@H](C)[C@H](C)C2)c1O ZINC000085042235 1129156075 /nfs/dbraw/zinc/15/60/75/1129156075.db2.gz UOPDHVSXPPRQFG-UMVBOHGHSA-N 1 0 277.408 3.705 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1ccc(N(C)CC)cc1)[C@@H](O)C(C)C ZINC000840882096 1123982007 /nfs/dbraw/zinc/98/20/07/1123982007.db2.gz MCBXPBIREKEPLA-JLSDUUJJSA-N 1 0 292.467 3.589 20 10 CHCDRO COc1ccc(C[NH2+]Cc2ccc(N(C)C)cc2C)c(C)c1 ZINC000840937019 1124030770 /nfs/dbraw/zinc/03/07/70/1124030770.db2.gz RHHHUDMYKHRLTI-UHFFFAOYSA-N 1 0 298.430 3.668 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)CCc1cccnc1 ZINC000866268538 1124044723 /nfs/dbraw/zinc/04/47/23/1124044723.db2.gz XWVCYAJZAZYTOF-MRXNPFEDSA-N 1 0 297.446 3.567 20 10 CHCDRO CC[C@H]([NH2+]CC[C@@H]1CCSC1)c1ccc(C)cc1O ZINC000866401595 1124062760 /nfs/dbraw/zinc/06/27/60/1124062760.db2.gz BEDWOIYKYSKALX-HIFRSBDPSA-N 1 0 279.449 3.885 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC[C@H]2CCSC2)c(O)c1C ZINC000866401876 1124063160 /nfs/dbraw/zinc/06/31/60/1124063160.db2.gz GAWKUNVFXSLLQD-KBPBESRZSA-N 1 0 279.449 3.803 20 10 CHCDRO C[C@@H]([NH2+]CC[C@@H]1CCSC1)c1cc(Cl)ccc1O ZINC000866403494 1124063803 /nfs/dbraw/zinc/06/38/03/1124063803.db2.gz QOIZZLQBUPBFNZ-GHMZBOCLSA-N 1 0 285.840 3.839 20 10 CHCDRO Cc1ncc([C@H](C)[NH2+][C@@H](C)c2cc(F)ccc2O)s1 ZINC000866455465 1124068026 /nfs/dbraw/zinc/06/80/26/1124068026.db2.gz LUNYBMCKXYSGAN-IUCAKERBSA-N 1 0 280.368 3.708 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)o1 ZINC000866478938 1124069708 /nfs/dbraw/zinc/06/97/08/1124069708.db2.gz OGBNWAKFPZWBOJ-CYBMUJFWSA-N 1 0 259.349 3.761 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C2CCC2)[C@H]2CCOC2)c1 ZINC000866511185 1124076695 /nfs/dbraw/zinc/07/66/95/1124076695.db2.gz BHJJYLGSFSQFAR-YEWWUXTCSA-N 1 0 289.419 3.556 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1ccnn1C)c1cc(Cl)ccc1O ZINC000866613873 1124088688 /nfs/dbraw/zinc/08/86/88/1124088688.db2.gz JRXYJMDZQTZVEH-GWCFXTLKSA-N 1 0 293.798 3.581 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccnn1C)c1ccc2ccccc2c1O ZINC000866615000 1124089455 /nfs/dbraw/zinc/08/94/55/1124089455.db2.gz RYWUIUFYHIWDFW-OLZOCXBDSA-N 1 0 295.386 3.691 20 10 CHCDRO CC(C)(C)c1ccc(C[NH2+]CCc2ccc(N)cc2)s1 ZINC000841037186 1124111473 /nfs/dbraw/zinc/11/14/73/1124111473.db2.gz YYGFIJNZSMPGQG-UHFFFAOYSA-N 1 0 288.460 3.960 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1C[C@@H](C)O[C@@H](C)C1)c1ccc(N(C)C)cc1 ZINC001119822913 1131265293 /nfs/dbraw/zinc/26/52/93/1131265293.db2.gz LUKQLLRGLPQDFK-QXSJWSMHSA-N 1 0 290.451 3.607 20 10 CHCDRO CC[C@H]([NH2+][C@@H](CC)[C@H](O)c1ccccc1)c1ccccc1O ZINC000872133523 1124692766 /nfs/dbraw/zinc/69/27/66/1124692766.db2.gz QOEUUTXYIRUSSI-JENIJYKNSA-N 1 0 299.414 3.945 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1nccnc1C)c1ccc(C)cc1O ZINC000872135106 1124693517 /nfs/dbraw/zinc/69/35/17/1124693517.db2.gz VFTHQEHJUVCDNG-HIFRSBDPSA-N 1 0 285.391 3.601 20 10 CHCDRO c1csc(SCCC[NH2+]C2CCCCCC2)n1 ZINC000124253133 1124730033 /nfs/dbraw/zinc/73/00/33/1124730033.db2.gz RQYMPZUYGKSQHA-UHFFFAOYSA-N 1 0 270.467 3.938 20 10 CHCDRO CCCOc1ccc(C[NH2+][C@@H]2CCCc3cn[nH]c32)cc1C ZINC000873080201 1124736368 /nfs/dbraw/zinc/73/63/68/1124736368.db2.gz LEAPZMGLGPLSGI-MRXNPFEDSA-N 1 0 299.418 3.674 20 10 CHCDRO CCOC1CC(CC[NH2+]Cc2cc(Cl)c(C)cc2O)C1 ZINC000825671936 1124760248 /nfs/dbraw/zinc/76/02/48/1124760248.db2.gz ULSRWCVQDBXMBF-UHFFFAOYSA-N 1 0 297.826 3.649 20 10 CHCDRO Cc1cccc(C[NH2+]CCc2ccc(Cl)cc2)c1O ZINC000124647878 1124803250 /nfs/dbraw/zinc/80/32/50/1124803250.db2.gz OPHONOQLNIEKBT-UHFFFAOYSA-N 1 0 275.779 3.686 20 10 CHCDRO COc1ccccc1[C@@H]1CC[N@H+](Cc2ccc(C)cc2O)C1 ZINC000876756916 1124975210 /nfs/dbraw/zinc/97/52/10/1124975210.db2.gz ACFQWHDDIGNISW-OAHLLOKOSA-N 1 0 297.398 3.699 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2ccccc2COC(C)C)c(O)c1 ZINC000876913599 1124989946 /nfs/dbraw/zinc/98/99/46/1124989946.db2.gz RUODTRAIJIJCLE-UHFFFAOYSA-N 1 0 299.414 3.915 20 10 CHCDRO Cc1ccc(C[NH2+][C@H]2CCc3cc(F)ccc32)c(O)c1 ZINC000876973888 1124992764 /nfs/dbraw/zinc/99/27/64/1124992764.db2.gz RLISKVVHQVEVJP-INIZCTEOSA-N 1 0 271.335 3.617 20 10 CHCDRO Cc1ccc2c(c1)CC[C@H]2[NH2+]Cc1ccc(C)cc1O ZINC000876973327 1124993713 /nfs/dbraw/zinc/99/37/13/1124993713.db2.gz DMGJVWDPWVEMRF-QGZVFWFLSA-N 1 0 267.372 3.786 20 10 CHCDRO COc1ccc(Cl)cc1C[NH2+]Cc1ccc(C)cc1O ZINC000876982597 1124994593 /nfs/dbraw/zinc/99/45/93/1124994593.db2.gz COOYLWAHTLNGGX-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO Cc1ccc(C[NH2+]C2(c3ccccc3)CCC2)c(O)c1 ZINC000876991369 1124994893 /nfs/dbraw/zinc/99/48/93/1124994893.db2.gz MJMAUIZIYYMFQR-UHFFFAOYSA-N 1 0 267.372 3.870 20 10 CHCDRO Cc1ccc(C[NH2+][C@H]2c3ccccc3C[C@H]2C)c(O)c1 ZINC000877008571 1124996127 /nfs/dbraw/zinc/99/61/27/1124996127.db2.gz NCKFWNWPURTFFI-FZKQIMNGSA-N 1 0 267.372 3.724 20 10 CHCDRO Cc1csc([C@@H]([NH2+]Cc2ccc(C)cc2O)C2CC2)n1 ZINC000877066820 1125005753 /nfs/dbraw/zinc/00/57/53/1125005753.db2.gz UXTWUETVRORQFA-HNNXBMFYSA-N 1 0 288.416 3.706 20 10 CHCDRO CC[C@@H]([NH2+]CC1(C)CC1)c1cc(Br)ccc1O ZINC000229563073 1131324627 /nfs/dbraw/zinc/32/46/27/1131324627.db2.gz UXAAZFAHFIXCDW-GFCCVEGCSA-N 1 0 298.224 3.996 20 10 CHCDRO COc1ccc(C[NH2+]Cc2c(C)cccc2O)cc1Cl ZINC000877109425 1125009997 /nfs/dbraw/zinc/00/99/97/1125009997.db2.gz KSURLQWKSFITEK-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO Cc1ccc(C[NH+]2CCC(c3ccc(C)nc3)CC2)c(O)c1 ZINC000877197263 1125018828 /nfs/dbraw/zinc/01/88/28/1125018828.db2.gz QUXIUQJKBDUGHI-UHFFFAOYSA-N 1 0 296.414 3.784 20 10 CHCDRO COc1cc(C[NH+]2CC(C3CC3)C2)c(O)c(C(C)(C)C)c1 ZINC000825956146 1125022917 /nfs/dbraw/zinc/02/29/17/1125022917.db2.gz XYSUYPMAPTUXOS-UHFFFAOYSA-N 1 0 289.419 3.540 20 10 CHCDRO CCn1ccnc1[C@@H]1CCCC[N@@H+]1Cc1ccc(C)cc1O ZINC000877494886 1125035464 /nfs/dbraw/zinc/03/54/64/1125035464.db2.gz VOIWQJHQFOVYNK-INIZCTEOSA-N 1 0 299.418 3.644 20 10 CHCDRO Cc1ccc(C[NH2+]CC2CCC(F)(F)CC2)c(O)c1 ZINC000877501973 1125035840 /nfs/dbraw/zinc/03/58/40/1125035840.db2.gz XKCQXZYCGHATOP-UHFFFAOYSA-N 1 0 269.335 3.616 20 10 CHCDRO CCCC[N@H+](CCC[C@@H]1CCO1)Cc1ccccc1O ZINC000877503422 1125036977 /nfs/dbraw/zinc/03/69/77/1125036977.db2.gz LPNYYOLSNGYPQD-MRXNPFEDSA-N 1 0 277.408 3.563 20 10 CHCDRO Cc1ccc(C[NH2+]C[C@H]2CCCC(F)(F)C2)c(O)c1 ZINC000877498855 1125037321 /nfs/dbraw/zinc/03/73/21/1125037321.db2.gz VTHGKWCNIUJVCC-LBPRGKRZSA-N 1 0 269.335 3.616 20 10 CHCDRO CC[C@@H](c1ccncc1)[N@H+](C)Cc1ccc(C)cc1O ZINC000877532742 1125040667 /nfs/dbraw/zinc/04/06/67/1125040667.db2.gz WUSYSOSFQQNAPS-INIZCTEOSA-N 1 0 270.376 3.679 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H](C)[C@H]1CC1(F)F ZINC000877592648 1125050299 /nfs/dbraw/zinc/05/02/99/1125050299.db2.gz RIZDJRARIHCSNT-HEHGZKQESA-N 1 0 296.405 3.625 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)c2ccc3c(c2)CCCO3)c(O)c1 ZINC000877644147 1125058593 /nfs/dbraw/zinc/05/85/93/1125058593.db2.gz RGWAHBUGJVUKDA-CQSZACIVSA-N 1 0 297.398 3.876 20 10 CHCDRO CCC(F)(F)C(C)(C)C[NH2+]Cc1ccc(C)cc1O ZINC000877655847 1125059509 /nfs/dbraw/zinc/05/95/09/1125059509.db2.gz MWEOHQARIBEPLF-UHFFFAOYSA-N 1 0 271.351 3.862 20 10 CHCDRO COc1ccc(O)c(C[NH2+]Cc2ccc(C(C)(C)C)o2)c1 ZINC000877735025 1125069400 /nfs/dbraw/zinc/06/94/00/1125069400.db2.gz NAORINRQTDWTKS-UHFFFAOYSA-N 1 0 289.375 3.581 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CC(C)(C)O2)c1ccccc1O ZINC000877756302 1125072916 /nfs/dbraw/zinc/07/29/16/1125072916.db2.gz FVUMZJUGBLGABQ-CYBMUJFWSA-N 1 0 297.398 3.957 20 10 CHCDRO CC(C)c1cnc(C[NH2+][C@@H](C)c2ccccc2O)s1 ZINC000877757412 1125074563 /nfs/dbraw/zinc/07/45/63/1125074563.db2.gz ZJTZWIZSOWMHSX-NSHDSACASA-N 1 0 276.405 3.823 20 10 CHCDRO CCO[P@@](C)(=O)CC[C@H](C)[NH2+][C@@H](C)c1ccccc1O ZINC000877758321 1125074595 /nfs/dbraw/zinc/07/45/95/1125074595.db2.gz SVSVRXSGVQCLMY-KQHSUYLTSA-N 1 0 299.351 3.766 20 10 CHCDRO CCc1cccc(C[NH2+][C@@H](C)c2cc3cnccc3o2)c1O ZINC000877768360 1125077572 /nfs/dbraw/zinc/07/75/72/1125077572.db2.gz PMILOVPGFJSWRM-LBPRGKRZSA-N 1 0 296.370 3.947 20 10 CHCDRO CO[C@H]1CC[N@H+](Cc2cc(Cl)c(C)cc2O)CC1(C)C ZINC000826062420 1125169561 /nfs/dbraw/zinc/16/95/61/1125169561.db2.gz RIIXKFIENOMBCO-HNNXBMFYSA-N 1 0 297.826 3.601 20 10 CHCDRO C[C@@H]([NH2+]Cc1cncc(C(F)(F)F)c1)c1ccccc1O ZINC000879649012 1125222903 /nfs/dbraw/zinc/22/29/03/1125222903.db2.gz HIUCRHTXFRVGPL-SNVBAGLBSA-N 1 0 296.292 3.657 20 10 CHCDRO COc1ccc(Cl)c(C[NH2+][C@H](C)c2ccccc2O)c1 ZINC000879649490 1125223042 /nfs/dbraw/zinc/22/30/42/1125223042.db2.gz UWFFZJOFDBLRJN-LLVKDONJSA-N 1 0 291.778 3.905 20 10 CHCDRO COCC[C@H]([NH2+][C@@H](C)c1ccccc1O)c1ccccc1 ZINC000879650551 1125223959 /nfs/dbraw/zinc/22/39/59/1125223959.db2.gz GYXBGOUWGRBJGA-YOEHRIQHSA-N 1 0 285.387 3.821 20 10 CHCDRO CO[C@](C)([C@H](C)[NH2+]Cc1cc(Cl)c(C)cc1O)C1CC1 ZINC000826120896 1125225570 /nfs/dbraw/zinc/22/55/70/1125225570.db2.gz LAHXFNZIENBLQA-MEDUHNTESA-N 1 0 297.826 3.647 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@H]2CCC3(CCC3)O2)c(O)c1 ZINC000883357848 1125401258 /nfs/dbraw/zinc/40/12/58/1125401258.db2.gz WFKWOSWZGJCJEN-HUUCEWRRSA-N 1 0 289.419 3.761 20 10 CHCDRO CCc1ccc(C[NH2+]Cc2ccc3c(c2)CCCN3C)o1 ZINC000131639408 1125402030 /nfs/dbraw/zinc/40/20/30/1125402030.db2.gz QSPOURBHJIEVCO-UHFFFAOYSA-N 1 0 284.403 3.514 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@@H]1c3ccccc3CC[C@H]1F)CC2 ZINC000883378016 1125405032 /nfs/dbraw/zinc/40/50/32/1125405032.db2.gz XVHFLYFTZQYFHA-GPMSIDNRSA-N 1 0 297.373 3.995 20 10 CHCDRO Oc1ccccc1C[NH2+][C@@H]1c2ccccc2CC[C@H]1F ZINC000883382434 1125406836 /nfs/dbraw/zinc/40/68/36/1125406836.db2.gz GXMQXJHCVYUVTP-NVXWUHKLSA-N 1 0 271.335 3.507 20 10 CHCDRO C[C@@H]([NH2+]CCCSc1nccs1)c1ccccc1 ZINC000132183925 1125415440 /nfs/dbraw/zinc/41/54/40/1125415440.db2.gz WUDHVPBCSYBLLC-GFCCVEGCSA-N 1 0 278.446 3.976 20 10 CHCDRO CCOc1cccc(C[N@H+](C)C2CCCCCC2)c1O ZINC000132360522 1125417368 /nfs/dbraw/zinc/41/73/68/1125417368.db2.gz QDSIXEAJJDMBME-UHFFFAOYSA-N 1 0 277.408 3.946 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCC[C@@H]2C2CCCC2)c1 ZINC000132817011 1125422925 /nfs/dbraw/zinc/42/29/25/1125422925.db2.gz RHGRXSWZJQCHLN-MRXNPFEDSA-N 1 0 259.393 3.855 20 10 CHCDRO Cc1ccc2c(cccc2Nc2cccc(O)c2O)n1 ZINC001212797862 1125448805 /nfs/dbraw/zinc/44/88/05/1125448805.db2.gz OLTNASTZXKAUNC-UHFFFAOYSA-N 1 0 266.300 3.698 20 10 CHCDRO COCC[C@@H]([NH2+]Cc1cc(Cl)ccc1O)c1ccco1 ZINC000779995369 1129181452 /nfs/dbraw/zinc/18/14/52/1129181452.db2.gz MXMLVZDBHJFCEB-CYBMUJFWSA-N 1 0 295.766 3.506 20 10 CHCDRO Cc1ccccc1[C@H]1C[N@H+](Cc2ccccc2O)[C@@H](C)CO1 ZINC000245636842 1129214300 /nfs/dbraw/zinc/21/43/00/1129214300.db2.gz XGLFVBJYTAXYJL-HNAYVOBHSA-N 1 0 297.398 3.663 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]CCc1c[nH]c3ccccc13)CC2 ZINC000296113836 1129220381 /nfs/dbraw/zinc/22/03/81/1129220381.db2.gz UXOVSCUUPDOWIT-KRWDZBQOSA-N 1 0 292.382 3.693 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCCCC1(F)F)c1ccccc1O ZINC000296443373 1129222400 /nfs/dbraw/zinc/22/24/00/1129222400.db2.gz ZQTLIROAQIFPBA-NEPJUHHUSA-N 1 0 269.335 3.868 20 10 CHCDRO CCn1ccnc1C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000296662348 1129223293 /nfs/dbraw/zinc/22/32/93/1129223293.db2.gz ZYKIPLZVNIHUMJ-CYBMUJFWSA-N 1 0 295.386 3.613 20 10 CHCDRO Cc1ccc(O)c(C[N@H+]2C[C@@H](C)OC[C@H]2c2ccccc2)c1 ZINC000245773338 1129224878 /nfs/dbraw/zinc/22/48/78/1129224878.db2.gz SFCNRSSYPWFHJT-QAPCUYQASA-N 1 0 297.398 3.663 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)c2cc(F)ccc2O)cc1F ZINC000184910211 1129261724 /nfs/dbraw/zinc/26/17/24/1129261724.db2.gz OHXRRJNHLYPWAZ-LLVKDONJSA-N 1 0 277.314 3.830 20 10 CHCDRO COc1ccccc1C[C@@H](C)[NH2+][C@@H](C)c1ccccc1O ZINC000037778492 1129268543 /nfs/dbraw/zinc/26/85/43/1129268543.db2.gz GZXMEGGQOASMSX-KGLIPLIRSA-N 1 0 285.387 3.683 20 10 CHCDRO C[C@H]1C[N@H+](Cc2ccc(N(C)C)cc2)Cc2ccccc2O1 ZINC000795428723 1129273951 /nfs/dbraw/zinc/27/39/51/1129273951.db2.gz BAEXMVXAMQLEQK-HNNXBMFYSA-N 1 0 296.414 3.536 20 10 CHCDRO COc1cc(C)cc(C[N@@H+]2C[C@@H](C)[C@H]2c2ccccc2)c1O ZINC000246496889 1129287303 /nfs/dbraw/zinc/28/73/03/1129287303.db2.gz KCSZXTFNCPALOS-KDOFPFPSSA-N 1 0 297.398 3.902 20 10 CHCDRO CCCc1ccc(C[NH2+]Cc2cc(OC)ccc2O)cc1 ZINC000734003698 1129290726 /nfs/dbraw/zinc/29/07/26/1129290726.db2.gz VKNJRPFKEZHFBT-UHFFFAOYSA-N 1 0 285.387 3.643 20 10 CHCDRO COc1cccc(C[NH2+]CC[C@@H]2CCCC[C@@H]2C)c1O ZINC000734005017 1129290992 /nfs/dbraw/zinc/29/09/92/1129290992.db2.gz OCEPZALUVOODLN-KBPBESRZSA-N 1 0 277.408 3.707 20 10 CHCDRO Oc1cc2c(cc1C[NH+](CC1CC1)CC1CC1)CCC2 ZINC000734478034 1129310777 /nfs/dbraw/zinc/31/07/77/1129310777.db2.gz UEDIISRJZMXJMZ-UHFFFAOYSA-N 1 0 271.404 3.503 20 10 CHCDRO CCOc1ccc(C[NH2+]C2CCC3(CC3)CC2)c(O)c1 ZINC000766213543 1129343810 /nfs/dbraw/zinc/34/38/10/1129343810.db2.gz QKTXRPRREAUEJR-UHFFFAOYSA-N 1 0 275.392 3.603 20 10 CHCDRO C[N@H+](Cc1cnc(C2CCC2)s1)Cc1ccccc1O ZINC000091974649 1129375816 /nfs/dbraw/zinc/37/58/16/1129375816.db2.gz NBVITHQRFCMWJH-UHFFFAOYSA-N 1 0 288.416 3.748 20 10 CHCDRO COc1cccc(C[NH2+]C[C@@H]2CCC[C@@H](C)[C@H]2C)c1O ZINC000795588905 1129378437 /nfs/dbraw/zinc/37/84/37/1129378437.db2.gz QOELZYHBXBSQKR-MCIONIFRSA-N 1 0 277.408 3.563 20 10 CHCDRO C[C@H]1CCCCC[N@@H+]1Cc1c(O)ccc2ccncc21 ZINC000738221147 1129390851 /nfs/dbraw/zinc/39/08/51/1129390851.db2.gz CDYZYDKNRGLPGN-ZDUSSCGKSA-N 1 0 270.376 3.705 20 10 CHCDRO C[C@H]1CCCCC[N@@H+]1Cc1cc2c(cc1O)CCC2 ZINC000738225551 1129391247 /nfs/dbraw/zinc/39/12/47/1129391247.db2.gz GDXDRMQEBXGZPG-ZDUSSCGKSA-N 1 0 259.393 3.645 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](C)Cc2ccc(C)s2)c1 ZINC000093049420 1129415980 /nfs/dbraw/zinc/41/59/80/1129415980.db2.gz AFNHLPGYXMBQBI-UHFFFAOYSA-N 1 0 291.416 3.793 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1C[C@H]1c1ccccc1)c1ccccc1O ZINC000248390932 1129416731 /nfs/dbraw/zinc/41/67/31/1129416731.db2.gz UKWFVBPAEDYNPA-LXZKKBNFSA-N 1 0 267.372 3.847 20 10 CHCDRO CC[C@@H](C)[C@@H](C)[N@H+](Cc1cccc(OC)c1O)C1CC1 ZINC000093132209 1129417932 /nfs/dbraw/zinc/41/79/32/1129417932.db2.gz DDCVSRMFIRZMLL-CHWSQXEVSA-N 1 0 277.408 3.800 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCS[C@@H]3CCCC[C@@H]32)c1 ZINC000093690285 1129427030 /nfs/dbraw/zinc/42/70/30/1129427030.db2.gz ONDZUCMEOFNYOJ-GOEBONIOSA-N 1 0 277.433 3.561 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](C)CCc2cccs2)c1 ZINC000093685567 1129427184 /nfs/dbraw/zinc/42/71/84/1129427184.db2.gz KZPXYNGLIZIBCU-UHFFFAOYSA-N 1 0 291.416 3.527 20 10 CHCDRO Cc1cccc(OCC[NH2+][C@H](C)c2cc(F)ccc2O)c1 ZINC000094617942 1129448234 /nfs/dbraw/zinc/44/82/34/1129448234.db2.gz OZUCFAGGXAWLJI-CYBMUJFWSA-N 1 0 289.350 3.569 20 10 CHCDRO CCc1ccccc1C[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000094618343 1129448267 /nfs/dbraw/zinc/44/82/67/1129448267.db2.gz ANNOSXGUAUVZOT-LBPRGKRZSA-N 1 0 273.351 3.945 20 10 CHCDRO C[C@H]([NH2+]CCc1cccc(F)c1)c1cc(F)ccc1O ZINC000094617111 1129448344 /nfs/dbraw/zinc/44/83/44/1129448344.db2.gz KRLUPSWTXCVDKF-NSHDSACASA-N 1 0 277.314 3.564 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CCn3cccc3[C@@H]2C)cc1 ZINC000741752654 1129451488 /nfs/dbraw/zinc/45/14/88/1129451488.db2.gz DFIVDBGYZFHZFX-HNNXBMFYSA-N 1 0 283.419 3.521 20 10 CHCDRO CCCCC[C@H](CCC)[NH2+]Cc1ccc(O)cc1O ZINC001258664164 1129472755 /nfs/dbraw/zinc/47/27/55/1129472755.db2.gz GRRKZXMLBICOKG-AWEZNQCLSA-N 1 0 265.397 3.936 20 10 CHCDRO CCC(CC)(CC)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000742374342 1129475263 /nfs/dbraw/zinc/47/52/63/1129475263.db2.gz VRVCXOCQZHAZHD-UHFFFAOYSA-N 1 0 266.404 3.950 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H]2C[C@H]2Cc2ccccc2)cc1F ZINC000742375689 1129475560 /nfs/dbraw/zinc/47/55/60/1129475560.db2.gz VRGTVGBAIYLAGI-AEFFLSMTSA-N 1 0 298.405 3.613 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H]2CC[C@H]3CCC[C@H]3C2)c1 ZINC000742378341 1129476025 /nfs/dbraw/zinc/47/60/25/1129476025.db2.gz FJKFOLPTJVICCW-IJEWVQPXSA-N 1 0 259.393 3.759 20 10 CHCDRO COc1ccc(C[NH2+]C[C@@H](C)Oc2ccc(C)cc2)cc1C ZINC000742380142 1129476144 /nfs/dbraw/zinc/47/61/44/1129476144.db2.gz IQIMWCQKZIDPEH-MRXNPFEDSA-N 1 0 299.414 3.869 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCS[C@H](C(C)C)C2)cc1C ZINC000743400082 1129522305 /nfs/dbraw/zinc/52/23/05/1129522305.db2.gz QOIYSKZGEFIFTN-INIZCTEOSA-N 1 0 279.449 3.582 20 10 CHCDRO CCC[C@@]1(C)CCC[N@H+](Cc2cc3c(cc2O)OCO3)C1 ZINC000743404037 1129522620 /nfs/dbraw/zinc/52/26/20/1129522620.db2.gz GVNXWJPMKNNBSO-KRWDZBQOSA-N 1 0 291.391 3.523 20 10 CHCDRO CC1CCC(C)([NH2+]Cc2ccc3c(c2)CCO3)CC1 ZINC000303407913 1129542546 /nfs/dbraw/zinc/54/25/46/1129542546.db2.gz UCMACXXJLGCPKD-UHFFFAOYSA-N 1 0 259.393 3.680 20 10 CHCDRO CCOc1cccc(C[N@@H+]2C[C@H](C)C[C@@H](C)[C@H]2C)c1O ZINC000253093278 1129609893 /nfs/dbraw/zinc/60/98/93/1129609893.db2.gz IFLUVVTVPFGWLX-MGPQQGTHSA-N 1 0 277.408 3.657 20 10 CHCDRO CC[C@H](C[C@H](C)CO)[NH2+][C@@H](CC)c1ccc(N(C)C)cc1 ZINC000766360153 1129659368 /nfs/dbraw/zinc/65/93/68/1129659368.db2.gz JARQZCPJJWGHTJ-LESCRADOSA-N 1 0 292.467 3.590 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CC[C@@H]1C)c1cc(Br)ccc1O ZINC000379795252 1129659948 /nfs/dbraw/zinc/65/99/48/1129659948.db2.gz LASLYGYMQKFTAU-TVYUQYBPSA-N 1 0 298.224 3.994 20 10 CHCDRO CCCN(CC)CC[NH2+][C@@H](CC)c1ccc(N(C)C)cc1 ZINC000766397806 1129662266 /nfs/dbraw/zinc/66/22/66/1129662266.db2.gz BZFYRLBDTBADQI-SFHVURJKSA-N 1 0 291.483 3.525 20 10 CHCDRO CCO[C@@H](CC[NH2+][C@@H](C)c1ccc(N(C)C)cc1)C(C)C ZINC000766387518 1129663671 /nfs/dbraw/zinc/66/36/71/1129663671.db2.gz HEKBJFOPIPJVLB-YJBOKZPZSA-N 1 0 292.467 3.854 20 10 CHCDRO CCCC(O)(CCC)C[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000788602422 1129664208 /nfs/dbraw/zinc/66/42/08/1129664208.db2.gz NJQRFJZIAXBYQI-OAHLLOKOSA-N 1 0 293.451 3.991 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](C)Cc2ccncc2)cc1 ZINC000766488504 1129669628 /nfs/dbraw/zinc/66/96/28/1129669628.db2.gz JPRPKPHATBGPDQ-HOTGVXAUSA-N 1 0 297.446 3.820 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)Cc1ccncc1)c1ccc(N(C)C)cc1 ZINC000766487952 1129669719 /nfs/dbraw/zinc/66/97/19/1129669719.db2.gz IXPBQVVSGYCWPZ-BEFAXECRSA-N 1 0 297.446 3.820 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CC(C)(C)C[C@H](C)O)cc1 ZINC000305772015 1129674519 /nfs/dbraw/zinc/67/45/19/1129674519.db2.gz RWAHCMVPJRVDIQ-LSDHHAIUSA-N 1 0 292.467 3.590 20 10 CHCDRO C[C@@H]([NH2+]CCNc1ccccc1)c1ccc(N(C)C)cc1 ZINC000766513612 1129677467 /nfs/dbraw/zinc/67/74/67/1129677467.db2.gz CZDHCVLRQPAMGW-OAHLLOKOSA-N 1 0 283.419 3.515 20 10 CHCDRO C[C@H]([NH2+]CCNc1ccccc1)c1ccc(N(C)C)cc1 ZINC000766513611 1129677656 /nfs/dbraw/zinc/67/76/56/1129677656.db2.gz CZDHCVLRQPAMGW-HNNXBMFYSA-N 1 0 283.419 3.515 20 10 CHCDRO CC[C@H]([NH2+][C@H]1C[C@@H](OC)C1(C)C)c1ccc(N(C)C)cc1 ZINC000766529446 1129684115 /nfs/dbraw/zinc/68/41/15/1129684115.db2.gz PVWVQYDPWGEOKR-YESZJQIVSA-N 1 0 290.451 3.607 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2ccc(F)cn2)cc1 ZINC000766609348 1129706049 /nfs/dbraw/zinc/70/60/49/1129706049.db2.gz XMZIGXDUEFUWIK-ZDUSSCGKSA-N 1 0 287.382 3.528 20 10 CHCDRO CCC[C@@H](C)[C@@H]1CCC[N@@H+]1Cc1cc2c(cc1O)OCO2 ZINC000767763302 1129813134 /nfs/dbraw/zinc/81/31/34/1129813134.db2.gz LKDVNYCTUQFQIN-OCCSQVGLSA-N 1 0 291.391 3.522 20 10 CHCDRO CCOc1ccc(C[N@H+](C)Cc2ccccc2C)c(O)c1 ZINC000768161311 1129838211 /nfs/dbraw/zinc/83/82/11/1129838211.db2.gz XGNIGJNVHLPNOA-UHFFFAOYSA-N 1 0 285.387 3.731 20 10 CHCDRO C[C@@H]1CCC[N@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000016076976 1129839691 /nfs/dbraw/zinc/83/96/91/1129839691.db2.gz REFQRGQCDUHFQB-CYBMUJFWSA-N 1 0 255.361 3.777 20 10 CHCDRO Cc1cccc(OCC[N@@H+](C)Cc2cc(C)ccc2O)c1 ZINC000768213992 1129844027 /nfs/dbraw/zinc/84/40/27/1129844027.db2.gz XQBSJOBNPPGEFQ-UHFFFAOYSA-N 1 0 285.387 3.520 20 10 CHCDRO COc1cccc(O)c1C[NH+]1CCC(c2ccccc2)CC1 ZINC000768232465 1129845365 /nfs/dbraw/zinc/84/53/65/1129845365.db2.gz AMGGDEHACNLNCO-UHFFFAOYSA-N 1 0 297.398 3.780 20 10 CHCDRO CCc1cccc(C[NH2+][C@H](C)c2ncc(C)s2)c1O ZINC000691446354 1129850340 /nfs/dbraw/zinc/85/03/40/1129850340.db2.gz NRJIVNBXDLXVSA-LLVKDONJSA-N 1 0 276.405 3.570 20 10 CHCDRO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)Cc1cccc(O)c1 ZINC000768354080 1129853205 /nfs/dbraw/zinc/85/32/05/1129853205.db2.gz WSMWFKIVIAHOCW-UHFFFAOYSA-N 1 0 298.430 3.869 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCC(F)(F)C1)c1ccc(N(C)C)cc1 ZINC000381949984 1129853722 /nfs/dbraw/zinc/85/37/22/1129853722.db2.gz AWFFXFHDFFCUFC-AAEUAGOBSA-N 1 0 268.351 3.591 20 10 CHCDRO CCc1cccc(C[NH2+][C@H]2CCC[C@@H](SC)C2)c1O ZINC000691449750 1129854449 /nfs/dbraw/zinc/85/44/49/1129854449.db2.gz FLPNJZOBNASXFB-LSDHHAIUSA-N 1 0 279.449 3.718 20 10 CHCDRO COc1cc(C[NH+]2CCC3(CCCC3)CC2)c(O)cc1C ZINC000768445220 1129857334 /nfs/dbraw/zinc/85/73/34/1129857334.db2.gz GLRFDJCREAFZPY-UHFFFAOYSA-N 1 0 289.419 3.865 20 10 CHCDRO Oc1cc2c(cc1C[NH+]1Cc3ccccc3C1)CCCC2 ZINC000768452060 1129857575 /nfs/dbraw/zinc/85/75/75/1129857575.db2.gz NSUUQXHBHRAWKU-UHFFFAOYSA-N 1 0 279.383 3.787 20 10 CHCDRO COc1cc(C[N@@H+]2CCC3(C2)CCCCC3)c(O)cc1C ZINC000768465776 1129859055 /nfs/dbraw/zinc/85/90/55/1129859055.db2.gz LBBRELOFWNUHRE-UHFFFAOYSA-N 1 0 289.419 3.865 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2cc(-c3ccccc3)ccc2O)[C@H](C)CO1 ZINC000768536269 1129861231 /nfs/dbraw/zinc/86/12/31/1129861231.db2.gz GXYXNOKJJIAITC-HUUCEWRRSA-N 1 0 297.398 3.668 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H]2Cc3ccc(Cl)cc3C2)c1 ZINC000800288535 1129864642 /nfs/dbraw/zinc/86/46/42/1129864642.db2.gz RNUUZIOZLWIIAQ-MRXNPFEDSA-N 1 0 287.790 3.611 20 10 CHCDRO Cc1csc(C[NH2+][C@H]2CCc3cccc(O)c32)c1 ZINC000394120657 1129874131 /nfs/dbraw/zinc/87/41/31/1129874131.db2.gz WOQNARLKMJWGFD-ZDUSSCGKSA-N 1 0 259.374 3.539 20 10 CHCDRO Cc1cc([C@@H]2CCC[N@@H+]2Cc2c(O)cccc2Cl)on1 ZINC000768876995 1129879105 /nfs/dbraw/zinc/87/91/05/1129879105.db2.gz FMFGYKPGUCMBPD-ZDUSSCGKSA-N 1 0 292.766 3.679 20 10 CHCDRO CC[C@H]([NH2+]CC1(COC)CCC1)c1cc(Cl)ccc1O ZINC000800493071 1129879619 /nfs/dbraw/zinc/87/96/19/1129879619.db2.gz ILCUCHXHYZYJAT-AWEZNQCLSA-N 1 0 297.826 3.903 20 10 CHCDRO Cc1cccc(C[NH2+][C@H]2Cc3ccc(Cl)cc3C2)c1O ZINC000800528904 1129882484 /nfs/dbraw/zinc/88/24/84/1129882484.db2.gz VYXCXUZYWBFCQK-INIZCTEOSA-N 1 0 287.790 3.611 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CCC[C@H]3CCC[C@H]32)c(O)c1 ZINC000769102525 1129889542 /nfs/dbraw/zinc/88/95/42/1129889542.db2.gz OLAOKXHOLFKVDL-CZUORRHYSA-N 1 0 275.392 3.555 20 10 CHCDRO CCOc1ccc(C[NH2+][C@@H](C)c2ccsc2)c(O)c1 ZINC000800889634 1129896997 /nfs/dbraw/zinc/89/69/97/1129896997.db2.gz RTHFNXZMQIVZLX-NSHDSACASA-N 1 0 277.389 3.703 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H]2C2CCC2)cc1 ZINC000769246232 1129898694 /nfs/dbraw/zinc/89/86/94/1129898694.db2.gz XYWVVKOUGLBDIZ-QGZVFWFLSA-N 1 0 258.409 3.517 20 10 CHCDRO FCCC[C@H]1CCC[C@@H]1[NH2+]Cc1ccc2c(c1)CCO2 ZINC000800969100 1129900905 /nfs/dbraw/zinc/90/09/05/1129900905.db2.gz HACXFFULLMNLIN-ZBFHGGJFSA-N 1 0 277.383 3.630 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2ccc(N(C)C)c(F)c2)s1 ZINC000769316623 1129901696 /nfs/dbraw/zinc/90/16/96/1129901696.db2.gz LMWKPKWJCXQPPB-UHFFFAOYSA-N 1 0 292.423 3.894 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H](O)c2cc(C)cc(C)c2)c1 ZINC000800992883 1129902681 /nfs/dbraw/zinc/90/26/81/1129902681.db2.gz UUUAMNOHZURSEE-BEFAXECRSA-N 1 0 299.414 3.702 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H](O)c2cc(C)cc(C)c2)c1 ZINC000800992886 1129902983 /nfs/dbraw/zinc/90/29/83/1129902983.db2.gz UUUAMNOHZURSEE-KXBFYZLASA-N 1 0 299.414 3.702 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC[C@@H](c3ccccc3F)C2)c1 ZINC000769378254 1129905264 /nfs/dbraw/zinc/90/52/64/1129905264.db2.gz ASQOPOXHZZMEGA-CQSZACIVSA-N 1 0 285.362 3.829 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCCc3sccc3C2)cc1 ZINC000769380042 1129905377 /nfs/dbraw/zinc/90/53/77/1129905377.db2.gz FXYOSGIZSGYZRS-UHFFFAOYSA-N 1 0 286.444 3.763 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2[C@H](C)C[C@@H]3CCCC[C@H]32)c1 ZINC000769404168 1129906835 /nfs/dbraw/zinc/90/68/35/1129906835.db2.gz KCPOFQSWTJOMMY-JKIFEVAISA-N 1 0 289.419 3.944 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)CCC1CC1 ZINC000769410974 1129907084 /nfs/dbraw/zinc/90/70/84/1129907084.db2.gz CLCYUDNOFKRLRZ-AWEZNQCLSA-N 1 0 260.425 3.729 20 10 CHCDRO CC[C@@H](Cc1ccccc1)[N@H+](C)Cc1cccc(OC)c1O ZINC000769487071 1129909588 /nfs/dbraw/zinc/90/95/88/1129909588.db2.gz HELYITFFVDCLHM-KRWDZBQOSA-N 1 0 299.414 3.854 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CCS[C@@H]2CCCC[C@@H]21 ZINC000769497890 1129913683 /nfs/dbraw/zinc/91/36/83/1129913683.db2.gz HBWDNDVRDNFYOZ-DZGCQCFKSA-N 1 0 297.851 3.906 20 10 CHCDRO COc1cccc(C[N@@H+]2CC[C@@](C)(c3ccccc3)C2)c1O ZINC000769502828 1129914221 /nfs/dbraw/zinc/91/42/21/1129914221.db2.gz ALNNGHYZUMBUGU-LJQANCHMSA-N 1 0 297.398 3.564 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC[C@@H]2Cc2ccccc2)c1 ZINC000769505530 1129914582 /nfs/dbraw/zinc/91/45/82/1129914582.db2.gz CXVMCQKRLIELFR-QGZVFWFLSA-N 1 0 267.372 3.518 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CC[C@@H]2Cc2ccccc2)cc1C ZINC000769505898 1129914972 /nfs/dbraw/zinc/91/49/72/1129914972.db2.gz JZALONLPJPMHDT-GOSISDBHSA-N 1 0 281.399 3.826 20 10 CHCDRO CCS[C@@H]1CC[C@@H]([N@H+](C)Cc2c(O)cccc2OC)C1 ZINC000769549022 1129917142 /nfs/dbraw/zinc/91/71/42/1129917142.db2.gz JUWGXIWUTIPHAI-CHWSQXEVSA-N 1 0 295.448 3.507 20 10 CHCDRO CCCC[N@@H+](Cc1ccccc1O)C[C@@H]1CCO[C@H](C)C1 ZINC000801594988 1129931246 /nfs/dbraw/zinc/93/12/46/1129931246.db2.gz TVTPTSJYNJEVCU-HZPDHXFCSA-N 1 0 291.435 3.809 20 10 CHCDRO CCCC[N@@H+](Cc1ccccc1O)C[C@@H]1CCO[C@@H](C)C1 ZINC000801594989 1129931366 /nfs/dbraw/zinc/93/13/66/1129931366.db2.gz TVTPTSJYNJEVCU-JKSUJKDBSA-N 1 0 291.435 3.809 20 10 CHCDRO COC(C)(C)C[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000770317831 1129944341 /nfs/dbraw/zinc/94/43/41/1129944341.db2.gz LNFWMTFLKHRNQS-UHFFFAOYSA-N 1 0 290.451 3.534 20 10 CHCDRO COc1cccc(O)c1C[N@H+]1CC=C(C(C)(C)C)CC1 ZINC000770383848 1129945142 /nfs/dbraw/zinc/94/51/42/1129945142.db2.gz KYXRMYQEORWRPI-UHFFFAOYSA-N 1 0 275.392 3.579 20 10 CHCDRO COc1cccc(C[NH+]2CCC(CC(C)C)CC2)c1O ZINC000770349064 1129945551 /nfs/dbraw/zinc/94/55/51/1129945551.db2.gz DOZZOLLCJFBHDE-UHFFFAOYSA-N 1 0 277.408 3.659 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CCCC[C@H](SC)C2)c(O)c1 ZINC000770351669 1129946065 /nfs/dbraw/zinc/94/60/65/1129946065.db2.gz UDOVJFVDOLEOQC-HNNXBMFYSA-N 1 0 295.448 3.508 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+](C)[C@H](C)[C@H]2Cc3ccccc3O2)c1 ZINC000770349829 1129946116 /nfs/dbraw/zinc/94/61/16/1129946116.db2.gz NLCKDUGRVIICAC-AUUYWEPGSA-N 1 0 297.398 3.525 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCC[C@H]1CCc1ccccc1 ZINC000770509099 1129947965 /nfs/dbraw/zinc/94/79/65/1129947965.db2.gz HXZPMWBCUKVVGO-SFHVURJKSA-N 1 0 281.399 3.989 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2ccccc2O)[C@@H]2CCCC[C@H]12 ZINC000770510088 1129948017 /nfs/dbraw/zinc/94/80/17/1129948017.db2.gz XHJMBYSYLJYJDF-FVQBIDKESA-N 1 0 259.393 3.793 20 10 CHCDRO Oc1ccccc1C[N@H+](CCc1cccc(F)c1)C1CC1 ZINC000770510120 1129948310 /nfs/dbraw/zinc/94/83/10/1129948310.db2.gz JVGSGRWSVPCAEM-UHFFFAOYSA-N 1 0 285.362 3.738 20 10 CHCDRO CCc1ccccc1C[NH2+]Cc1cccc(CC)c1O ZINC000691484121 1129951038 /nfs/dbraw/zinc/95/10/38/1129951038.db2.gz SRLJFVKHIYCNHJ-UHFFFAOYSA-N 1 0 269.388 3.807 20 10 CHCDRO C[C@@H]1C[N@@H+](Cc2cc(-c3ccccc3)ccc2O)C[C@H](C)O1 ZINC000772599695 1130033908 /nfs/dbraw/zinc/03/39/08/1130033908.db2.gz 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CCN(CC)c1ccc(C[NH2+][C@@H](C)[C@]2(C)CCCO2)cc1 ZINC000788546767 1130193764 /nfs/dbraw/zinc/19/37/64/1130193764.db2.gz LQDSHCFMPYKZPF-YJBOKZPZSA-N 1 0 290.451 3.580 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H](C(C)C)[C@H](O)c2ccccc2)c1 ZINC000788537967 1130193910 /nfs/dbraw/zinc/19/39/10/1130193910.db2.gz ZZCPYDLFELPTAK-RTBURBONSA-N 1 0 299.414 3.548 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H](CCO)CC(C)C)c(O)c1 ZINC000788611368 1130195622 /nfs/dbraw/zinc/19/56/22/1130195622.db2.gz NAPGUYPMMZKJDE-HOTGVXAUSA-N 1 0 293.451 3.704 20 10 CHCDRO Cc1cccc([C@H](O)C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)c1 ZINC000788669445 1130201947 /nfs/dbraw/zinc/20/19/47/1130201947.db2.gz OMKYUFHMYSRCJE-MAUKXSAKSA-N 1 0 299.414 3.702 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H]2c3ccccc3NC2(C)C)c1 ZINC000903949181 1130211999 /nfs/dbraw/zinc/21/19/99/1130211999.db2.gz ZTTZWCMUZKOMCZ-KRWDZBQOSA-N 1 0 282.387 3.736 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@@H](C)C2CCC(F)(F)CC2)c1 ZINC000788983481 1130221411 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ZINC000811514460 1130618839 /nfs/dbraw/zinc/61/88/39/1130618839.db2.gz LDAMUZGGKRFEIO-UHFFFAOYSA-N 1 0 263.356 3.543 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CC3(CCC3)[C@H]2C2CC2)cc1F ZINC000811513945 1130619594 /nfs/dbraw/zinc/61/95/94/1130619594.db2.gz XBRBPADNGWLPCC-QGZVFWFLSA-N 1 0 288.410 3.656 20 10 CHCDRO COc1ccc2ccc(O)c(C[N@H+](C)C3CC(C)C3)c2c1 ZINC001234525864 1130654111 /nfs/dbraw/zinc/65/41/11/1130654111.db2.gz LYFCXBJTBWONLV-UHFFFAOYSA-N 1 0 285.387 3.784 20 10 CHCDRO COc1ccc2ccc(O)c(C[N@H+](CC3CC3)C3CC3)c2c1 ZINC001234569276 1130657579 /nfs/dbraw/zinc/65/75/79/1130657579.db2.gz KKSHXHNUZCZRIY-UHFFFAOYSA-N 1 0 297.398 3.928 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)C[C@H]2CCCCO2)cc1 ZINC000759644395 1130666145 /nfs/dbraw/zinc/66/61/45/1130666145.db2.gz SKVAWVAHNHWESO-GOSISDBHSA-N 1 0 290.451 3.534 20 10 CHCDRO CC(C)(CC(F)(F)F)[NH2+]Cc1cc(Cl)ccc1O ZINC000780589039 1130685897 /nfs/dbraw/zinc/68/58/97/1130685897.db2.gz KRAUYEXNTFJGQO-UHFFFAOYSA-N 1 0 281.705 3.866 20 10 CHCDRO CCc1cccnc1[C@H](C)[NH2+]Cc1ccc(N(C)C)cc1C ZINC000780724438 1130688964 /nfs/dbraw/zinc/68/89/64/1130688964.db2.gz KVVWVVRXJZFOGI-HNNXBMFYSA-N 1 0 297.446 3.869 20 10 CHCDRO C[C@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1cc(F)ccc1O ZINC000780792597 1130693053 /nfs/dbraw/zinc/69/30/53/1130693053.db2.gz HPAIRVOVCTYCRM-ONGXEEELSA-N 1 0 291.288 3.694 20 10 CHCDRO CN(c1ccc(C[NH2+]C2CSC2)cc1)C1CCCCC1 ZINC000780872104 1130693522 /nfs/dbraw/zinc/69/35/22/1130693522.db2.gz GWUBQNCLYVDXDU-UHFFFAOYSA-N 1 0 290.476 3.661 20 10 CHCDRO C[N@H+](Cc1cccc(-c2ccccc2)c1O)C1CC1 ZINC001234991129 1130700170 /nfs/dbraw/zinc/70/01/70/1130700170.db2.gz KICBGWQHZBBTRI-UHFFFAOYSA-N 1 0 253.345 3.653 20 10 CHCDRO Oc1c(C[N@@H+]2C[C@@H]3C[C@H]2C[C@@H]3F)cccc1-c1ccccc1 ZINC001234999031 1130700906 /nfs/dbraw/zinc/70/09/06/1130700906.db2.gz QHIRNIACFODUBL-BQFCYCMXSA-N 1 0 297.373 3.992 20 10 CHCDRO C[C@H](Nc1cc2c(c[nH+]1)CCCC2)c1ccccc1O ZINC000812739201 1130710547 /nfs/dbraw/zinc/71/05/47/1130710547.db2.gz MXGWWJMIVHICLP-LBPRGKRZSA-N 1 0 268.360 3.839 20 10 CHCDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]CCCCF ZINC000812773672 1130712912 /nfs/dbraw/zinc/71/29/12/1130712912.db2.gz LXGCVIOUURJWMS-UHFFFAOYSA-N 1 0 273.351 3.899 20 10 CHCDRO Cc1cc(O)c(C[NH+]2CC(c3ccccc3F)C2)cc1C ZINC000812790690 1130713806 /nfs/dbraw/zinc/71/38/06/1130713806.db2.gz DIODTUBMOIVNTK-UHFFFAOYSA-N 1 0 285.362 3.748 20 10 CHCDRO CC[N@@H+](Cc1cc(-c2ccccc2)ccc1O)C[C@H](C)OC ZINC000812806950 1130720215 /nfs/dbraw/zinc/72/02/15/1130720215.db2.gz AQUGKQWQHLQWJA-HNNXBMFYSA-N 1 0 299.414 3.916 20 10 CHCDRO COCC1CC[NH+](Cc2ccc(C(C)(C)C)cc2O)CC1 ZINC001235673878 1130765577 /nfs/dbraw/zinc/76/55/77/1130765577.db2.gz AUMAMNXQTZLPMZ-UHFFFAOYSA-N 1 0 291.435 3.548 20 10 CHCDRO C[N@H+](Cc1cncs1)Cc1ccc(C(C)(C)C)cc1O ZINC001235678307 1130767359 /nfs/dbraw/zinc/76/73/59/1130767359.db2.gz AWEZBMWBOIXCFD-UHFFFAOYSA-N 1 0 290.432 3.778 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2c(O)ccc3ccncc32)[C@@H]2CCCC[C@@H]21 ZINC000782274313 1130768135 /nfs/dbraw/zinc/76/81/35/1130768135.db2.gz AMVMHJPMYYANNE-DDUZABMNSA-N 1 0 296.414 3.951 20 10 CHCDRO Cc1ccccc1O[C@H]1CCC[N@H+](Cc2ccc(N)cc2)C1 ZINC001235689723 1130769396 /nfs/dbraw/zinc/76/93/96/1130769396.db2.gz BXIBBHATAHGICC-SFHVURJKSA-N 1 0 296.414 3.621 20 10 CHCDRO Nc1ccc(C[N@@H+]2CCC[C@@H]2c2cc(F)ccc2F)cc1 ZINC001235714433 1130771746 /nfs/dbraw/zinc/77/17/46/1130771746.db2.gz LHEFHWCBUQIKDW-QGZVFWFLSA-N 1 0 288.341 3.884 20 10 CHCDRO CC(C)c1ccccc1C[NH2+]Cc1ccccc1O ZINC000782539842 1130782787 /nfs/dbraw/zinc/78/27/87/1130782787.db2.gz PADJQNZAEPQYFM-UHFFFAOYSA-N 1 0 255.361 3.805 20 10 CHCDRO COc1cccc(O)c1C[NH2+]C[C@H]1CCCCC(F)(F)C1 ZINC000813782099 1130783473 /nfs/dbraw/zinc/78/34/73/1130783473.db2.gz MNHNOWSSVCKSNO-LBPRGKRZSA-N 1 0 299.361 3.706 20 10 CHCDRO C[C@H]1C[C@H]([NH2+]CC2CC(F)(F)C2)c2c1c(F)ccc2O ZINC000813872901 1130793929 /nfs/dbraw/zinc/79/39/29/1130793929.db2.gz LGMJKBWICQVYMX-KWQFWETISA-N 1 0 285.309 3.715 20 10 CHCDRO C[C@H](COc1ccccc1)[NH2+][C@@H](C)c1ccccc1O ZINC000783505772 1130831727 /nfs/dbraw/zinc/83/17/27/1130831727.db2.gz QCMGONMUGBOLIF-KGLIPLIRSA-N 1 0 271.360 3.510 20 10 CHCDRO CCC[C@@H]([NH2+][C@@H](C)c1ccccc1O)c1ccccn1 ZINC000783510420 1130832156 /nfs/dbraw/zinc/83/21/56/1130832156.db2.gz YYVONCVCWBBXCI-XJKSGUPXSA-N 1 0 270.376 3.979 20 10 CHCDRO Cc1ccsc1CC[NH2+][C@H](C)c1ccccc1O ZINC000783524764 1130834311 /nfs/dbraw/zinc/83/43/11/1130834311.db2.gz AKFJGZGQZJQHCS-GFCCVEGCSA-N 1 0 261.390 3.655 20 10 CHCDRO C[C@H]([NH2+]CC(C)(C)[C@@H]1CCCCO1)c1ccccc1O ZINC000783520316 1130834520 /nfs/dbraw/zinc/83/45/20/1130834520.db2.gz XKDFXMQBAVCGLE-BBRMVZONSA-N 1 0 277.408 3.638 20 10 CHCDRO CC[C@@H]1CC[N@@H+]1Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000814178777 1130835063 /nfs/dbraw/zinc/83/50/63/1130835063.db2.gz CULHOINTGVRHSG-GFCCVEGCSA-N 1 0 286.341 3.756 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2C[C@H](C)O[C@H](C)[C@H]2C)cc1C(C)C ZINC000783546680 1130836843 /nfs/dbraw/zinc/83/68/43/1130836843.db2.gz SLLSXRTVRJWXLG-RRFJBIMHSA-N 1 0 291.435 3.822 20 10 CHCDRO Cc1cccc(C[N@@H+]2CC3(CCC3)[C@H]2C(C)C)c1O ZINC000814170931 1130839010 /nfs/dbraw/zinc/83/90/10/1130839010.db2.gz GQXCVDNADWLHFQ-MRXNPFEDSA-N 1 0 259.393 3.711 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H](OC)CC2)cc1 ZINC000783603211 1130841880 /nfs/dbraw/zinc/84/18/80/1130841880.db2.gz MUCQOYBCQKSWSO-GOSISDBHSA-N 1 0 290.451 3.534 20 10 CHCDRO CC[C@H]1c2ccccc2CC[N@H+]1Cc1ccc(N)cc1 ZINC001236060975 1130843260 /nfs/dbraw/zinc/84/32/60/1130843260.db2.gz UJHQCMITALSCJC-SFHVURJKSA-N 1 0 266.388 3.778 20 10 CHCDRO COc1cccc(O)c1C[N@H+](C)CC1(c2ccccc2)CC1 ZINC000783701299 1130849305 /nfs/dbraw/zinc/84/93/05/1130849305.db2.gz OMHQPVPSXSRASK-UHFFFAOYSA-N 1 0 297.398 3.564 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CSC[C@@H]1C)c1cc(Cl)ccc1O ZINC000797065956 1130958312 /nfs/dbraw/zinc/95/83/12/1130958312.db2.gz OBAZYIRWGQEFNA-XDTLVQLUSA-N 1 0 285.840 3.838 20 10 CHCDRO Cc1cc(C[N@@H+]2CCC(F)(F)[C@H](C)C2)ccc1N(C)C ZINC000815120279 1130958330 /nfs/dbraw/zinc/95/83/30/1130958330.db2.gz PFXUXLADSSKUIL-CYBMUJFWSA-N 1 0 282.378 3.538 20 10 CHCDRO CCS[C@H]1CCC[C@H]1[NH2+]Cc1ccc(N(C)C)c(C)c1 ZINC000815116671 1130958400 /nfs/dbraw/zinc/95/84/00/1130958400.db2.gz ZDCCJFDYQPEBIO-WBVHZDCISA-N 1 0 292.492 3.825 20 10 CHCDRO C[C@@H]([NH2+]CC1(C(F)(F)F)CC1)c1ccc(N(C)C)cc1 ZINC000797072947 1130958524 /nfs/dbraw/zinc/95/85/24/1130958524.db2.gz OCQJDJIHMIVWIY-LLVKDONJSA-N 1 0 286.341 3.746 20 10 CHCDRO CC1=C[C@@H](C)C[N@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C1 ZINC000797415634 1130986049 /nfs/dbraw/zinc/98/60/49/1130986049.db2.gz DDEAOYXIEVWEBN-GFCCVEGCSA-N 1 0 289.419 3.793 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]C[C@@H]1CCC(F)(F)C1 ZINC000797469274 1130989276 /nfs/dbraw/zinc/98/92/76/1130989276.db2.gz YCNHQYVZNPAOJJ-SECBINFHSA-N 1 0 275.726 3.571 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CCN2CCCC[C@@H]2C)c(O)c1 ZINC000815559868 1130999207 /nfs/dbraw/zinc/99/92/07/1130999207.db2.gz RTKZCJLSRDRGJJ-HOTGVXAUSA-N 1 0 290.451 3.534 20 10 CHCDRO Oc1cccc2c1C[N@H+](Cc1cccc3ccoc31)CC2 ZINC001236734318 1131001608 /nfs/dbraw/zinc/00/16/08/1131001608.db2.gz BSDVNZWSGBERQX-UHFFFAOYSA-N 1 0 279.339 3.697 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H]2Cc3ccccc32)c(O)c1 ZINC000815576079 1131001754 /nfs/dbraw/zinc/00/17/54/1131001754.db2.gz IVFVTHOSSCDDLC-ZBFHGGJFSA-N 1 0 281.399 4.000 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccn(C(C)C)n2)c(O)c1 ZINC000815582562 1131003136 /nfs/dbraw/zinc/00/31/36/1131003136.db2.gz JQCXFDHNQRLIAQ-CQSZACIVSA-N 1 0 287.407 3.637 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@@]2(C)CCCS2)c(O)c1 ZINC000815588376 1131005285 /nfs/dbraw/zinc/00/52/85/1131005285.db2.gz MIMIFXPKPYWYHX-CZUORRHYSA-N 1 0 279.449 3.945 20 10 CHCDRO CCc1ccc(C[N@H+](C)Cc2cccc(OC)c2)c(O)c1 ZINC001236789627 1131006269 /nfs/dbraw/zinc/00/62/69/1131006269.db2.gz PNEGLIIDENKALF-UHFFFAOYSA-N 1 0 285.387 3.595 20 10 CHCDRO CCc1ccc(C[N@@H+]2CC[C@H]3CCC[C@H]3C2)c(O)c1 ZINC001236786479 1131007635 /nfs/dbraw/zinc/00/76/35/1131007635.db2.gz PKRPRRZZAJEXSX-CABCVRRESA-N 1 0 259.393 3.577 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CC[C@@H]3CCC[C@@H]3C2)c(Cl)c1 ZINC001236796638 1131007997 /nfs/dbraw/zinc/00/79/97/1131007997.db2.gz XIXYXZJCYXHDFI-NWDGAFQWSA-N 1 0 295.810 3.676 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CCCc2cccc(C)n2)c(O)c1 ZINC000815625048 1131011257 /nfs/dbraw/zinc/01/12/57/1131011257.db2.gz RLGJOWMGNFYKRK-INIZCTEOSA-N 1 0 298.430 3.996 20 10 CHCDRO CCC[N@H+](Cc1c(C)cc(OC)cc1O)[C@@H](C)CC ZINC001236819528 1131014887 /nfs/dbraw/zinc/01/48/87/1131014887.db2.gz VZQYYSNGAJCQOO-ZDUSSCGKSA-N 1 0 265.397 3.720 20 10 CHCDRO C[N@H+](Cc1cncs1)Cc1cc2ccccc2cc1O ZINC001236834711 1131020090 /nfs/dbraw/zinc/02/00/90/1131020090.db2.gz BDZBULKHTMWKFU-UHFFFAOYSA-N 1 0 284.384 3.634 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H]2C[C@H](c3ccccc3)C2)c1 ZINC000797999559 1131020527 /nfs/dbraw/zinc/02/05/27/1131020527.db2.gz WOZUOOQMUKDHRM-FVQBIDKESA-N 1 0 297.398 3.998 20 10 CHCDRO Oc1cc2ccccc2cc1C[N@@H+]1CCC[C@@H](CF)C1 ZINC001236839581 1131021637 /nfs/dbraw/zinc/02/16/37/1131021637.db2.gz 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Oc1c(Cl)cccc1CNc1cc2c(c[nH+]1)CCC2 ZINC000816660584 1131122163 /nfs/dbraw/zinc/12/21/63/1131122163.db2.gz JHPJFZKCUBSVEP-UHFFFAOYSA-N 1 0 274.751 3.541 20 10 CHCDRO C[C@@H]1CC[C@H]([NH2+]Cc2c(O)cccc2Cl)C[C@H]1C ZINC000252503632 1131124778 /nfs/dbraw/zinc/12/47/78/1131124778.db2.gz NCJLENPLKJFLPH-UTUOFQBUSA-N 1 0 267.800 3.960 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2CCC[C@@H](C)C2)cc1Br ZINC001237677578 1131126962 /nfs/dbraw/zinc/12/69/62/1131126962.db2.gz OMIYNLWXIOTDII-SNVBAGLBSA-N 1 0 298.224 3.695 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](C)C(C)(C)C)cc1Br ZINC001237679816 1131127054 /nfs/dbraw/zinc/12/70/54/1131127054.db2.gz VBGQLRWMVKTNCT-UHFFFAOYSA-N 1 0 286.213 3.693 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+](C)CC2CCCC2)c1O ZINC001237685060 1131127280 /nfs/dbraw/zinc/12/72/80/1131127280.db2.gz CYXIZVHTYMZJOB-UHFFFAOYSA-N 1 0 267.800 3.976 20 10 CHCDRO C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1cc(F)cc(Cl)c1[O-] ZINC001237812479 1131142832 /nfs/dbraw/zinc/14/28/32/1131142832.db2.gz HDXKEVIFHKNFRX-VHSXEESVSA-N 1 0 271.763 3.805 20 10 CHCDRO C[C@H]([N@H+](C)Cc1ccc(N2CCCC2)cc1)C1(C)CC1 ZINC001116448804 1131146748 /nfs/dbraw/zinc/14/67/48/1131146748.db2.gz FYIRJIHSJSWBGA-HNNXBMFYSA-N 1 0 272.436 3.907 20 10 CHCDRO C[C@@]1(F)CCCN(Cc2cc(F)c(Cl)cc2O)C1 ZINC001237934704 1131152646 /nfs/dbraw/zinc/15/26/46/1131152646.db2.gz NFJDYCWHGRWYOZ-CYBMUJFWSA-N 1 0 275.726 3.509 20 10 CHCDRO CC[C@@H]1CCC[N@@H+]1Cc1cc(F)c(Cl)cc1[O-] ZINC001237938237 1131153197 /nfs/dbraw/zinc/15/31/97/1131153197.db2.gz ZUBRAILFURDVSK-SNVBAGLBSA-N 1 0 257.736 3.559 20 10 CHCDRO C[N@H+](Cc1cccc(F)c1)Cc1cc(F)c(Cl)cc1[O-] ZINC001237935680 1131153792 /nfs/dbraw/zinc/15/37/92/1131153792.db2.gz XJWMXBBDBIVJQZ-UHFFFAOYSA-N 1 0 297.732 3.956 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000817412568 1131159949 /nfs/dbraw/zinc/15/99/49/1131159949.db2.gz MTFNBGUNXVSTKJ-NSHDSACASA-N 1 0 273.298 3.557 20 10 CHCDRO Cc1cc(F)cc(C[N@@H+]2Cc3ccccc3[C@@H](C)C2)c1O ZINC001238057837 1131164545 /nfs/dbraw/zinc/16/45/45/1131164545.db2.gz OLBSTSSVGRVYML-ZDUSSCGKSA-N 1 0 285.362 3.959 20 10 CHCDRO Cc1cc(F)cc(C[N@@H+]2CCC[C@@H]2c2cccnc2)c1O ZINC001238058813 1131164777 /nfs/dbraw/zinc/16/47/77/1131164777.db2.gz WKJJRZYLNVCXLT-MRXNPFEDSA-N 1 0 286.350 3.572 20 10 CHCDRO Cc1cc(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)cc(C)n1 ZINC000817590449 1131175200 /nfs/dbraw/zinc/17/52/00/1131175200.db2.gz XJHMSULSJDYYJF-LBPRGKRZSA-N 1 0 290.794 3.908 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2cc(C)nc(C)c2)c(O)c1 ZINC000817590423 1131175344 /nfs/dbraw/zinc/17/53/44/1131175344.db2.gz WTFMJETYYDHUGF-AWEZNQCLSA-N 1 0 270.376 3.563 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+]CCc2ccc(N)cc2)c2ccccc21 ZINC000817956699 1131190041 /nfs/dbraw/zinc/19/00/41/1131190041.db2.gz AVNKKXTUIYOJDG-ACJLOTCBSA-N 1 0 266.388 3.649 20 10 CHCDRO Nc1ccc(CC[NH2+][C@H]2CCc3cc(Cl)ccc32)cc1 ZINC000817955825 1131190149 /nfs/dbraw/zinc/19/01/49/1131190149.db2.gz IQBZRAZMJZXQQO-KRWDZBQOSA-N 1 0 286.806 3.742 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H](CN)C2CCCCC2)c(O)c1C ZINC000817957616 1131191181 /nfs/dbraw/zinc/19/11/81/1131191181.db2.gz DFNINISITYHVCI-WMLDXEAASA-N 1 0 290.451 3.567 20 10 CHCDRO CC[C@@H]1C[C@@H](C)CC[C@H]1[NH2+]CCc1ccc(N)cc1 ZINC000817957133 1131191198 /nfs/dbraw/zinc/19/11/98/1131191198.db2.gz JJRCQWWRVABOCY-YSVLISHTSA-N 1 0 260.425 3.616 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccc(N)cc1)c1cccc(OC)c1 ZINC000817956422 1131191372 /nfs/dbraw/zinc/19/13/72/1131191372.db2.gz YQWPANNFGGALTI-GOSISDBHSA-N 1 0 284.403 3.561 20 10 CHCDRO Cc1cccc(C[C@@H]([NH2+]CCc2ccc(N)cc2)C2CC2)c1 ZINC000817956403 1131191437 /nfs/dbraw/zinc/19/14/37/1131191437.db2.gz YHGNRHXEXGMQHR-HXUWFJFHSA-N 1 0 294.442 3.731 20 10 CHCDRO Cc1ccc([C@H](C)NCC[NH2+]C2CCCCCC2)c(O)c1 ZINC000817959352 1131192758 /nfs/dbraw/zinc/19/27/58/1131192758.db2.gz BTFVTWNUMMDHIL-HNNXBMFYSA-N 1 0 290.451 3.664 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCCc2cc(N)ccc21)c1ccccc1O ZINC000817967011 1131194207 /nfs/dbraw/zinc/19/42/07/1131194207.db2.gz CGMFKKMTGLBWLD-PXAZEXFGSA-N 1 0 282.387 3.703 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1C[C@H]2C[C@H]2C1)c1cc(Cl)ccc1O ZINC000818357825 1131211186 /nfs/dbraw/zinc/21/11/86/1131211186.db2.gz BDGCYKIARPWPCX-QPPBUOOMSA-N 1 0 265.784 3.885 20 10 CHCDRO FC1(F)C[C@@]12CC[N@H+](Cc1ccc(N3CCCC3)cc1)C2 ZINC001118240305 1131216507 /nfs/dbraw/zinc/21/65/07/1131216507.db2.gz QKBVLIDFDIXSGD-MRXNPFEDSA-N 1 0 292.373 3.518 20 10 CHCDRO COC1CC(CC[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)C1 ZINC001118428215 1131226060 /nfs/dbraw/zinc/22/60/60/1131226060.db2.gz RICSUYQLPXXSMM-VXGQWTEUSA-N 1 0 289.419 3.654 20 10 CHCDRO CSCC[N@H+](C)Cc1cc(C)n(-c2ccccc2)c1C ZINC001137859153 1131425282 /nfs/dbraw/zinc/42/52/82/1131425282.db2.gz LGVYVFOEEAPLSM-UHFFFAOYSA-N 1 0 288.460 3.889 20 10 CHCDRO CC[N@H+](Cc1ccc2ncccc2c1)Cc1ccccc1O ZINC001138112634 1131467036 /nfs/dbraw/zinc/46/70/36/1131467036.db2.gz VCYCWMOAMCRBLI-UHFFFAOYSA-N 1 0 292.382 3.963 20 10 CHCDRO Cc1c(C[NH+]2CC3(C2)CC(F)(F)C3)c2ccccc2n1C ZINC001138252707 1131482018 /nfs/dbraw/zinc/48/20/18/1131482018.db2.gz RLJXFBAPHBTROO-UHFFFAOYSA-N 1 0 290.357 3.718 20 10 CHCDRO Cc1c(C[N@H+]2CCCC[C@H]2C)c2ccccc2n1C ZINC001138252491 1131482555 /nfs/dbraw/zinc/48/25/55/1131482555.db2.gz IWXPTIKCOYZNKE-CYBMUJFWSA-N 1 0 256.393 3.861 20 10 CHCDRO Cc1c(C[N@@H+]2CC[C@]3(CC3(F)F)C2)c2ccccc2n1C ZINC001138256910 1131483053 /nfs/dbraw/zinc/48/30/53/1131483053.db2.gz PAWSCUCPMYIYLB-INIZCTEOSA-N 1 0 290.357 3.718 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCO[C@@H](C(C)C)C1)c1ccccc1O ZINC000824798826 1131485085 /nfs/dbraw/zinc/48/50/85/1131485085.db2.gz GRYVLRAUADSDTG-QILLFSRXSA-N 1 0 291.435 3.884 20 10 CHCDRO CCOc1cccc(C[NH2+]C23CCC(CC2)CC3)c1O ZINC000824936180 1131489363 /nfs/dbraw/zinc/48/93/63/1131489363.db2.gz SOHYBDAIQQBYGT-UHFFFAOYSA-N 1 0 275.392 3.603 20 10 CHCDRO Cc1ccc2c(C[N@@H+]3CCc4cccc(O)c4C3)c[nH]c2c1 ZINC001136975555 1131491090 /nfs/dbraw/zinc/49/10/90/1131491090.db2.gz LYRPRDJFDQXZAQ-UHFFFAOYSA-N 1 0 292.382 3.740 20 10 CHCDRO Oc1ccccc1C[NH+]1CC(c2ccc(Cl)cc2)C1 ZINC000824988176 1131493885 /nfs/dbraw/zinc/49/38/85/1131493885.db2.gz HYHDDQBERQNCGZ-UHFFFAOYSA-N 1 0 273.763 3.645 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)CC(C)C)c(OC)c1 ZINC001138387504 1131497359 /nfs/dbraw/zinc/49/73/59/1131497359.db2.gz FIRQYPSGWJERGR-UHFFFAOYSA-N 1 0 278.440 3.629 20 10 CHCDRO CC[C@@H]([NH2+]CC1(COC)CCCC1)c1ccccc1O ZINC000825244892 1131504679 /nfs/dbraw/zinc/50/46/79/1131504679.db2.gz AJPKZAITVVNANS-OAHLLOKOSA-N 1 0 277.408 3.640 20 10 CHCDRO Cc1cc(O)c(C[NH2+]Cc2cc(C(C)C)no2)cc1Cl ZINC000825266897 1131504732 /nfs/dbraw/zinc/50/47/32/1131504732.db2.gz NXDYASPXNRMPLM-UHFFFAOYSA-N 1 0 294.782 3.755 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C(C)(C)c2nccs2)cc1Cl ZINC000825279776 1131505691 /nfs/dbraw/zinc/50/56/91/1131505691.db2.gz XOMNXGWKMHYVPY-UHFFFAOYSA-N 1 0 296.823 3.835 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(Cl)c(C)cc1O)c1ccncc1 ZINC000825304409 1131505876 /nfs/dbraw/zinc/50/58/76/1131505876.db2.gz XFXLGAOXKDLORY-HNNXBMFYSA-N 1 0 290.794 3.990 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CCCc2nccs2)cc1Cl ZINC000825430054 1131510069 /nfs/dbraw/zinc/51/00/69/1131510069.db2.gz SFCSMMBVKGOVIA-UHFFFAOYSA-N 1 0 296.823 3.533 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1CCSC1)c1cc(Cl)ccc1O ZINC000790498851 1131545443 /nfs/dbraw/zinc/54/54/43/1131545443.db2.gz UQJJINVQUVYUMT-ZWNOBZJWSA-N 1 0 285.840 3.839 20 10 CHCDRO CCCOc1ccccc1C[N@H+](C)Cc1ccccc1O ZINC001138999118 1131570023 /nfs/dbraw/zinc/57/00/23/1131570023.db2.gz WXSUVZYCSJIHPU-UHFFFAOYSA-N 1 0 285.387 3.813 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CC[C@]2(CC2(F)F)C1 ZINC000844756318 1131595847 /nfs/dbraw/zinc/59/58/47/1131595847.db2.gz ABFDUQNQGXCRCP-INIZCTEOSA-N 1 0 289.325 3.777 20 10 CHCDRO Oc1cc2c(cc1C[N@@H+]1CCC[C@]3(CC3(F)F)C1)CCC2 ZINC000844745765 1131596709 /nfs/dbraw/zinc/59/67/09/1131596709.db2.gz GJBKDQBIJNPQGN-INIZCTEOSA-N 1 0 293.357 3.502 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CNc3ccccc3C2)c(O)c1 ZINC000844919342 1131607347 /nfs/dbraw/zinc/60/73/47/1131607347.db2.gz FLFVBLVZUWGMNQ-HOCLYGCPSA-N 1 0 296.414 3.696 20 10 CHCDRO CC[N@H+](Cc1cc2ccccc2n1C)Cc1ccccc1O ZINC001139872136 1131644518 /nfs/dbraw/zinc/64/45/18/1131644518.db2.gz GUJGVEONFZVERF-UHFFFAOYSA-N 1 0 294.398 3.906 20 10 CHCDRO Oc1cc(O)c(C[N@@H+]2CCCC[C@@H]2c2ccccc2)c(O)c1 ZINC001144499155 1131646732 /nfs/dbraw/zinc/64/67/32/1131646732.db2.gz CGMOMXTWAIWRJO-MRXNPFEDSA-N 1 0 299.370 3.531 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CCCC[C@H]1c1cccnc1 ZINC001140055515 1131660015 /nfs/dbraw/zinc/66/00/15/1131660015.db2.gz JAXIAIKFNYIOCO-INIZCTEOSA-N 1 0 286.350 3.654 20 10 CHCDRO Cc1ccc(C)c(C[NH+]2CCC(c3ccncc3)CC2)c1O ZINC001140179367 1131673232 /nfs/dbraw/zinc/67/32/32/1131673232.db2.gz JDDKJLXRLJSMTB-UHFFFAOYSA-N 1 0 296.414 3.784 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCCC(F)(F)[C@H](F)C2)c1O ZINC001140178642 1131673587 /nfs/dbraw/zinc/67/35/87/1131673587.db2.gz RZICUHXCAKRQGA-CYBMUJFWSA-N 1 0 287.325 3.578 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCCC23CCC3)c1 ZINC000845970677 1131673792 /nfs/dbraw/zinc/67/37/92/1131673792.db2.gz BMIKBCHLVOOPMD-WBMJQRKESA-N 1 0 275.392 3.774 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCC[C@H](c3ccccn3)C2)c1O ZINC001140182681 1131674274 /nfs/dbraw/zinc/67/42/74/1131674274.db2.gz XFFOWVQVDPOIIR-INIZCTEOSA-N 1 0 296.414 3.784 20 10 CHCDRO Cc1ccc(CC[N@@H+](C)Cc2c(C)ccc(C)c2O)cc1 ZINC001140182678 1131674622 /nfs/dbraw/zinc/67/46/22/1131674622.db2.gz XBHSGOIAZCJMCQ-UHFFFAOYSA-N 1 0 283.415 3.992 20 10 CHCDRO C[C@@H]1CCCC[C@@H]1OCC[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000834522363 1131681053 /nfs/dbraw/zinc/68/10/53/1131681053.db2.gz AOKDFOJHLCEYBX-UNEWFSDZSA-N 1 0 289.419 3.564 20 10 CHCDRO C[C@H](C[NH2+][C@H]1CCc2cccc(O)c21)c1cccc(F)c1 ZINC000834537488 1131681707 /nfs/dbraw/zinc/68/17/07/1131681707.db2.gz DQLRHDPYAOAKRL-WBMJQRKESA-N 1 0 285.362 3.912 20 10 CHCDRO C[C@]1(CC[NH2+]Cc2cc(Cl)ccc2O)C[C@@]1(F)Cl ZINC000846036674 1131681759 /nfs/dbraw/zinc/68/17/59/1131681759.db2.gz NLYIBLYLXULRMR-STQMWFEESA-N 1 0 292.181 3.840 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000846108295 1131686515 /nfs/dbraw/zinc/68/65/15/1131686515.db2.gz OHZLJXOEWGRYEP-ZDUSSCGKSA-N 1 0 287.737 3.667 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H]2c3ccccc3C[C@H]2C)c1O ZINC000846151273 1131692441 /nfs/dbraw/zinc/69/24/41/1131692441.db2.gz YSLBREMFFSHCQR-FHSNZYRGSA-N 1 0 297.398 3.985 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]C[C@H](SC)C(C)(C)C)c1O ZINC000846166555 1131692754 /nfs/dbraw/zinc/69/27/54/1131692754.db2.gz ZEFLOADQTGBTOV-RISCZKNCSA-N 1 0 297.464 3.829 20 10 CHCDRO C=Cc1ccc(CC[NH2+][C@H](C)c2cccc(OC)c2O)cc1 ZINC000846168704 1131693094 /nfs/dbraw/zinc/69/30/94/1131693094.db2.gz CSOQPHLNUAOJSR-CQSZACIVSA-N 1 0 297.398 3.937 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@@H](C2CC2)C2CCC2)c1O ZINC000846168181 1131693640 /nfs/dbraw/zinc/69/36/40/1131693640.db2.gz HWWCIJKQVUIRII-BDJLRTHQSA-N 1 0 275.392 3.630 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CCC2=CCCCC2)c1O ZINC000846138778 1131693716 /nfs/dbraw/zinc/69/37/16/1131693716.db2.gz UBEZVSHUDZVJDE-CYBMUJFWSA-N 1 0 275.392 3.942 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H]2CCCC[C@@H]2C)c1O ZINC000846135200 1131693888 /nfs/dbraw/zinc/69/38/88/1131693888.db2.gz BANNFDAISPZTIO-OBJOEFQTSA-N 1 0 263.381 3.630 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]C2CCC(C(F)F)CC2)c1O ZINC000846170730 1131694026 /nfs/dbraw/zinc/69/40/26/1131694026.db2.gz ZAYVSIMSCIXPJH-UNXYVOJBSA-N 1 0 299.361 3.875 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@H](C)c2ccsc2)c1O ZINC000846169281 1131694151 /nfs/dbraw/zinc/69/41/51/1131694151.db2.gz ZQQSKAMBQTYYOZ-GHMZBOCLSA-N 1 0 277.389 3.874 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@@H]2CCCc3occc32)c1O ZINC000846138241 1131694160 /nfs/dbraw/zinc/69/41/60/1131694160.db2.gz AGCBNDXIWOHFDT-BXUZGUMPSA-N 1 0 287.359 3.722 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]C[C@@H](C)c2ccccc2)c1O ZINC000846138122 1131694201 /nfs/dbraw/zinc/69/42/01/1131694201.db2.gz SVLJNGBWSDTGJY-ZIAGYGMSSA-N 1 0 285.387 3.855 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]Cc2c(C)cccc2F)c1O ZINC000846144213 1131694469 /nfs/dbraw/zinc/69/44/69/1131694469.db2.gz GKHDWUJZSOTOHR-LBPRGKRZSA-N 1 0 289.350 3.699 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@H](C)c2nc(C)cs2)c1O ZINC000846146675 1131694877 /nfs/dbraw/zinc/69/48/77/1131694877.db2.gz SDXJXSJKJDBORR-GHMZBOCLSA-N 1 0 292.404 3.578 20 10 CHCDRO COCC(C)(C)CCC[NH2+][C@H](C)c1cccc(OC)c1O ZINC000846174534 1131695076 /nfs/dbraw/zinc/69/50/76/1131695076.db2.gz XQVLEVVACGUGMR-CYBMUJFWSA-N 1 0 295.423 3.504 20 10 CHCDRO C[C@@H]([NH2+]C1(C2CCC2)CC1)c1ccc(N(C)C)cc1 ZINC000846206960 1131695958 /nfs/dbraw/zinc/69/59/58/1131695958.db2.gz JGOMHBAFPZWLDL-CYBMUJFWSA-N 1 0 258.409 3.736 20 10 CHCDRO Cc1ccccc1[C@@H]1C[C@H]1[NH2+][C@H]1CCc2cccc(O)c21 ZINC000846190336 1131698600 /nfs/dbraw/zinc/69/86/00/1131698600.db2.gz QNTGUZPIEKZJDY-YESZJQIVSA-N 1 0 279.383 3.834 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@@H]2C[C@H]2CC(C)(C)C)c1O ZINC000846192501 1131698964 /nfs/dbraw/zinc/69/89/64/1131698964.db2.gz XWTLOPVFPHTWKF-MBNYWOFBSA-N 1 0 277.408 3.876 20 10 CHCDRO Cc1ccccc1[C@@H]1C[C@H]1[NH2+][C@@H](C)c1ccccc1O ZINC000846192534 1131698988 /nfs/dbraw/zinc/69/89/88/1131698988.db2.gz YGTFTMALLNYEDX-RRQGHBQHSA-N 1 0 267.372 3.907 20 10 CHCDRO C[C@H](COCC1CC1)[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000846204000 1131699535 /nfs/dbraw/zinc/69/95/35/1131699535.db2.gz JLQRXHLACZNORV-MNOVXSKESA-N 1 0 283.799 3.511 20 10 CHCDRO CO[C@@H]1CCCC[C@H]1[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000846202766 1131699728 /nfs/dbraw/zinc/69/97/28/1131699728.db2.gz QZDPWMUPBIIPQV-WDBKCZKBSA-N 1 0 283.799 3.654 20 10 CHCDRO C[C@H](COCC1CC1)[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000846203772 1131700278 /nfs/dbraw/zinc/70/02/78/1131700278.db2.gz BDCYZPKMHMFSAV-MNOVXSKESA-N 1 0 283.799 3.511 20 10 CHCDRO CC[C@H](CC(F)(F)F)[NH2+][C@H]1CCc2cccc(O)c21 ZINC000834765451 1131703653 /nfs/dbraw/zinc/70/36/53/1131703653.db2.gz MJKRQBOTBZWNRI-MNOVXSKESA-N 1 0 273.298 3.700 20 10 CHCDRO C[C@@H]1CC(CC[NH2+][C@H]2CCc3cccc(O)c32)C[C@@H](C)O1 ZINC000834794119 1131706855 /nfs/dbraw/zinc/70/68/55/1131706855.db2.gz ORLFOERHPUEFIF-IOASZLSFSA-N 1 0 289.419 3.563 20 10 CHCDRO CC[C@@H]([NH2+]CCCC1CCOCC1)c1ccc(C)cc1O ZINC000834818857 1131707458 /nfs/dbraw/zinc/70/74/58/1131707458.db2.gz QFHKTCWGXNJXCP-QGZVFWFLSA-N 1 0 291.435 3.948 20 10 CHCDRO Cc1cc(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)ccn1 ZINC000834859592 1131713366 /nfs/dbraw/zinc/71/33/66/1131713366.db2.gz FCBFSFRRTLSQSD-NSHDSACASA-N 1 0 276.767 3.600 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2CCOC3(CCC3)C2)c1 ZINC000834882652 1131716982 /nfs/dbraw/zinc/71/69/82/1131716982.db2.gz NJEFFEIJSDWJFF-HUUCEWRRSA-N 1 0 289.419 3.701 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCOC2(CCC2)C1)c1cc(F)ccc1O ZINC000834881800 1131717176 /nfs/dbraw/zinc/71/71/76/1131717176.db2.gz BHIHEXYMKJSEEJ-OLZOCXBDSA-N 1 0 293.382 3.531 20 10 CHCDRO Cc1ccncc1C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000834887222 1131719153 /nfs/dbraw/zinc/71/91/53/1131719153.db2.gz QCZGDBMUERYQBT-RISCZKNCSA-N 1 0 286.350 3.573 20 10 CHCDRO CCn1ccnc1[C@H](C)[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000834897003 1131721484 /nfs/dbraw/zinc/72/14/84/1131721484.db2.gz XXCHQMAKUXEDRX-KGLIPLIRSA-N 1 0 287.407 3.637 20 10 CHCDRO CCCc1ncc(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)o1 ZINC000834898793 1131723235 /nfs/dbraw/zinc/72/32/35/1131723235.db2.gz GULPNMDZJGOJEP-CYBMUJFWSA-N 1 0 288.391 3.800 20 10 CHCDRO CCCc1ncc(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)o1 ZINC000834901233 1131724573 /nfs/dbraw/zinc/72/45/73/1131724573.db2.gz YYCLYSBPTRMOSM-ZDUSSCGKSA-N 1 0 288.391 3.800 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCOC(C)(C)C2)c(O)c1 ZINC000834909105 1131729942 /nfs/dbraw/zinc/72/99/42/1131729942.db2.gz JBPSHAPAQXDNIO-KBPBESRZSA-N 1 0 277.408 3.556 20 10 CHCDRO Cc1ccc(CC[NH2+][C@H](C)c2c(C)cc(C)cc2O)nc1 ZINC000834908114 1131730034 /nfs/dbraw/zinc/73/00/34/1131730034.db2.gz BSIKNKBJIOQDDG-OAHLLOKOSA-N 1 0 284.403 3.606 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H]2CCOC(C)(C)C2)c(O)c1 ZINC000834908201 1131730247 /nfs/dbraw/zinc/73/02/47/1131730247.db2.gz BTUWYVZZPFIKEU-HUUCEWRRSA-N 1 0 291.435 3.865 20 10 CHCDRO C[C@@H]1CCC[C@@H](C)[NH+]1Cc1ccc(Cl)cc1O ZINC001140461951 1131749734 /nfs/dbraw/zinc/74/97/34/1131749734.db2.gz ZWWNRSKJVHYIJW-GHMZBOCLSA-N 1 0 253.773 3.809 20 10 CHCDRO Oc1cc(Cl)ccc1C[NH+]1C2CCCC1CCC2 ZINC001140464645 1131750461 /nfs/dbraw/zinc/75/04/61/1131750461.db2.gz YLWFULVXAILDOW-UHFFFAOYSA-N 1 0 265.784 3.953 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]Cc2ccsc2)cc1 ZINC000835032511 1131761319 /nfs/dbraw/zinc/76/13/19/1131761319.db2.gz FYNQMNVZDUIVDT-ARJAWSKDSA-N 1 0 272.417 3.617 20 10 CHCDRO C[C@@H](Cc1ccco1)[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC000835036641 1131761690 /nfs/dbraw/zinc/76/16/90/1131761690.db2.gz PSMNLMIZQNZCMZ-DRDHIDPGSA-N 1 0 284.403 3.580 20 10 CHCDRO COC(C)(C)C[C@@H](C)[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC000835040228 1131762944 /nfs/dbraw/zinc/76/29/44/1131762944.db2.gz OHHVXSRPIYYNFC-MVGZEHJDSA-N 1 0 290.451 3.559 20 10 CHCDRO CS[C@@H]1CC[C@@H]([NH2+]C/C=C/c2ccc(N(C)C)cc2)C1 ZINC000835044263 1131763998 /nfs/dbraw/zinc/76/39/98/1131763998.db2.gz YPUWRFKVWAIYPL-GWOVIKRFSA-N 1 0 290.476 3.640 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]C[C@H]2CCC(F)(F)C2)cc1 ZINC000835050908 1131765243 /nfs/dbraw/zinc/76/52/43/1131765243.db2.gz GEGOVZXKJHCUCK-BWPKMQGJSA-N 1 0 294.389 3.791 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]CCC1CC(F)(F)C1 ZINC000835059784 1131767083 /nfs/dbraw/zinc/76/70/83/1131767083.db2.gz DAKZCVLHPDHZCL-UHFFFAOYSA-N 1 0 275.726 3.571 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2c([O-])cc(F)cc2F)cc1C ZINC001140585565 1131812530 /nfs/dbraw/zinc/81/25/30/1131812530.db2.gz ODSHTIKJEJUXCY-UHFFFAOYSA-N 1 0 291.341 3.919 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCCC[C@H]2c2cccnc2)c1 ZINC001140621362 1131831278 /nfs/dbraw/zinc/83/12/78/1131831278.db2.gz ZBCNAZTWZFUKEK-KRWDZBQOSA-N 1 0 282.387 3.823 20 10 CHCDRO CCc1ccc(C[N@H+](C)Cc2cc(C)ccc2O)cc1 ZINC001140623571 1131832642 /nfs/dbraw/zinc/83/26/42/1131832642.db2.gz WBHCKBQPYTTXCJ-UHFFFAOYSA-N 1 0 269.388 3.895 20 10 CHCDRO Cc1ccc(O)c(C[NH+]2CCC(c3cccc(O)c3)CC2)c1 ZINC001140623941 1131832866 /nfs/dbraw/zinc/83/28/66/1131832866.db2.gz XWIJPYNDUOKKSI-UHFFFAOYSA-N 1 0 297.398 3.786 20 10 CHCDRO Cc1ccc(O)c(C[NH+]2CCC(Cc3ccncc3)CC2)c1 ZINC001140623801 1131833032 /nfs/dbraw/zinc/83/30/32/1131833032.db2.gz SDHRRSWKPIJVHQ-UHFFFAOYSA-N 1 0 296.414 3.550 20 10 CHCDRO Cc1c(O)ccc(C[N@H+](C)C/C=C/c2ccccc2)c1O ZINC001140749337 1131906739 /nfs/dbraw/zinc/90/67/39/1131906739.db2.gz WALPNIAGBMFRPU-RMKNXTFCSA-N 1 0 283.371 3.551 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)c(C)c2)c1 ZINC000773001842 1131914131 /nfs/dbraw/zinc/91/41/31/1131914131.db2.gz SPVUKIFFSLKXON-OAHLLOKOSA-N 1 0 298.430 3.920 20 10 CHCDRO Oc1cccc2c1C[N@H+](Cc1coc3ccccc13)CC2 ZINC001140784961 1131915564 /nfs/dbraw/zinc/91/55/64/1131915564.db2.gz HBPULBPOYPTYFF-UHFFFAOYSA-N 1 0 279.339 3.697 20 10 CHCDRO CCC[N@H+](CC)Cc1ccc(N(C)C)cc1Cl ZINC001140921404 1131963503 /nfs/dbraw/zinc/96/35/03/1131963503.db2.gz DENPSZOTMQEQJX-UHFFFAOYSA-N 1 0 254.805 3.638 20 10 CHCDRO Cc1ccc(C[N@@H+]2CCCc3ccccc3C2)c(O)c1 ZINC001140950758 1131968899 /nfs/dbraw/zinc/96/88/99/1131968899.db2.gz GXYXMEMOSZYAOJ-UHFFFAOYSA-N 1 0 267.372 3.649 20 10 CHCDRO Cc1ccc(C[NH+]2CCC(Cc3ccncc3)CC2)c(O)c1 ZINC001140957483 1131973922 /nfs/dbraw/zinc/97/39/22/1131973922.db2.gz ARWMZAWNJPIVNM-UHFFFAOYSA-N 1 0 296.414 3.550 20 10 CHCDRO C[C@H](Cc1ccc(Cl)cc1)[NH2+]Cc1ccccc1O ZINC000036937511 1131984373 /nfs/dbraw/zinc/98/43/73/1131984373.db2.gz KHAVOQQFSYPDEZ-GFCCVEGCSA-N 1 0 275.779 3.766 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccccc1O)c1ccccc1OC ZINC000036995043 1131987326 /nfs/dbraw/zinc/98/73/26/1131987326.db2.gz GFNOZOBEPQKFHF-HNNXBMFYSA-N 1 0 271.360 3.642 20 10 CHCDRO c1c(C[NH+]2CC3(C2)CCCC3)cc2c3c1CCCN3CCC2 ZINC001141075456 1132004936 /nfs/dbraw/zinc/00/49/36/1132004936.db2.gz QGPICDXYSSGHQU-UHFFFAOYSA-N 1 0 296.458 3.761 20 10 CHCDRO CCC[N@H+](CC)Cc1cc2c3c(c1)CCCN3CCC2 ZINC001141074529 1132005512 /nfs/dbraw/zinc/00/55/12/1132005512.db2.gz KYDJMGUZTXZQNQ-UHFFFAOYSA-N 1 0 272.436 3.617 20 10 CHCDRO CCCC[N@H+](Cc1ccccc1)Cc1cc(O)ccc1O ZINC001141158592 1132030564 /nfs/dbraw/zinc/03/05/64/1132030564.db2.gz FZNYDJVYNLKOQC-UHFFFAOYSA-N 1 0 285.387 3.900 20 10 CHCDRO CC[C@H]1C[N@H+](Cc2ccc(N(C)CC)cc2)[C@@H](CC)CO1 ZINC001171778862 1132097473 /nfs/dbraw/zinc/09/74/73/1132097473.db2.gz QULLHEQMNXDWPE-WMZOPIPTSA-N 1 0 290.451 3.532 20 10 CHCDRO Cc1cc(C)c(C[NH2+][C@H]2CSc3ccccc3C2)c(O)c1 ZINC001172201557 1132148331 /nfs/dbraw/zinc/14/83/31/1132148331.db2.gz OESFYAPEYICDDE-OAHLLOKOSA-N 1 0 299.439 3.816 20 10 CHCDRO CC(C)OCC[C@H](C)[NH2+]Cc1cc2ccccc2cc1O ZINC001172439561 1132233660 /nfs/dbraw/zinc/23/36/60/1132233660.db2.gz BSBKYEWDPRKMCP-AWEZNQCLSA-N 1 0 287.403 3.839 20 10 CHCDRO C[N@@H+]1CC[C@@H](Oc2ccc(NN=C3C=CC(=O)C=C3)cc2)C1 ZINC001231319766 1132279774 /nfs/dbraw/zinc/27/97/74/1132279774.db2.gz KSZSXXPIHDLLHY-QGZVFWFLSA-N 1 0 297.358 3.891 20 10 CHCDRO C[C@H](CCCc1cccnc1)[NH2+][C@H]1CCc2cccc(O)c21 ZINC000840771076 1132285127 /nfs/dbraw/zinc/28/51/27/1132285127.db2.gz AAKCBHWNTVXPJF-PBHICJAKSA-N 1 0 296.414 3.776 20 10 CHCDRO CC[C@H]([NH2+][C@H]1C[C@H](OC)C12CCC2)c1ccc(C)cc1O ZINC000840807191 1132289589 /nfs/dbraw/zinc/28/95/89/1132289589.db2.gz RANLTACDSWUVBU-XIRDDKMYSA-N 1 0 289.419 3.699 20 10 CHCDRO CC1(C)C[NH+](Cc2ccc(OCc3ccccc3)cc2O)C1 ZINC001231466757 1132295340 /nfs/dbraw/zinc/29/53/40/1132295340.db2.gz VFJLQQSWPAIYSJ-UHFFFAOYSA-N 1 0 297.398 3.813 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CS[C@H](C)C1)c1ccc(N(C)C)cc1 ZINC000840857260 1132295730 /nfs/dbraw/zinc/29/57/30/1132295730.db2.gz WMUVALSSYNRJNQ-XPKDYRNWSA-N 1 0 278.465 3.687 20 10 CHCDRO CO[C@@](C)([C@H](C)[NH2+][C@H](C)c1ccc(C)cc1O)C1CC1 ZINC000840859518 1132296093 /nfs/dbraw/zinc/29/60/93/1132296093.db2.gz MYFGNKCVMOHHKV-IGCXYCKISA-N 1 0 277.408 3.555 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CS[C@H](C)C2)c(O)c1 ZINC000840858936 1132296710 /nfs/dbraw/zinc/29/67/10/1132296710.db2.gz DSXNMTCLDIKMOH-AGIUHOORSA-N 1 0 265.422 3.554 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CS[C@H](C)C1)c1cc(Cl)ccc1O ZINC000840860952 1132296990 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Cc1ccc([C@H]2CCC[N@@H+]2Cc2cccc(C)c2O)cn1 ZINC001231592096 1132320796 /nfs/dbraw/zinc/32/07/96/1132320796.db2.gz BEQYISHMEWKBJR-QGZVFWFLSA-N 1 0 282.387 3.741 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccc(N)cc1)[C@H](C)c1ccccc1 ZINC000841035313 1132321398 /nfs/dbraw/zinc/32/13/98/1132321398.db2.gz MHKUMFSUGMUBLJ-LSDHHAIUSA-N 1 0 268.404 3.593 20 10 CHCDRO Cc1cc(F)c(C[NH2+]CCc2ccc(N)cc2)c(Cl)c1 ZINC000841038693 1132322592 /nfs/dbraw/zinc/32/25/92/1132322592.db2.gz OIKOSJCQLRXRIJ-UHFFFAOYSA-N 1 0 292.785 3.702 20 10 CHCDRO C[C@]1(c2ccccc2)CC[C@H]([NH2+]CCc2ccc(N)cc2)C1 ZINC000841039045 1132322777 /nfs/dbraw/zinc/32/27/77/1132322777.db2.gz YHPIEWTUILHLQN-PMACEKPBSA-N 1 0 294.442 3.911 20 10 CHCDRO Nc1ccc(CC[NH2+][C@@H]2CCC[C@@H](C(F)(F)F)C2)cc1 ZINC000841038037 1132323218 /nfs/dbraw/zinc/32/32/18/1132323218.db2.gz GANKSUVCWDPLMZ-TZMCWYRMSA-N 1 0 286.341 3.522 20 10 CHCDRO Cc1cc(C)c(C[NH+]2C[C@H]3CCCC[C@@H]3C2)c(O)c1 ZINC001231842583 1132377210 /nfs/dbraw/zinc/37/72/10/1132377210.db2.gz OTSGATUJFREGPB-HUUCEWRRSA-N 1 0 259.393 3.631 20 10 CHCDRO COc1ccc(CC[N@H+](C)Cc2c(C)cc(C)cc2O)cc1 ZINC001231847277 1132378267 /nfs/dbraw/zinc/37/82/67/1132378267.db2.gz VUBFNTCDWVHPMF-UHFFFAOYSA-N 1 0 299.414 3.692 20 10 CHCDRO Cc1cc(C)c(C[N@H+](C)CCOc2ccccc2)c(O)c1 ZINC001231843933 1132378386 /nfs/dbraw/zinc/37/83/86/1132378386.db2.gz DBQZSONHKDOVTF-UHFFFAOYSA-N 1 0 285.387 3.520 20 10 CHCDRO Cc1cc(C)c(C[N@H+](C)CCc2cccs2)c(O)c1 ZINC001231846156 1132378877 /nfs/dbraw/zinc/37/88/77/1132378877.db2.gz GXWRCZVHPWLDFN-UHFFFAOYSA-N 1 0 275.417 3.745 20 10 CHCDRO COc1cc(N(C)C)ccc1C[N@H+](C)CC1CCCCC1 ZINC001231855659 1132379820 /nfs/dbraw/zinc/37/98/20/1132379820.db2.gz YFEDSZJXTBWYGA-UHFFFAOYSA-N 1 0 290.451 3.773 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2CCC[C@@H](C)[C@@H]2C)cc1Cl ZINC001231871112 1132383414 /nfs/dbraw/zinc/38/34/14/1132383414.db2.gz YKNOIQRRYBBWSE-PWSUYJOCSA-N 1 0 267.800 3.974 20 10 CHCDRO CCCOC1CCC([NH2+][C@H](C)c2ccccc2O)CC1 ZINC001173090509 1132383652 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1132392019 /nfs/dbraw/zinc/39/20/19/1132392019.db2.gz QJKVOLRAKFQTRE-UHFFFAOYSA-N 1 0 267.372 3.921 20 10 CHCDRO CO[C@@H](C[NH2+][C@H](C)c1ccc(C)c(C)c1O)CC(C)C ZINC000841754765 1132392097 /nfs/dbraw/zinc/39/20/97/1132392097.db2.gz DIUFOCPJQXXFLI-HUUCEWRRSA-N 1 0 279.424 3.721 20 10 CHCDRO C[C@]1(F)CC[N@H+](Cc2ccc3ccccc3c2O)C[C@@H]1F ZINC001231879904 1132392215 /nfs/dbraw/zinc/39/22/15/1132392215.db2.gz VLDMJLURPAWOLT-RDJZCZTQSA-N 1 0 291.341 3.817 20 10 CHCDRO CO[C@@](C)(C[NH2+][C@@H](C)c1ccc(Cl)cc1O)C1CC1 ZINC000841758565 1132393783 /nfs/dbraw/zinc/39/37/83/1132393783.db2.gz SVJUWWIZTTWIFG-BONVTDFDSA-N 1 0 283.799 3.511 20 10 CHCDRO COCCCC[N@H+](C)Cc1cc(-c2ccccc2)ccc1O ZINC000841894735 1132402170 /nfs/dbraw/zinc/40/21/70/1132402170.db2.gz SMHTYXYYMOOWNL-UHFFFAOYSA-N 1 0 299.414 3.918 20 10 CHCDRO CC[C@H]1CC[C@@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC001173265240 1132431981 /nfs/dbraw/zinc/43/19/81/1132431981.db2.gz RJUBQAXQDOSZEW-DOTOQJQBSA-N 1 0 272.436 3.955 20 10 CHCDRO COc1cc(O)c(C[N@H+]2[C@H](C)CCC[C@@H]2C)cc1Cl ZINC001232266050 1132446095 /nfs/dbraw/zinc/44/60/95/1132446095.db2.gz QBVHTKFLJPCYBR-PHIMTYICSA-N 1 0 283.799 3.817 20 10 CHCDRO COc1cc(O)c(C[NH+]2CCC3(CCC3)CC2)cc1Cl ZINC001232267005 1132447420 /nfs/dbraw/zinc/44/74/20/1132447420.db2.gz UUAQXKQIYMJNME-UHFFFAOYSA-N 1 0 295.810 3.820 20 10 CHCDRO CC[C@H]1CC[C@H]([NH2+]Cc2ccc(Br)cc2O)C1 ZINC001173278080 1132453115 /nfs/dbraw/zinc/45/31/15/1132453115.db2.gz YTYWOGIOTCJFQE-GWCFXTLKSA-N 1 0 298.224 3.823 20 10 CHCDRO CC[C@H]1CC[C@@H]([NH2+]Cc2ccc(Br)cc2O)C1 ZINC001173278293 1132453381 /nfs/dbraw/zinc/45/33/81/1132453381.db2.gz YTYWOGIOTCJFQE-GXFFZTMASA-N 1 0 298.224 3.823 20 10 CHCDRO CCCCOCC[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C ZINC000040506500 1132473346 /nfs/dbraw/zinc/47/33/46/1132473346.db2.gz DABXSXAFOQJTNB-UONOGXRCSA-N 1 0 277.408 3.655 20 10 CHCDRO C[C@H](C[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F)CC(F)F ZINC000842891140 1132475213 /nfs/dbraw/zinc/47/52/13/1132475213.db2.gz ZUQGLYZQJVCADQ-ATZCPNFKSA-N 1 0 287.325 3.961 20 10 CHCDRO CC(C)(C)c1cccc(C[N@@H+]2C[C@@H]3CCC[C@@H]3C2)c1O ZINC001143103660 1132502478 /nfs/dbraw/zinc/50/24/78/1132502478.db2.gz IMRPGZHJXRSSQD-OKILXGFUSA-N 1 0 273.420 3.922 20 10 CHCDRO CC(C)(C)c1cccc(C[N@@H+]2CCC[C@@H](CF)C2)c1O ZINC001143110325 1132503516 /nfs/dbraw/zinc/50/35/16/1132503516.db2.gz CTIMPWWIGUCMIE-ZDUSSCGKSA-N 1 0 279.399 3.871 20 10 CHCDRO CC(C)(C)c1cccc(C[NH+]2C3CCC2CC3)c1O ZINC001143110905 1132504037 /nfs/dbraw/zinc/50/40/37/1132504037.db2.gz SSCDTEBGLJDZHP-UHFFFAOYSA-N 1 0 259.393 3.817 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H]2C[C@H]2C(C)C)cc1 ZINC001204129251 1132507572 /nfs/dbraw/zinc/50/75/72/1132507572.db2.gz QWGKQIMYKHWSFG-DLBZAZTESA-N 1 0 260.425 3.667 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)Cc1cccc(O)c1Cl ZINC001232789071 1132520116 /nfs/dbraw/zinc/52/01/16/1132520116.db2.gz VDCCKUMRLLKQTJ-UHFFFAOYSA-N 1 0 291.778 3.773 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)C/C=C/c2ccccc2)c(O)c1 ZINC001232839356 1132528535 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COc1cc(Cl)cc(C[N@@H+]2CC[C@@H]3CCC[C@H]3C2)c1O ZINC001233288004 1132596369 /nfs/dbraw/zinc/59/63/69/1132596369.db2.gz RARWCJXRHNXHJH-RYUDHWBXSA-N 1 0 295.810 3.676 20 10 CHCDRO CC1CC([N@H+](C)Cc2ccc(C(F)(F)F)cc2O)C1 ZINC001233452251 1132624563 /nfs/dbraw/zinc/62/45/63/1132624563.db2.gz OZXDVCRZJPPWBS-UHFFFAOYSA-N 1 0 273.298 3.641 20 10 CHCDRO C[C@@]1(CF)CC[N@H+](Cc2ccc(C(F)(F)F)cc2O)C1 ZINC001233452116 1132624616 /nfs/dbraw/zinc/62/46/16/1132624616.db2.gz LHAYMWZNSIWSLC-ZDUSSCGKSA-N 1 0 291.288 3.593 20 10 CHCDRO CCN(Cc1ccccc1O)c1cc2[nH]ccc2c(C)[nH+]1 ZINC001154888917 1132629839 /nfs/dbraw/zinc/62/98/39/1132629839.db2.gz KGYCNMWQPLBTPF-UHFFFAOYSA-N 1 0 281.359 3.603 20 10 CHCDRO Nc1ccc(Cc2ccccc2NC=C2CC[NH2+]CC2)cc1 ZINC001159742375 1132902316 /nfs/dbraw/zinc/90/23/16/1132902316.db2.gz XMAGEXJUZHVONP-UHFFFAOYSA-N 1 0 293.414 3.539 20 10 CHCDRO CN(C)c1cc[nH+]c(NCc2cc3ccccc3cc2O)c1 ZINC001160206387 1132946077 /nfs/dbraw/zinc/94/60/77/1132946077.db2.gz HHNIHTOXPWOSJP-UHFFFAOYSA-N 1 0 293.370 3.619 20 10 CHCDRO CC[N@H+](Cc1ccc(N2CCCCC2)c(C)c1)C1CC1 ZINC001167007837 1133299044 /nfs/dbraw/zinc/29/90/44/1133299044.db2.gz VNQACHSFFPTIEC-UHFFFAOYSA-N 1 0 272.436 3.970 20 10 CHCDRO COC(C)(C)[C@H](C)[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C ZINC000720244748 1133336742 /nfs/dbraw/zinc/33/67/42/1133336742.db2.gz ASVQSZPCYJDCIU-RWMBFGLXSA-N 1 0 277.408 3.652 20 10 CHCDRO Oc1ccccc1C[NH+]1CCC(c2cccs2)CC1 ZINC001203555501 1133338829 /nfs/dbraw/zinc/33/88/29/1133338829.db2.gz BNTDMVUQVZJTRY-UHFFFAOYSA-N 1 0 273.401 3.833 20 10 CHCDRO COc1cccc(C[N@@H+]2CC[C@H](C3CCCCC3)C2)c1O ZINC001203597085 1133344182 /nfs/dbraw/zinc/34/41/82/1133344182.db2.gz UTVRFFUEPJVPSJ-HNNXBMFYSA-N 1 0 289.419 3.803 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCC[C@@](C)(F)CC2)c1O ZINC001203602399 1133344474 /nfs/dbraw/zinc/34/44/74/1133344474.db2.gz UJCVQZOYBNRHQX-MRXNPFEDSA-N 1 0 281.371 3.505 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCCC[C@](C)(F)C2)c1O ZINC001203602405 1133344601 /nfs/dbraw/zinc/34/46/01/1133344601.db2.gz VCPPUKGPPZBRLZ-INIZCTEOSA-N 1 0 281.371 3.505 20 10 CHCDRO CC[C@@H](c1ccccc1)[N@H+](C)Cc1cc(OC)ccc1O ZINC001203680372 1133352827 /nfs/dbraw/zinc/35/28/27/1133352827.db2.gz SEXLLIVLFZAXML-KRWDZBQOSA-N 1 0 285.387 3.984 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[NH2+]CC[C@@H]1CC[C@H]2C[C@H]21 ZINC001203692668 1133355529 /nfs/dbraw/zinc/35/55/29/1133355529.db2.gz ZJKCAYNTCBCFQR-LNLFQRSKSA-N 1 0 284.447 3.813 20 10 CHCDRO C[N@H+](Cc1ccc(N2CCCC2)cc1)Cc1cccc(O)c1 ZINC001203860887 1133377335 /nfs/dbraw/zinc/37/73/35/1133377335.db2.gz VAMXUFVWPXIPOI-UHFFFAOYSA-N 1 0 296.414 3.624 20 10 CHCDRO Oc1ccc(C[N@@H+]2CCC[C@@H](c3ccccc3)CC2)cc1O ZINC001203878573 1133377794 /nfs/dbraw/zinc/37/77/94/1133377794.db2.gz CVVXHNURZYWJGR-QGZVFWFLSA-N 1 0 297.398 3.868 20 10 CHCDRO CC(C)CC[NH+](CCC(C)C)Cc1ccc(O)c(O)c1 ZINC001203881919 1133378869 /nfs/dbraw/zinc/37/88/69/1133378869.db2.gz YECMRDMHMVLWNJ-UHFFFAOYSA-N 1 0 279.424 3.992 20 10 CHCDRO Oc1ccc(C[N@@H+]2CC[C@H](C3CCCCC3)C2)cc1O ZINC001203879173 1133378904 /nfs/dbraw/zinc/37/89/04/1133378904.db2.gz GTCSFDBWGKIOPM-HNNXBMFYSA-N 1 0 275.392 3.500 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2C[C@@H](C)C[C@H]2CF)cc1 ZINC001203940638 1133386667 /nfs/dbraw/zinc/38/66/67/1133386667.db2.gz SHDNEKMQOZRJSW-YOEHRIQHSA-N 1 0 278.415 3.713 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](CC)C2CCOCC2)cc1 ZINC001203939564 1133386630 /nfs/dbraw/zinc/38/66/30/1133386630.db2.gz QXNYJYHEIMAWKZ-UHFFFAOYSA-N 1 0 290.451 3.534 20 10 CHCDRO CCN(CC)c1ccc(C[NH+]2CCC(C)CC2)cc1 ZINC001203937355 1133386658 /nfs/dbraw/zinc/38/66/58/1133386658.db2.gz WKRAWTCYMUKMCX-UHFFFAOYSA-N 1 0 260.425 3.765 20 10 CHCDRO CCN(CC)c1ccc(C[NH+]2CC3(C2)CC(F)(F)C3)cc1 ZINC001203937368 1133387036 /nfs/dbraw/zinc/38/70/36/1133387036.db2.gz XBMXTXCWGTYQOH-UHFFFAOYSA-N 1 0 294.389 3.764 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2C[C@@H]3CCC[C@@H]3C2)cc1 ZINC001203936236 1133387135 /nfs/dbraw/zinc/38/71/35/1133387135.db2.gz KVZVKJAKTKJOQX-CALCHBBNSA-N 1 0 272.436 3.765 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCc3occc3C2)cc1 ZINC001203942864 1133387303 /nfs/dbraw/zinc/38/73/03/1133387303.db2.gz VWQXFIWBWFWBSZ-UHFFFAOYSA-N 1 0 284.403 3.684 20 10 CHCDRO CC1CC([N@H+](C)Cc2ccc(N3CCCC3)cc2)C1 ZINC001204324071 1133436384 /nfs/dbraw/zinc/43/63/84/1133436384.db2.gz KKOKRSJFRLTLBQ-UHFFFAOYSA-N 1 0 258.409 3.517 20 10 CHCDRO C[C@H]1CC[N@H+](Cc2ccc(N3CCCC3)cc2)[C@@H](C)C1 ZINC001204321159 1133436988 /nfs/dbraw/zinc/43/69/88/1133436988.db2.gz HHQZIIRPZPFCKS-HOTGVXAUSA-N 1 0 272.436 3.907 20 10 CHCDRO Cc1ccc(C[N@H+]2C[C@H](C)[C@@H]3CCCC[C@H]32)c(O)c1 ZINC001204961963 1133508150 /nfs/dbraw/zinc/50/81/50/1133508150.db2.gz YFSOGHVOCKUOSA-CWRNSKLLSA-N 1 0 259.393 3.711 20 10 CHCDRO CC(C)c1ccc(O)c(C[NH2+]CC[C@@H]2CCO[C@H](C)C2)c1 ZINC001205391148 1133573449 /nfs/dbraw/zinc/57/34/49/1133573449.db2.gz JORVACWHKLZYLG-HUUCEWRRSA-N 1 0 291.435 3.810 20 10 CHCDRO CC[C@@H]1[C@H](C)CC[N@@H+]1C/C=C/c1ccc(N(C)C)cc1 ZINC001205489426 1133582820 /nfs/dbraw/zinc/58/28/20/1133582820.db2.gz QGWQXIDOALEZCZ-YOBDTOFLSA-N 1 0 272.436 3.886 20 10 CHCDRO CC[N@@H+](Cc1c(O)cc(C)cc1Cl)CC1CCC1 ZINC001205506554 1133584139 /nfs/dbraw/zinc/58/41/39/1133584139.db2.gz ALLHMTPDAHWXRU-UHFFFAOYSA-N 1 0 267.800 3.976 20 10 CHCDRO COc1cc(C)ccc1C[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001206783218 1133747982 /nfs/dbraw/zinc/74/79/82/1133747982.db2.gz WWBWPCSUHRBREJ-UHFFFAOYSA-N 1 0 298.430 3.702 20 10 CHCDRO Cc1noc(C)c1C[N@@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001207137504 1133772654 /nfs/dbraw/zinc/77/26/54/1133772654.db2.gz HGIVQYWGRAFHKV-UHFFFAOYSA-N 1 0 299.418 3.524 20 10 CHCDRO CC[N@H+](CCc1ccccc1F)Cc1ccccc1O ZINC001207505408 1133810990 /nfs/dbraw/zinc/81/09/90/1133810990.db2.gz ZWTWWFPIJZGQCW-UHFFFAOYSA-N 1 0 273.351 3.596 20 10 CHCDRO C[C@H](C[N@H+](C)Cc1ccc(N(C)C)cc1)c1ccccc1 ZINC001207912328 1133862290 /nfs/dbraw/zinc/86/22/90/1133862290.db2.gz QTTPTJONLGZUNT-MRXNPFEDSA-N 1 0 282.431 3.988 20 10 CHCDRO C[N@H+](CCCc1ccc(F)cc1)Cc1ccccc1O ZINC001208775659 1133943397 /nfs/dbraw/zinc/94/33/97/1133943397.db2.gz SVPNGNGIXWRXGR-UHFFFAOYSA-N 1 0 273.351 3.596 20 10 CHCDRO COC[C@@H]1CC[N@H+](Cc2ccc(-n3c(C)ccc3C)cc2)C1 ZINC001209516136 1134031912 /nfs/dbraw/zinc/03/19/12/1134031912.db2.gz ARMINCKOYMCUHP-GOSISDBHSA-N 1 0 298.430 3.562 20 10 CHCDRO CC[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)S2)c1ccccc1O ZINC000403514719 1134791384 /nfs/dbraw/zinc/79/13/84/1134791384.db2.gz NJWSVGQIELUEPC-VYHDIPPYSA-N 1 0 277.433 3.860 20 10 CHCDRO C[NH2+][C@H]1C[C@@H](OC2=CC(=O)C=CC2=NNc2ccccc2)C1 ZINC001217957592 1135031340 /nfs/dbraw/zinc/03/13/40/1135031340.db2.gz MQGKLAIQZQHBBM-SGGRVHQCSA-N 1 0 297.358 3.937 20 10 CHCDRO F[C@H]1C[NH2+]C[C@H]1Oc1ccc(/N=N/c2ccccc2)cc1 ZINC001217997532 1135039387 /nfs/dbraw/zinc/03/93/87/1135039387.db2.gz DAABMQYNNZTPFH-BSMWSGRKSA-N 1 0 285.322 3.791 20 10 CHCDRO C[C@@H]1C[C@H](OC2=CC(=O)C=CC2=NNc2ccccc2)C[NH2+]1 ZINC001218048204 1135049006 /nfs/dbraw/zinc/04/90/06/1135049006.db2.gz UINVCSHHSUPWIP-IELRGZLXSA-N 1 0 297.358 3.937 20 10 CHCDRO O=C1C=CC(=NNc2ccccc2)C(O[C@H]2CC[NH2+]C2)=C1 ZINC001218181045 1135064097 /nfs/dbraw/zinc/06/40/97/1135064097.db2.gz GOVBNLQOGRYUFM-HLAUDOPJSA-N 1 0 283.331 3.548 20 10 CHCDRO CCC[C@@H](Oc1ccc(N2CC[NH2+]CC2)cc1)[C@@H](C)CC ZINC001218290762 1135079259 /nfs/dbraw/zinc/07/92/59/1135079259.db2.gz CKXWFERNXVNGFM-MAUKXSAKSA-N 1 0 290.451 3.690 20 10 CHCDRO COCC1(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)CCC1 ZINC000313857914 1135141034 /nfs/dbraw/zinc/14/10/34/1135141034.db2.gz IXFSHKGRWJRASN-ZIAGYGMSSA-N 1 0 289.419 3.655 20 10 CHCDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]Cc1cccc(C#N)c1 ZINC000314650202 1135145689 /nfs/dbraw/zinc/14/56/89/1135145689.db2.gz GGVZUSMXXFIRFK-XJKSGUPXSA-N 1 0 292.382 3.910 20 10 CHCDRO COc1cc(C)ccc1[C@H](C)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000315908460 1135162729 /nfs/dbraw/zinc/16/27/29/1135162729.db2.gz RREHMLFDADDINZ-HNNXBMFYSA-N 1 0 298.430 3.920 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@H](C)c2ccccc2Cl)c1 ZINC000020124139 171005361 /nfs/dbraw/zinc/00/53/61/171005361.db2.gz JMPBWQIQZGOEHZ-LLVKDONJSA-N 1 0 291.778 3.905 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@@H](C)c2ccccc2Cl)c1 ZINC000020124138 171005911 /nfs/dbraw/zinc/00/59/11/171005911.db2.gz JMPBWQIQZGOEHZ-NSHDSACASA-N 1 0 291.778 3.905 20 10 CHCDRO Cc1ccccc1[C@@H](C)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000020126080 171009865 /nfs/dbraw/zinc/00/98/65/171009865.db2.gz ZPVDBLQDYDYMGL-OAHLLOKOSA-N 1 0 268.404 3.912 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1cccnc1)c1ccccc1O ZINC000020127752 171013980 /nfs/dbraw/zinc/01/39/80/171013980.db2.gz JXOUXQKIEHEHMX-DOMZBBRYSA-N 1 0 256.349 3.589 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(F)cc1F ZINC000020146097 171031680 /nfs/dbraw/zinc/03/16/80/171031680.db2.gz KGIQNGDCTUPAQT-LBPRGKRZSA-N 1 0 290.357 3.882 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2)c1 ZINC000035628890 172307735 /nfs/dbraw/zinc/30/77/35/172307735.db2.gz NGJLTZACUNVMTK-AWEZNQCLSA-N 1 0 284.403 3.617 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCC[C@@H](C)C2)c1 ZINC000037254119 173065375 /nfs/dbraw/zinc/06/53/75/173065375.db2.gz NRIDADHARZCPOW-FRRDWIJNSA-N 1 0 263.381 3.630 20 10 CHCDRO CC(C)C[C@H](C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000037255557 173066939 /nfs/dbraw/zinc/06/69/39/173066939.db2.gz WADFDVSWVVIRJO-HNNXBMFYSA-N 1 0 260.425 3.811 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2ccc(Cl)cc2)c1 ZINC000071406865 176156295 /nfs/dbraw/zinc/15/62/95/176156295.db2.gz OTPQZANKFKGGOA-UHFFFAOYSA-N 1 0 261.752 3.644 20 10 CHCDRO COc1cccc(C[NH2+][C@@H](C)c2ccc(F)cc2F)c1O ZINC000036952824 260056266 /nfs/dbraw/zinc/05/62/66/260056266.db2.gz XIRODJBPBZGQER-JTQLQIEISA-N 1 0 293.313 3.530 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccc(F)cc1F ZINC000037363181 260094808 /nfs/dbraw/zinc/09/48/08/260094808.db2.gz GOKHWXNXRNIACR-LLVKDONJSA-N 1 0 289.325 3.751 20 10 CHCDRO c1ccc2c(c1)SCC[C@H]2[NH2+]Cc1ccc2c(c1)CCO2 ZINC000037363500 260095036 /nfs/dbraw/zinc/09/50/36/260095036.db2.gz CMZOFDYNZVEARU-MRXNPFEDSA-N 1 0 297.423 3.948 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccco1)c1ccc(N(C)C)cc1 ZINC000152038459 261058382 /nfs/dbraw/zinc/05/83/82/261058382.db2.gz XQAGDJRHUAISCH-INIZCTEOSA-N 1 0 258.365 3.587 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)C[C@H](O)c1ccccc1)c1ccccc1O ZINC000156413739 261122787 /nfs/dbraw/zinc/12/27/87/261122787.db2.gz PZTRCASRBPAFSQ-FNHZYXHNSA-N 1 0 299.414 3.945 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCOC2(CCCC2)C1)c1ccccc1O ZINC000156766424 261131206 /nfs/dbraw/zinc/13/12/06/261131206.db2.gz JAEXAPGNQBSFGC-HOCLYGCPSA-N 1 0 289.419 3.925 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](C)c1c(C)noc1C)c1ccccc1O ZINC000156866508 261134137 /nfs/dbraw/zinc/13/41/37/261134137.db2.gz AJVHYHUHAAZGAY-ABAIWWIYSA-N 1 0 288.391 3.841 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCO[C@H](C2CC2)C1)c1cc(Cl)ccc1O ZINC000157884243 261154598 /nfs/dbraw/zinc/15/45/98/261154598.db2.gz YIJYIBHAKFQSRF-WNMQOVRZSA-N 1 0 295.810 3.654 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(C)nc1)c1ccc(N(C)C)cc1 ZINC000161293749 261242828 /nfs/dbraw/zinc/24/28/28/261242828.db2.gz XMRZUEKBRLZDAK-SFHVURJKSA-N 1 0 283.419 3.697 20 10 CHCDRO COCc1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2[O-])cc1 ZINC000184941850 262035160 /nfs/dbraw/zinc/03/51/60/262035160.db2.gz PKGKLHVIOXWYRG-LBPRGKRZSA-N 1 0 289.350 3.529 20 10 CHCDRO CC(=O)Nc1cccc(C[NH2+][C@H](C)c2cc(C)ccc2O)c1 ZINC000185020811 262037347 /nfs/dbraw/zinc/03/73/47/262037347.db2.gz PPVAWLMNQCPNOJ-CYBMUJFWSA-N 1 0 298.386 3.510 20 10 CHCDRO CCOc1ccccc1C[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000185103738 262040931 /nfs/dbraw/zinc/04/09/31/262040931.db2.gz WKMCIVOBACGZDZ-LBPRGKRZSA-N 1 0 289.350 3.781 20 10 CHCDRO CO[C@H](C[NH2+][C@@H](C)c1cc(F)ccc1O)c1ccccc1 ZINC000185102199 262040974 /nfs/dbraw/zinc/04/09/74/262040974.db2.gz BBQZMUPZEDMHGQ-YVEFUNNKSA-N 1 0 289.350 3.570 20 10 CHCDRO CSCCCCC[NH2+]Cc1cc(C)c(C)cc1O ZINC000185164716 262044332 /nfs/dbraw/zinc/04/43/32/262044332.db2.gz XEOSMEJTFRYVLM-UHFFFAOYSA-N 1 0 267.438 3.632 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCCOC2CCCC2)c(O)c1 ZINC000185240698 262047800 /nfs/dbraw/zinc/04/78/00/262047800.db2.gz QWXVGWYUVNUNDN-AWEZNQCLSA-N 1 0 277.408 3.701 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC2(CCO)CCCCC2)c(O)c1 ZINC000185669499 262065031 /nfs/dbraw/zinc/06/50/31/262065031.db2.gz GUXYZPLHQJKTMA-OAHLLOKOSA-N 1 0 291.435 3.684 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc([C@H](C)O)cc1)c1ccccc1O ZINC000186127378 262081285 /nfs/dbraw/zinc/08/12/85/262081285.db2.gz QOZSRGOEINITQY-GUYCJALGSA-N 1 0 285.387 3.686 20 10 CHCDRO Cc1cnc([C@@H](C)C[NH2+][C@H](C)c2ccc(C)cc2O)s1 ZINC000186777946 262109336 /nfs/dbraw/zinc/10/93/36/262109336.db2.gz QCKUMRXRJGJUBK-WCQYABFASA-N 1 0 290.432 3.920 20 10 CHCDRO CCc1ccc(C[NH2+][C@H](C)c2cc(OC)ccc2O)s1 ZINC000185026445 262301320 /nfs/dbraw/zinc/30/13/20/262301320.db2.gz WPFVTKPRKZXXCT-LLVKDONJSA-N 1 0 291.416 3.876 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]CCCCCCSC)c1 ZINC000186533800 262316002 /nfs/dbraw/zinc/31/60/02/262316002.db2.gz JXMISSGWHFMGBV-CYBMUJFWSA-N 1 0 297.464 3.975 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CCC[C@@H]1c1ccncc1 ZINC000289890301 263112845 /nfs/dbraw/zinc/11/28/45/263112845.db2.gz SVKJOOKYTFWFMT-OAHLLOKOSA-N 1 0 288.778 3.778 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H](c2ccccc2)[C@H]2CCOC2)c1 ZINC000374472286 267793703 /nfs/dbraw/zinc/79/37/03/267793703.db2.gz PMFHVGRNOMDROK-LPHOPBHVSA-N 1 0 297.398 3.568 20 10 CHCDRO COC[C@@H]([NH2+][C@@H](C)c1cc(C)ccc1O)c1ccc(C)o1 ZINC000185630256 327841706 /nfs/dbraw/zinc/84/17/06/327841706.db2.gz XAZXRGUITUJXOT-DZGCQCFKSA-N 1 0 289.375 3.640 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H](C)[C@@]1(C)CCCO1 ZINC000559901761 327270077 /nfs/dbraw/zinc/27/00/77/327270077.db2.gz FIAMFJRWTBPPMG-RDTXWAMCSA-N 1 0 286.419 3.534 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C2CCC3(CCOCC3)CC2)c1 ZINC000360020086 329070067 /nfs/dbraw/zinc/07/00/67/329070067.db2.gz KOGMQWTVTNYJIO-UHFFFAOYSA-N 1 0 289.419 3.530 20 10 CHCDRO CCCC[N@H+](Cc1ccnc(C)c1)Cc1ccccc1O ZINC000527539197 330260816 /nfs/dbraw/zinc/26/08/16/330260816.db2.gz LEYNQANRXZKOES-UHFFFAOYSA-N 1 0 284.403 3.898 20 10 CHCDRO c1ccc([C@@H]([NH2+]Cc2ccc3c(c2)CCO3)C2CCC2)nc1 ZINC000527769855 330281850 /nfs/dbraw/zinc/28/18/50/330281850.db2.gz BYKVKYAMSCFWEE-IBGZPJMESA-N 1 0 294.398 3.648 20 10 CHCDRO C[C@@H]([NH2+]CC1CC=CC1)c1cc(Br)ccc1O ZINC000527946663 330294133 /nfs/dbraw/zinc/29/41/33/330294133.db2.gz IFHQXUOPSZWHNP-SNVBAGLBSA-N 1 0 296.208 3.772 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@H](c1ccccn1)C1CCC1)CC2 ZINC000527969291 330301409 /nfs/dbraw/zinc/30/14/09/330301409.db2.gz SWOFYKQFMCQTNX-KXBFYZLASA-N 1 0 294.398 3.906 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ncccc2F)c(O)c1 ZINC000528035793 330302751 /nfs/dbraw/zinc/30/27/51/330302751.db2.gz KHKGKSWENPOSDI-RYUDHWBXSA-N 1 0 274.339 3.647 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+][C@@H](c1ccccn1)C1CCC1 ZINC000529644992 333503331 /nfs/dbraw/zinc/50/33/31/333503331.db2.gz RUIQQZOHUFVMJQ-QGZVFWFLSA-N 1 0 286.350 3.557 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1C[C@H](C)[C@@H]1C ZINC000385713274 336154880 /nfs/dbraw/zinc/15/48/80/336154880.db2.gz VSDSWFYGIPVPCC-SLEUVZQESA-N 1 0 256.393 3.621 20 10 CHCDRO CC(C)([NH2+]Cc1ccccc1O)c1ccccc1F ZINC000291762159 519324692 /nfs/dbraw/zinc/32/46/92/519324692.db2.gz RNRYRCIJYAZVJB-UHFFFAOYSA-N 1 0 259.324 3.556 20 10 CHCDRO CC(C)[C@H]1C[C@@H]([NH2+][C@@H](C)c2ccc(N(C)C)cc2)CCO1 ZINC000271588995 519827420 /nfs/dbraw/zinc/82/74/20/519827420.db2.gz SSBGSMOUJBLFPP-QILLFSRXSA-N 1 0 290.451 3.607 20 10 CHCDRO CCC[C@H]([NH2+][C@@H](C)c1ccccc1O)[C@@H](O)c1ccccc1 ZINC000279999923 521170253 /nfs/dbraw/zinc/17/02/53/521170253.db2.gz FXIVTEMKRQUFPM-FNHZYXHNSA-N 1 0 299.414 3.945 20 10 CHCDRO CCOc1cccc(C[NH2+]C(C)(C)c2ccccc2)c1O ZINC000299519093 521358699 /nfs/dbraw/zinc/35/86/99/521358699.db2.gz DHQKZCCMFSUMSA-UHFFFAOYSA-N 1 0 285.387 3.816 20 10 CHCDRO CCOc1cccc(C[NH2+]Cc2c(O)cccc2Cl)c1 ZINC000083551938 521364865 /nfs/dbraw/zinc/36/48/65/521364865.db2.gz YZPXPAXUABLJNM-UHFFFAOYSA-N 1 0 291.778 3.734 20 10 CHCDRO CCC[N@H+](Cc1ccnn1C(C)C)Cc1ccccc1O ZINC000279592632 521692330 /nfs/dbraw/zinc/69/23/30/521692330.db2.gz HUEPYFCXVZMVCU-UHFFFAOYSA-N 1 0 287.407 3.582 20 10 CHCDRO C[NH+](C)Cc1ccc(NCc2ccccc2O)cc1Cl ZINC000280258042 521909039 /nfs/dbraw/zinc/90/90/39/521909039.db2.gz LQVJYLFSGJJYNS-UHFFFAOYSA-N 1 0 290.794 3.719 20 10 CHCDRO CC[C@H]([NH2+]C1CC(F)(F)C1)c1ccc(N(C)C)cc1 ZINC000277193491 522560314 /nfs/dbraw/zinc/56/03/14/522560314.db2.gz VCEQWAATCBDQQJ-AWEZNQCLSA-N 1 0 268.351 3.591 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCOC(C)(C)C1)c1ccc(C)cc1O ZINC000280075630 522718800 /nfs/dbraw/zinc/71/88/00/522718800.db2.gz LJMHBNUNYGGRNA-HIFRSBDPSA-N 1 0 277.408 3.699 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCO[C@H](C(C)C)C1)c1ccccc1O ZINC000274930811 522720332 /nfs/dbraw/zinc/72/03/32/522720332.db2.gz QUTGWAOXVKXKTI-KMFMINBZSA-N 1 0 277.408 3.637 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCOC2(CCC2)C1)c1ccccc1O ZINC000274961641 522755254 /nfs/dbraw/zinc/75/52/54/522755254.db2.gz WVUXKJBKONNYMS-ZFWWWQNUSA-N 1 0 275.392 3.535 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1CCSC1)c1ccc(N(C)C)cc1 ZINC000280200919 522865873 /nfs/dbraw/zinc/86/58/73/522865873.db2.gz VNPGSGFTZGQUDC-CZUORRHYSA-N 1 0 278.465 3.546 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccc1O ZINC000050015506 522882747 /nfs/dbraw/zinc/88/27/47/522882747.db2.gz WTICTORZJVWJBZ-CQSZACIVSA-N 1 0 286.331 3.541 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)C1CCOCC1)c1ccc(N(C)C)cc1 ZINC000126181473 522906279 /nfs/dbraw/zinc/90/62/79/522906279.db2.gz IPSCVVZBDWTYPB-KBXCAEBGSA-N 1 0 290.451 3.608 20 10 CHCDRO CO[C@H](C[NH2+]Cc1ccccc1O)c1ccc(Cl)cc1 ZINC000266174632 523951827 /nfs/dbraw/zinc/95/18/27/523951827.db2.gz SLLYNHSUTOEVPZ-MRXNPFEDSA-N 1 0 291.778 3.523 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccc(Cl)nc2)c(O)c1 ZINC000293252006 524330702 /nfs/dbraw/zinc/33/07/02/524330702.db2.gz BPSBDXZWYRCACN-GFCCVEGCSA-N 1 0 290.794 3.908 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2cn3ccccc3n2)c(O)c1 ZINC000293278932 524334292 /nfs/dbraw/zinc/33/42/92/524334292.db2.gz CRYAKCRXYDDMQS-AWEZNQCLSA-N 1 0 295.386 3.508 20 10 CHCDRO COc1ccc(N2CCC([NH2+][C@@H](C)CC(C)C)CC2)cc1 ZINC000157395072 524403106 /nfs/dbraw/zinc/40/31/06/524403106.db2.gz AHDNKGJCCGOROJ-HNNXBMFYSA-N 1 0 290.451 3.688 20 10 CHCDRO COc1ccc(N2CCC([NH2+][C@H](C)C(C)(C)C)CC2)cc1 ZINC000157429426 524404010 /nfs/dbraw/zinc/40/40/10/524404010.db2.gz AADWMSSIUBOSDT-CQSZACIVSA-N 1 0 290.451 3.688 20 10 CHCDRO C[C@H]([NH2+]CCCOc1ccccc1)c1ccccc1O ZINC000052092009 525343910 /nfs/dbraw/zinc/34/39/10/525343910.db2.gz ZSFWCVROKDXNDA-AWEZNQCLSA-N 1 0 271.360 3.512 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCSC1)c1cc2c(cc1O)CCCC2 ZINC000280120752 525485835 /nfs/dbraw/zinc/48/58/35/525485835.db2.gz PNLURBGVMFFKBF-OLZOCXBDSA-N 1 0 291.460 3.675 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCOC[C@@H]1C)c1ccc2ccccc2c1O ZINC000278613833 525571914 /nfs/dbraw/zinc/57/19/14/525571914.db2.gz RGPKQDDKPNZFFY-GDZNZVCISA-N 1 0 285.387 3.621 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1cccnc1)c1ccc(N(C)C)cc1 ZINC000037228906 525617458 /nfs/dbraw/zinc/61/74/58/525617458.db2.gz XJJFHFZFAHXKGX-KGLIPLIRSA-N 1 0 269.392 3.559 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCCSC1)c1cc(Cl)ccc1O ZINC000273586197 525678904 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ZINC000061817974 527482339 /nfs/dbraw/zinc/48/23/39/527482339.db2.gz CPMCRTWLIKWPEK-UHFFFAOYSA-N 1 0 258.409 3.815 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CC[C@H]2OCCC[C@@H]2C1 ZINC000129065611 1125472090 /nfs/dbraw/zinc/47/20/90/1125472090.db2.gz LORYEGKHNWUYEZ-DNVCBOLYSA-N 1 0 297.398 3.546 20 10 CHCDRO CC[C@@H]1CCC[C@H]([NH2+]Cc2ccc(N(C)C)cc2)C1 ZINC000083639716 1118190380 /nfs/dbraw/zinc/19/03/80/1118190380.db2.gz COTCAJHEBGVDQW-ZBFHGGJFSA-N 1 0 260.425 3.811 20 10 CHCDRO CS[C@H]1CCC[C@@H]([NH2+][C@@H](C)c2ccccc2O)C1 ZINC000183518633 1120137225 /nfs/dbraw/zinc/13/72/25/1120137225.db2.gz QKKXJWCLJCVODL-XQQFMLRXSA-N 1 0 265.422 3.717 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2c(F)cccc2Cl)c1 ZINC000733326120 1121975848 /nfs/dbraw/zinc/97/58/48/1121975848.db2.gz KAQKPDMLXUESGM-UHFFFAOYSA-N 1 0 279.742 3.783 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCN1C(C)(C)C)c1cc(Cl)ccc1O ZINC000850480745 1123273447 /nfs/dbraw/zinc/27/34/47/1123273447.db2.gz DDFARENKMXIHQD-WCQYABFASA-N 1 0 296.842 3.569 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)Cc2ccsc2)cc1C ZINC000111988691 1123472838 /nfs/dbraw/zinc/47/28/38/1123472838.db2.gz SPPNGOBDYFUAAL-UHFFFAOYSA-N 1 0 261.390 3.703 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC[C@@H]2CC2(Cl)Cl)c(O)c1 ZINC000857082300 1123585895 /nfs/dbraw/zinc/58/58/95/1123585895.db2.gz MJOBFTXJSWCOIB-WDEREUQCSA-N 1 0 288.218 3.935 20 10 CHCDRO CS[C@H]1CCC[C@H]([NH2+]Cc2ccc(N(C)C)cc2)C1 ZINC000117394260 1123728899 /nfs/dbraw/zinc/72/88/99/1123728899.db2.gz CTXYTDAIMFVXEK-HOCLYGCPSA-N 1 0 278.465 3.516 20 10 CHCDRO C[C@H]1C[C@H]([NH2+]CCC2(C)CC2)c2c1c(F)ccc2O ZINC000794828434 1123962148 /nfs/dbraw/zinc/96/21/48/1123962148.db2.gz OVYWKURKSBESLO-JQWIXIFHSA-N 1 0 263.356 3.859 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H](C)CCCCO)c1O ZINC000834876321 1131715814 /nfs/dbraw/zinc/71/58/14/1131715814.db2.gz AKZPWWOTSYAQKN-NWDGAFQWSA-N 1 0 285.815 3.556 20 10 CHCDRO C[C@@]1(F)CCCC[N@H+](Cc2ccc(Cl)cc2O)C1 ZINC001140462211 1131748359 /nfs/dbraw/zinc/74/83/59/1131748359.db2.gz AKXOKRYHFAVDSN-CQSZACIVSA-N 1 0 271.763 3.760 20 10 CHCDRO CC(C)(C)c1cccc(C[N@@H+]2CCC[C@H](F)C2)c1O ZINC001143110833 1132503158 /nfs/dbraw/zinc/50/31/58/1132503158.db2.gz QMYLELLWARICIE-ZDUSSCGKSA-N 1 0 265.372 3.624 20 10 CHCDRO CC[C@@H]1CCC[N@@H+]1Cc1cc(Cl)c(C)cc1O ZINC001204180112 1133415887 /nfs/dbraw/zinc/41/58/87/1133415887.db2.gz GXWWXILIOWGJJC-GFCCVEGCSA-N 1 0 253.773 3.728 20 10 CHCDRO CN(C)c1cc(F)c(C[N@H+](C)CC2CCCC2)cc1F ZINC001204421373 1133444263 /nfs/dbraw/zinc/44/42/63/1133444263.db2.gz FJZMFVZMUYMKEP-UHFFFAOYSA-N 1 0 282.378 3.653 20 10 CHCDRO Oc1ccccc1C[NH2+]Cc1cc(Cl)cc(Cl)c1 ZINC000134235805 1125545995 /nfs/dbraw/zinc/54/59/95/1125545995.db2.gz ZBUKUUMXXKJIEX-UHFFFAOYSA-N 1 0 282.170 3.989 20 10 CHCDRO Cc1cc(C)c(C[NH2+]Cc2ccccc2O)c(C)c1 ZINC000134231081 1125546424 /nfs/dbraw/zinc/54/64/24/1125546424.db2.gz UAUPPJDXDZXAQL-UHFFFAOYSA-N 1 0 255.361 3.607 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)CCSC)cc1 ZINC000134874470 1125567679 /nfs/dbraw/zinc/56/76/79/1125567679.db2.gz GFQKBMOAQULSOE-AWEZNQCLSA-N 1 0 280.481 3.764 20 10 CHCDRO CC(C)[C@H]1CC[N@H+](Cc2cccc(Br)c2[O-])C1 ZINC000135649002 1125593896 /nfs/dbraw/zinc/59/38/96/1125593896.db2.gz FIKNPDXGNGGTGX-NSHDSACASA-N 1 0 298.224 3.633 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1COCc2ccccc21)c1ccc(N(C)C)cc1 ZINC000841762354 1125601815 /nfs/dbraw/zinc/60/18/15/1125601815.db2.gz WNLZVJPYKYALCN-AUUYWEPGSA-N 1 0 296.414 3.675 20 10 CHCDRO C[C@H]([NH2+]Cc1cc(C2CC2)no1)c1cc(Cl)ccc1O ZINC000886684271 1125707267 /nfs/dbraw/zinc/70/72/67/1125707267.db2.gz ITBXWDPPQCFUTQ-VIFPVBQESA-N 1 0 292.766 3.762 20 10 CHCDRO C[C@H]([NH2+]C[C@]1(C)CCOC2(CCC2)C1)c1ccccc1O ZINC000886774539 1125715672 /nfs/dbraw/zinc/71/56/72/1125715672.db2.gz PNYQOIYHCMFKNK-WMLDXEAASA-N 1 0 289.419 3.782 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]C2CCC=CCC2)c1O ZINC000886815683 1125720351 /nfs/dbraw/zinc/72/03/51/1125720351.db2.gz IECXCCYYWASBMY-GFCCVEGCSA-N 1 0 261.365 3.550 20 10 CHCDRO CCCC[N@H+](Cc1cncs1)Cc1ccccc1O ZINC000282973497 1125745927 /nfs/dbraw/zinc/74/59/27/1125745927.db2.gz IRRCCNXPGSCDGX-UHFFFAOYSA-N 1 0 276.405 3.651 20 10 CHCDRO CCC[N@H+](Cc1cccc(O)c1)Cc1ccccc1O ZINC000092705036 1125760685 /nfs/dbraw/zinc/76/06/85/1125760685.db2.gz YJUXVMFUPNLSPR-UHFFFAOYSA-N 1 0 271.360 3.510 20 10 CHCDRO CCOc1cccc(C[N@H+](C)CCc2cccs2)c1O ZINC000093685437 1125772809 /nfs/dbraw/zinc/77/28/09/1125772809.db2.gz FSVABNZXJDXNCT-UHFFFAOYSA-N 1 0 291.416 3.527 20 10 CHCDRO CCCC[C@H](CCC)[NH2+]Cc1cc(OC)ccc1O ZINC000222073306 1125774366 /nfs/dbraw/zinc/77/43/66/1125774366.db2.gz XWCZHNJAOVNOIC-AWEZNQCLSA-N 1 0 265.397 3.849 20 10 CHCDRO CCCC[N@H+](CCSCC)Cc1ccccc1O ZINC000801595118 1129931301 /nfs/dbraw/zinc/93/13/01/1129931301.db2.gz IIZNUZJTPMURQG-UHFFFAOYSA-N 1 0 267.438 3.747 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H]2CCOC3(CCCC3)C2)cc1C ZINC000136695248 1126729769 /nfs/dbraw/zinc/72/97/69/1126729769.db2.gz BFQBUVYLRQVMAC-MRXNPFEDSA-N 1 0 289.419 3.590 20 10 CHCDRO CCN(CC)c1ccc(CN(C)Cc2nccs2)cc1 ZINC000179188518 1126824951 /nfs/dbraw/zinc/82/49/51/1126824951.db2.gz RHJWLNCJASYJOI-UHFFFAOYSA-N 1 0 289.448 3.621 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CCC[C@H]2c2cccs2)c1 ZINC000179591846 1126831257 /nfs/dbraw/zinc/83/12/57/1126831257.db2.gz NVOMIVUUHWAQIV-AWEZNQCLSA-N 1 0 289.400 3.799 20 10 CHCDRO CC[C@@H]([NH2+]C1CCSCC1)c1ccc(N(C)C)cc1 ZINC000180510525 1126845729 /nfs/dbraw/zinc/84/57/29/1126845729.db2.gz SJELHHCGIHQXJK-MRXNPFEDSA-N 1 0 278.465 3.689 20 10 CHCDRO [NH3+]Cc1ccccc1NCc1ccc(N2CCCCC2)cc1 ZINC000904484816 1126854522 /nfs/dbraw/zinc/85/45/22/1126854522.db2.gz QWRXDRUSNZHYIT-UHFFFAOYSA-N 1 0 295.430 3.748 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCCc2ccccn2)cc1 ZINC000181496657 1126856752 /nfs/dbraw/zinc/85/67/52/1126856752.db2.gz NFPOLPZJATZKAD-MRXNPFEDSA-N 1 0 297.446 3.821 20 10 CHCDRO Cc1cccc(C[NH2+]C(C)(C)c2cccc(F)c2)c1O ZINC000182222749 1126868156 /nfs/dbraw/zinc/86/81/56/1126868156.db2.gz MKVMJFZAEHIHFF-UHFFFAOYSA-N 1 0 273.351 3.865 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCN(c2ccccc2)C1)c1ccccc1O ZINC000183412576 1126886748 /nfs/dbraw/zinc/88/67/48/1126886748.db2.gz ICCBWRFPHKBHIB-CVEARBPZSA-N 1 0 296.414 3.569 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccccc1O ZINC000183471311 1126887358 /nfs/dbraw/zinc/88/73/58/1126887358.db2.gz BSDMQBOYDYNKFM-AWEZNQCLSA-N 1 0 296.414 3.625 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1ccccc1O)c1ccncc1 ZINC000183529132 1126888863 /nfs/dbraw/zinc/88/88/63/1126888863.db2.gz ZHMKWWMJOQPOBC-WFASDCNBSA-N 1 0 256.349 3.589 20 10 CHCDRO C[C@@H](O)C[C@H](C[NH2+][C@@H](C)c1ccccc1O)c1ccccc1 ZINC000183559164 1126888902 /nfs/dbraw/zinc/88/89/02/1126888902.db2.gz PSNBDUGICUUBDD-HLLBOEOZSA-N 1 0 299.414 3.598 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCOC2(CCCC2)C1)c1ccccc1O ZINC000183621128 1126889731 /nfs/dbraw/zinc/88/97/31/1126889731.db2.gz FRKSHEDUNGVQRC-UONOGXRCSA-N 1 0 275.392 3.535 20 10 CHCDRO C[C@@H]([NH2+]CCC[C@H]1CCCCO1)c1ccc(N(C)C)cc1 ZINC000183992759 1126894638 /nfs/dbraw/zinc/89/46/38/1126894638.db2.gz LTCOOPPPHADYOX-CRAIPNDOSA-N 1 0 290.451 3.753 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]Cc1cccnc1C ZINC001118808562 1131238473 /nfs/dbraw/zinc/23/84/73/1131238473.db2.gz RZYMONMLTFNMEA-DOMZBBRYSA-N 1 0 282.387 3.742 20 10 CHCDRO CC[C@H]([NH2+]CC[C@@](C)(O)c1ccccc1)c1ccccc1O ZINC000187889907 1126916984 /nfs/dbraw/zinc/91/69/84/1126916984.db2.gz JIFSWMOEHAFFKU-PKOBYXMFSA-N 1 0 299.414 3.731 20 10 CHCDRO C[C@H]([NH2+][C@H]1C[C@@H]1c1cccc(F)c1)c1ccccc1O ZINC000906594274 1126960799 /nfs/dbraw/zinc/96/07/99/1126960799.db2.gz CTSXMOLYWGBIOE-XZJROXQQSA-N 1 0 271.335 3.738 20 10 CHCDRO CCCOc1ccc(C[NH2+]CCCC(F)(F)F)c(O)c1 ZINC000266501147 1126983198 /nfs/dbraw/zinc/98/31/98/1126983198.db2.gz BJHRGUCCFJFSFX-UHFFFAOYSA-N 1 0 291.313 3.613 20 10 CHCDRO Cc1cc(C[N@@H+](CC2CC2)C(C)C)ccc1N(C)C ZINC000815063684 1130954350 /nfs/dbraw/zinc/95/43/50/1130954350.db2.gz FQIUEOINZQISIR-UHFFFAOYSA-N 1 0 260.425 3.681 20 10 CHCDRO CCN(CC)c1ccc(CN[C@H](C)c2cscn2)cc1 ZINC000271112405 1127067997 /nfs/dbraw/zinc/06/79/97/1127067997.db2.gz HQOUVYWLEUUSBA-CYBMUJFWSA-N 1 0 289.448 3.840 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CC(C)(C)CCCO)cc1 ZINC000271352647 1127077134 /nfs/dbraw/zinc/07/71/34/1127077134.db2.gz DNZDEGIEOLNSCL-OAHLLOKOSA-N 1 0 292.467 3.592 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCSC1)c1ccc(N2CCCCC2)cc1 ZINC000271422921 1127080027 /nfs/dbraw/zinc/08/00/27/1127080027.db2.gz ASNQFTSPWVRJPX-HOCLYGCPSA-N 1 0 290.476 3.833 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)c(C)c2)o1 ZINC000271528418 1127088779 /nfs/dbraw/zinc/08/87/79/1127088779.db2.gz RMBYHLQHLBHWRV-AWEZNQCLSA-N 1 0 272.392 3.813 20 10 CHCDRO CC(C)[C@@H]1C[C@@H]([NH2+][C@@H](C)c2ccc(N(C)C)cc2)CCO1 ZINC000271588999 1127094246 /nfs/dbraw/zinc/09/42/46/1127094246.db2.gz SSBGSMOUJBLFPP-ZVZYQTTQSA-N 1 0 290.451 3.607 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@H]2CCO[C@@H](C)C2)cc1 ZINC000271639875 1127095597 /nfs/dbraw/zinc/09/55/97/1127095597.db2.gz ZOFJTRWQCGCUMC-JYJNAYRXSA-N 1 0 290.451 3.608 20 10 CHCDRO Cc1nnc([C@H](C)[NH2+][C@@H](C)c2ccc(C)c(C)c2O)s1 ZINC000274150160 1127109648 /nfs/dbraw/zinc/10/96/48/1127109648.db2.gz FGJSIUDYEICJOF-QWRGUYRKSA-N 1 0 291.420 3.581 20 10 CHCDRO CCOc1cccc(C[NH2+][C@H](CC)CC(F)(F)F)c1O ZINC000760651140 1127144644 /nfs/dbraw/zinc/14/46/44/1127144644.db2.gz BCUXVLXLRAXZST-LLVKDONJSA-N 1 0 291.313 3.612 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2ccc3c(c2)OCO3)c(O)c1 ZINC000284131001 1127174907 /nfs/dbraw/zinc/17/49/07/1127174907.db2.gz OHFUREDLYVRJHJ-ZDUSSCGKSA-N 1 0 299.370 3.589 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2ccc([C@H](C)O)cc2)c(O)c1 ZINC000284295393 1127180454 /nfs/dbraw/zinc/18/04/54/1127180454.db2.gz YGQXBPGZRWNLOF-GJZGRUSLSA-N 1 0 299.414 3.913 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1C=CCC1)c1ccc2ccccc2c1O ZINC000698192236 1127185239 /nfs/dbraw/zinc/18/52/39/1127185239.db2.gz VETBCJWKJWAPNA-TZMCWYRMSA-N 1 0 253.345 3.915 20 10 CHCDRO CCCC[N@@H+](Cc1ccccc1O)CC1CC(OCC)C1 ZINC000285397179 1127226124 /nfs/dbraw/zinc/22/61/24/1127226124.db2.gz TWWAVAWSWXMUNI-UHFFFAOYSA-N 1 0 291.435 3.809 20 10 CHCDRO C[C@@H]1CCC[N@H+](Cc2cc(F)c(Cl)cc2[O-])[C@H]1C ZINC001237937068 1131153442 /nfs/dbraw/zinc/15/34/42/1131153442.db2.gz NKHBIQXXYIQTRT-ZJUUUORDSA-N 1 0 271.763 3.805 20 10 CHCDRO CC(C)[C@H]1CCC[C@H]([NH2+]CCc2ccc(N)cc2)C1 ZINC000817957737 1131191470 /nfs/dbraw/zinc/19/14/70/1131191470.db2.gz OUVSABQXWQGLSA-RDJZCZTQSA-N 1 0 260.425 3.616 20 10 CHCDRO CC[C@@H]([NH2+]CC1CCOCC1)c1cccc(Cl)c1[O-] ZINC000287907925 1127315693 /nfs/dbraw/zinc/31/56/93/1127315693.db2.gz ZZVYFJBSAUQRAP-CQSZACIVSA-N 1 0 283.799 3.513 20 10 CHCDRO C[C@H]([NH2+][C@H]1CC[C@@H](C)C1)c1cc(Br)ccc1O ZINC000783311246 1127364006 /nfs/dbraw/zinc/36/40/06/1127364006.db2.gz UDPFBRNQHMNWRM-SCVCMEIPSA-N 1 0 298.224 3.994 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCC=C(c3ccco3)C2)c1O ZINC000289120089 1127374050 /nfs/dbraw/zinc/37/40/50/1127374050.db2.gz DKGMNYGLXFBQTJ-UHFFFAOYSA-N 1 0 299.370 3.673 20 10 CHCDRO C[C@@H]1CC[C@H]([NH2+]Cc2ccc3c(c2)CCO3)[C@@H](C)C1 ZINC000226174587 1127379413 /nfs/dbraw/zinc/37/94/13/1127379413.db2.gz OPIGJTGXGYEGKP-WWGRRREGSA-N 1 0 259.393 3.536 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]C2(C3CCC3)CCC2)c1O ZINC000717872002 1127384943 /nfs/dbraw/zinc/38/49/43/1127384943.db2.gz IAGPJRFHWVVOSB-UHFFFAOYSA-N 1 0 295.810 3.867 20 10 CHCDRO C[C@@H](Cc1ccccc1Cl)[NH2+]Cc1cc(F)ccc1O ZINC000226584842 1127412338 /nfs/dbraw/zinc/41/23/38/1127412338.db2.gz SPZVRNXXBDMUGH-NSHDSACASA-N 1 0 293.769 3.906 20 10 CHCDRO C[C@@H]([NH2+]C[C@]1(N(C)C)CCC[C@@H](C)C1)c1ccccc1O ZINC000226701118 1127418066 /nfs/dbraw/zinc/41/80/66/1127418066.db2.gz ZTCUJHPARCIRBN-RKVPGOIHSA-N 1 0 290.451 3.553 20 10 CHCDRO CCC1(C[NH2+]Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000226784601 1127425771 /nfs/dbraw/zinc/42/57/71/1127425771.db2.gz HAJJMPHAWHCGCC-UHFFFAOYSA-N 1 0 272.436 3.957 20 10 CHCDRO Cc1cccc(C[NH2+]CCCOC2CCCCC2)c1O ZINC000158082179 1127436821 /nfs/dbraw/zinc/43/68/21/1127436821.db2.gz NWPIRDNIJXKPDX-UHFFFAOYSA-N 1 0 277.408 3.530 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](C)CCCOC(C)C)c(Cl)c1 ZINC001308779907 1127470674 /nfs/dbraw/zinc/47/06/74/1127470674.db2.gz WJJMAWIVMJJLCG-UHFFFAOYSA-N 1 0 285.815 3.601 20 10 CHCDRO C[C@H]([NH2+]C1CC=CC1)c1ccc2ccccc2c1O ZINC000168822522 1127470962 /nfs/dbraw/zinc/47/09/62/1127470962.db2.gz CJESZTPGHDJRFQ-LBPRGKRZSA-N 1 0 253.345 3.915 20 10 CHCDRO C[N@H+](Cc1cc(Br)ccc1O)C1CCCCC1 ZINC000060201645 1127508147 /nfs/dbraw/zinc/50/81/47/1127508147.db2.gz UKCVXKDOWSULRJ-UHFFFAOYSA-N 1 0 298.224 3.919 20 10 CHCDRO Cc1ncc(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)s1 ZINC000293882832 1127529853 /nfs/dbraw/zinc/52/98/53/1127529853.db2.gz VMEYWMUGFXSSFH-NSHDSACASA-N 1 0 276.405 3.625 20 10 CHCDRO CCOC1CC[NH+](Cc2c(O)ccc3ccccc32)CC1 ZINC000060445615 1127528313 /nfs/dbraw/zinc/52/83/13/1127528313.db2.gz OPUQMFQTUXKBSL-UHFFFAOYSA-N 1 0 285.387 3.546 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CC[C@@H](C)C(C)(C)C2)c1O ZINC000761225922 1127550126 /nfs/dbraw/zinc/55/01/26/1127550126.db2.gz MYEGECKUAPJDRX-CYBMUJFWSA-N 1 0 277.408 3.659 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]C[C@H]2CC=CCC2)c1O ZINC000228672698 1127582606 /nfs/dbraw/zinc/58/26/06/1127582606.db2.gz WYIHRJCIJCFEHM-NSHDSACASA-N 1 0 281.783 3.500 20 10 CHCDRO CCC[N@H+](Cc1ccncc1C)Cc1ccccc1O ZINC000295015638 1127614174 /nfs/dbraw/zinc/61/41/74/1127614174.db2.gz ZOYFUJHCTJNYTL-UHFFFAOYSA-N 1 0 270.376 3.508 20 10 CHCDRO C[C@H](Cc1ccc(F)cc1)[NH2+]Cc1cc(Cl)ccc1O ZINC000060942097 1127625063 /nfs/dbraw/zinc/62/50/63/1127625063.db2.gz VPHYVIWVEKOODO-LLVKDONJSA-N 1 0 293.769 3.906 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]CCc1ccc3[nH]ccc3c1)CC2 ZINC000296351339 1127669381 /nfs/dbraw/zinc/66/93/81/1127669381.db2.gz HMFWPBWVKXXXFX-KRWDZBQOSA-N 1 0 292.382 3.693 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@H]1CCOc3c(F)cccc31)CC2 ZINC000296435909 1127671505 /nfs/dbraw/zinc/67/15/05/1127671505.db2.gz MHLKCVFAVCJZAX-GJZGRUSLSA-N 1 0 299.345 3.632 20 10 CHCDRO Cc1cc(O)c(C[N@H+](Cc2cccnc2)C2CC2)cc1C ZINC000296538824 1127675342 /nfs/dbraw/zinc/67/53/42/1127675342.db2.gz OFVHBOHIMPDAOE-UHFFFAOYSA-N 1 0 282.387 3.569 20 10 CHCDRO C[C@H]([NH2+]Cc1ccnc(C(F)(F)F)c1)c1ccccc1O ZINC000296555993 1127675931 /nfs/dbraw/zinc/67/59/31/1127675931.db2.gz RUOKIMDVOOORFL-JTQLQIEISA-N 1 0 296.292 3.657 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ncccc1C)c1ccc(C)cc1O ZINC000296628752 1127679207 /nfs/dbraw/zinc/67/92/07/1127679207.db2.gz XHFUPWGIMCJCMQ-MRXNPFEDSA-N 1 0 284.403 3.687 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]C1(c3ccccc3F)CC1)CC2 ZINC000296662650 1127680700 /nfs/dbraw/zinc/68/07/00/1127680700.db2.gz FKCZYESQCDITLF-HNNXBMFYSA-N 1 0 283.346 3.798 20 10 CHCDRO C[C@@H]1CCC[C@@H](C)[NH+]1Cc1c(O)cccc1Br ZINC000707147213 1127687947 /nfs/dbraw/zinc/68/79/47/1127687947.db2.gz WDBZUJBMAUEOFX-GHMZBOCLSA-N 1 0 298.224 3.918 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@H]1CCCOc3ccccc31)CC2 ZINC000297728165 1127705365 /nfs/dbraw/zinc/70/53/65/1127705365.db2.gz NMWDDQPQDXLONA-HOTGVXAUSA-N 1 0 295.382 3.883 20 10 CHCDRO COc1ccc(O)c(C[NH2+]CC[C@@H](C)c2ccccc2)c1 ZINC000061910007 1127724121 /nfs/dbraw/zinc/72/41/21/1127724121.db2.gz IPGLLBYNSYJCNL-CQSZACIVSA-N 1 0 285.387 3.684 20 10 CHCDRO CSCCCCCC[NH2+]Cc1ccc(N(C)C)cc1 ZINC000230149380 1127743767 /nfs/dbraw/zinc/74/37/67/1127743767.db2.gz HOTKPYSPOUYXQX-UHFFFAOYSA-N 1 0 280.481 3.766 20 10 CHCDRO C[C@@H]([NH2+]CC[C@@H]1CCOC1)c1ccc2ccccc2c1O ZINC000230672521 1127770816 /nfs/dbraw/zinc/77/08/16/1127770816.db2.gz PXXDEJIQSDOXCA-ZIAGYGMSSA-N 1 0 285.387 3.623 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@]2(C)CCO[C@@H]2C2CC2)c1 ZINC000373344500 1127835706 /nfs/dbraw/zinc/83/57/06/1127835706.db2.gz BAABVPALLSJTMR-VHSSKADRSA-N 1 0 289.419 3.556 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)Cc2ccco2)cc1 ZINC000035254446 1127908181 /nfs/dbraw/zinc/90/81/81/1127908181.db2.gz BXGTUVFLYFLCMC-HNNXBMFYSA-N 1 0 286.419 3.847 20 10 CHCDRO CC[C@H](C[NH2+][C@H](C)c1ccc2ccccc2c1O)OC ZINC000290214333 1127939075 /nfs/dbraw/zinc/93/90/75/1127939075.db2.gz QEBIBHBLDLMEHJ-TZMCWYRMSA-N 1 0 273.376 3.621 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H](C)c2ccc(C)c(F)c2)c1 ZINC000088511558 1127953437 /nfs/dbraw/zinc/95/34/37/1127953437.db2.gz YXJGFDXRBKUTRT-CYBMUJFWSA-N 1 0 273.351 3.999 20 10 CHCDRO C[C@H]1CCCCC[C@H]1[NH2+]Cc1ccc(N(C)C)cc1 ZINC000088507848 1127953578 /nfs/dbraw/zinc/95/35/78/1127953578.db2.gz UUNSVBQXCUHFSS-WMLDXEAASA-N 1 0 260.425 3.811 20 10 CHCDRO CC(C)OC1CCC([NH2+]Cc2cc(Cl)ccc2O)CC1 ZINC000130116158 1127961143 /nfs/dbraw/zinc/96/11/43/1127961143.db2.gz VTTMFPVVLBGADE-UHFFFAOYSA-N 1 0 297.826 3.871 20 10 CHCDRO CCCC[N@H+](Cc1ccccc1O)[C@H](C)c1ncccn1 ZINC000930350970 1128073683 /nfs/dbraw/zinc/07/36/83/1128073683.db2.gz LDLKPRAKWGZLFD-CQSZACIVSA-N 1 0 285.391 3.546 20 10 CHCDRO Cc1cnc([C@@H](C)[NH2+]Cc2cc(Cl)ccc2O)s1 ZINC000134906511 1128090956 /nfs/dbraw/zinc/09/09/56/1128090956.db2.gz WQGGKBFGDMZGDA-SECBINFHSA-N 1 0 282.796 3.661 20 10 CHCDRO c1cc(N2CCCCC2)ccc1C[NH+]1C[C@@H]2CCC[C@H]2C1 ZINC001138213857 1128124355 /nfs/dbraw/zinc/12/43/55/1128124355.db2.gz CDTDXXKKCICNCO-ROUUACIJSA-N 1 0 284.447 3.909 20 10 CHCDRO CCC[C@H](CCO)C[NH2+][C@H](CC)c1ccc(N(C)C)cc1 ZINC000152474067 1128127189 /nfs/dbraw/zinc/12/71/89/1128127189.db2.gz TYKWSQWODQCOLV-CRAIPNDOSA-N 1 0 292.467 3.592 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccc3c(c2)C[C@@H](C)O3)c1 ZINC000926921002 1128203256 /nfs/dbraw/zinc/20/32/56/1128203256.db2.gz UHTQUZNACPOKPS-KGLIPLIRSA-N 1 0 297.398 3.875 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@H]1CCSC3(CCC3)C1)CC2 ZINC000927039839 1128210866 /nfs/dbraw/zinc/21/08/66/1128210866.db2.gz SSQWVQPEGCKPKC-UONOGXRCSA-N 1 0 289.444 3.787 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCCc2cccnc21)c1ccccc1O ZINC000927063275 1128213053 /nfs/dbraw/zinc/21/30/53/1128213053.db2.gz BQANYLZZEHAJLR-HOTGVXAUSA-N 1 0 282.387 3.906 20 10 CHCDRO Cc1ccccc1C[C@H](C)[N@H+](C)Cc1ccccc1O ZINC000777825263 1128288472 /nfs/dbraw/zinc/28/84/72/1128288472.db2.gz RUONYXIEMLTNER-HNNXBMFYSA-N 1 0 269.388 3.764 20 10 CHCDRO Cc1c(C[N@@H+]2CCC[C@H](F)CC2)c2ccccc2n1C ZINC001138252868 1128285901 /nfs/dbraw/zinc/28/59/01/1128285901.db2.gz XCXJKHIUHFOYBE-AWEZNQCLSA-N 1 0 274.383 3.811 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CC2(N(C)C)CCCCC2)c1 ZINC000035628737 1128319386 /nfs/dbraw/zinc/31/93/86/1128319386.db2.gz VSQNIJYHJDPLEF-OAHLLOKOSA-N 1 0 290.451 3.616 20 10 CHCDRO COc1cccc(C[N@H+](C)Cc2cc3c(cc2O)CCC3)c1 ZINC000915804488 1128339850 /nfs/dbraw/zinc/33/98/50/1128339850.db2.gz WPMHUYSMDRQARE-UHFFFAOYSA-N 1 0 297.398 3.522 20 10 CHCDRO C[N@@H+](Cc1cc2c(cc1O)CCC2)Cc1ccccc1F ZINC000915814311 1128342538 /nfs/dbraw/zinc/34/25/38/1128342538.db2.gz STFAETKMZMQCGU-UHFFFAOYSA-N 1 0 285.362 3.652 20 10 CHCDRO CC[N@H+](Cc1ccccc1C)Cc1cccc(OC)c1O ZINC000153740700 1128346846 /nfs/dbraw/zinc/34/68/46/1128346846.db2.gz KXEOCQMKRJRHGN-UHFFFAOYSA-N 1 0 285.387 3.731 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccccc1CF)c1ccccc1O ZINC000931555260 1128369033 /nfs/dbraw/zinc/36/90/33/1128369033.db2.gz WIBNVVSMHGUPKU-GFCCVEGCSA-N 1 0 259.324 3.713 20 10 CHCDRO Cc1noc(C)c1C[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000917073810 1128473812 /nfs/dbraw/zinc/47/38/12/1128473812.db2.gz BKBCDXKZORTTEW-UHFFFAOYSA-N 1 0 299.418 3.522 20 10 CHCDRO CC(C)=CC[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000917074167 1128474196 /nfs/dbraw/zinc/47/41/96/1128474196.db2.gz RRPMKVCVYDLBGG-UHFFFAOYSA-N 1 0 258.409 3.683 20 10 CHCDRO C[C@H]1CC[C@]2(CC[N@H+](Cc3c(O)ccc4ccncc43)C2)C1 ZINC000781585510 1128569019 /nfs/dbraw/zinc/56/90/19/1128569019.db2.gz GOYDXGNFMNBJGY-LIRRHRJNSA-N 1 0 296.414 3.953 20 10 CHCDRO Cc1cccc(OCC[NH2+][C@H](C)c2cc(C)ccc2O)c1 ZINC000042895923 1128589147 /nfs/dbraw/zinc/58/91/47/1128589147.db2.gz HZDMIDPIQLPVIK-OAHLLOKOSA-N 1 0 285.387 3.739 20 10 CHCDRO CC[C@H]([NH2+]CCOc1cccc(C)c1)c1ccccc1O ZINC000042896032 1128589245 /nfs/dbraw/zinc/58/92/45/1128589245.db2.gz KVLSSJBKNKOBKK-KRWDZBQOSA-N 1 0 285.387 3.820 20 10 CHCDRO CC(C)C[C@H](C)[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1 ZINC000155307036 1128604405 /nfs/dbraw/zinc/60/44/05/1128604405.db2.gz IZTMEVBJZNNCBT-HOTGVXAUSA-N 1 0 290.451 3.608 20 10 CHCDRO CC[C@H]([NH2+]C[C@@](C)(O)CCC(C)C)c1ccccc1O ZINC000155971722 1128621416 /nfs/dbraw/zinc/62/14/16/1128621416.db2.gz QEDWMQIUGNLSMH-RDJZCZTQSA-N 1 0 279.424 3.620 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCC[C@@H]3CCC[C@@H]32)c1O ZINC000156039588 1128623349 /nfs/dbraw/zinc/62/33/49/1128623349.db2.gz HBAIIESLPVJOEN-ZFWWWQNUSA-N 1 0 275.392 3.555 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C[C@@H]2CC=CCC2)cc1 ZINC000044346442 1128628408 /nfs/dbraw/zinc/62/84/08/1128628408.db2.gz TVDNPTXNPMSBAQ-MRXNPFEDSA-N 1 0 272.436 3.979 20 10 CHCDRO Cc1cccc(C[N@@H+](C)[C@@H]2CCc3ccccc32)c1O ZINC000158024513 1128663306 /nfs/dbraw/zinc/66/33/06/1128663306.db2.gz JYRYRQMBLCAZQK-QGZVFWFLSA-N 1 0 267.372 3.820 20 10 CHCDRO CC(C)[C@H](C)[N@H+](Cc1cc(F)ccc1O)C1CC1 ZINC000778988668 1128673796 /nfs/dbraw/zinc/67/37/96/1128673796.db2.gz KFRUNMOBAXHXBT-NSHDSACASA-N 1 0 251.345 3.540 20 10 CHCDRO C[C@H]1[C@@H](Cc2ccccc2)CC[N@@H+]1Cc1ccccc1O ZINC000779023634 1128685950 /nfs/dbraw/zinc/68/59/50/1128685950.db2.gz VBNDPCGKZVPGRG-DOTOQJQBSA-N 1 0 281.399 3.845 20 10 CHCDRO CCCN(CCC)c1ccc(C[NH2+]CCSC)cc1 ZINC000920957032 1128696932 /nfs/dbraw/zinc/69/69/32/1128696932.db2.gz WLOVEGBUQUPLCU-UHFFFAOYSA-N 1 0 280.481 3.766 20 10 CHCDRO Cc1cc(Br)cc([C@H](C)[NH2+]C2CC(C)C2)c1O ZINC000779036705 1128697590 /nfs/dbraw/zinc/69/75/90/1128697590.db2.gz QLHQQJNWVIFVCA-BSTRBVHOSA-N 1 0 298.224 3.912 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]C1(c2ccc(F)cc2)CCC1 ZINC000779064671 1128714618 /nfs/dbraw/zinc/71/46/18/1128714618.db2.gz GWWONMRBXMWHKV-UHFFFAOYSA-N 1 0 289.325 3.839 20 10 CHCDRO C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCC(C)(C)O2)c2c1c(F)ccc2O ZINC000779078457 1128722279 /nfs/dbraw/zinc/72/22/79/1128722279.db2.gz GHNFBFVAPXSAAX-NQBHXWOUSA-N 1 0 293.382 3.627 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@H]2CCC(C)(C)O2)cc1 ZINC000779080194 1128723796 /nfs/dbraw/zinc/72/37/96/1128723796.db2.gz VBAQVCCTESSJIJ-WMLDXEAASA-N 1 0 290.451 3.751 20 10 CHCDRO CCCC[N@H+](Cc1cc(OC)c(OC)cc1O)[C@@H](C)CC ZINC000159820831 1128730102 /nfs/dbraw/zinc/73/01/02/1128730102.db2.gz FBTIIMHIHHNMLJ-ZDUSSCGKSA-N 1 0 295.423 3.810 20 10 CHCDRO CS[C@@H]1CCC[C@@H]([NH2+][C@@H](C)c2ccccc2O)C1 ZINC000228793574 1117770237 /nfs/dbraw/zinc/77/02/37/1117770237.db2.gz QKKXJWCLJCVODL-YNEHKIRRSA-N 1 0 265.422 3.717 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)CCc2ccco2)c1 ZINC000035628881 1117811751 /nfs/dbraw/zinc/81/17/51/1117811751.db2.gz KSMBQZCDSPYQIZ-UONOGXRCSA-N 1 0 273.376 3.966 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@](C)(O)CCC(C)C)c(O)c1 ZINC000185528119 1117838486 /nfs/dbraw/zinc/83/84/86/1117838486.db2.gz JCAVJRGASMXXER-WMLDXEAASA-N 1 0 279.424 3.538 20 10 CHCDRO CCO[C@@H]1C[C@@H]([NH2+][C@@H](C)c2cc(F)ccc2O)C12CCC2 ZINC000185551739 1117844240 /nfs/dbraw/zinc/84/42/40/1117844240.db2.gz NYFCLDBDPWWMRK-IUIKQTSFSA-N 1 0 293.382 3.530 20 10 CHCDRO CCO[C@@H]1C[C@@H]([NH2+][C@@H](C)c2ccc(C)cc2O)C12CCC2 ZINC000185551649 1117845102 /nfs/dbraw/zinc/84/51/02/1117845102.db2.gz DQXOMZZTRKUNTH-IAOVAPTHSA-N 1 0 289.419 3.699 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2cccc(C#N)c2)c1 ZINC000185610686 1117857285 /nfs/dbraw/zinc/85/72/85/1117857285.db2.gz NUUNQYCIQTVZBF-CHWSQXEVSA-N 1 0 296.370 3.684 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2cccc(C#N)c2)c1 ZINC000185610642 1117857428 /nfs/dbraw/zinc/85/74/28/1117857428.db2.gz NUUNQYCIQTVZBF-STQMWFEESA-N 1 0 296.370 3.684 20 10 CHCDRO CC(C)[C@@H]1CCC[N@@H+]1Cc1c(O)ccc2ccncc21 ZINC000049099602 1128743646 /nfs/dbraw/zinc/74/36/46/1128743646.db2.gz WHQASOXOKWWEDV-INIZCTEOSA-N 1 0 270.376 3.561 20 10 CHCDRO CO[C@@H](C[NH2+][C@@H](C)c1ccc(C)cc1O)C1CCCC1 ZINC000692981381 1117959563 /nfs/dbraw/zinc/95/95/63/1117959563.db2.gz UWAGZFCHNLELHQ-GUYCJALGSA-N 1 0 277.408 3.556 20 10 CHCDRO C[C@H](Cc1ccsc1)[N@H+](C)Cc1ccccc1O ZINC000179581140 1128748893 /nfs/dbraw/zinc/74/88/93/1128748893.db2.gz CPMVWRVXCVEBHN-GFCCVEGCSA-N 1 0 261.390 3.517 20 10 CHCDRO CC[N@H+](Cc1cccs1)Cc1cccc(C)c1O ZINC000179604113 1128750610 /nfs/dbraw/zinc/75/06/10/1128750610.db2.gz XYMVRRNOSREQFK-UHFFFAOYSA-N 1 0 261.390 3.784 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+][C@H]2CC(C)(C)OC2(C)C)c1O ZINC000779151377 1128753066 /nfs/dbraw/zinc/75/30/66/1128753066.db2.gz XNAAGNDQUNLYDI-ZDUSSCGKSA-N 1 0 297.826 3.790 20 10 CHCDRO Cc1cccc(C[N@H+](Cc2cccs2)C2CC2)c1O ZINC000179679716 1128754253 /nfs/dbraw/zinc/75/42/53/1128754253.db2.gz OPTADKBECYSOFW-UHFFFAOYSA-N 1 0 273.401 3.927 20 10 CHCDRO C[N@@H+](Cc1ccccc1O)CC1CCC(F)(F)CC1 ZINC000693043646 1118094563 /nfs/dbraw/zinc/09/45/63/1118094563.db2.gz MCWJLSRDCQLDOR-UHFFFAOYSA-N 1 0 269.335 3.650 20 10 CHCDRO Cc1cccc(C[NH+]2CCC(Oc3ccccc3)CC2)c1O ZINC000179728457 1128756014 /nfs/dbraw/zinc/75/60/14/1128756014.db2.gz RCNLAGAEUYJTGU-UHFFFAOYSA-N 1 0 297.398 3.744 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1C[C@H]1C)c1ccc(N2CCCCC2)cc1 ZINC000765336876 1118145332 /nfs/dbraw/zinc/14/53/32/1118145332.db2.gz LIUZHOPNLNGLOI-HLLBOEOZSA-N 1 0 272.436 3.984 20 10 CHCDRO Cc1ccccc1OCC[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000765397192 1118148455 /nfs/dbraw/zinc/14/84/55/1118148455.db2.gz ZWCIPUZEEKLZOO-MRXNPFEDSA-N 1 0 298.430 3.791 20 10 CHCDRO CC[C@@H]([NH2+]CCOC1CCCC1)c1ccc(N(C)C)cc1 ZINC000765420090 1118151279 /nfs/dbraw/zinc/15/12/79/1118151279.db2.gz NHCNVNHPGWBKGL-GOSISDBHSA-N 1 0 290.451 3.753 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@](C)(O)C2CCCCC2)c1 ZINC000188671633 1128764524 /nfs/dbraw/zinc/76/45/24/1128764524.db2.gz VAWVTJWZDUUJKS-KBXCAEBGSA-N 1 0 291.435 3.683 20 10 CHCDRO Cc1cc([C@H]2CCC[N@@H+]2Cc2c(C)ccc(C)c2O)no1 ZINC001140178202 1118241522 /nfs/dbraw/zinc/24/15/22/1118241522.db2.gz CFTQQQGVAHFQBP-MRXNPFEDSA-N 1 0 286.375 3.643 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CC[C@H](F)C(F)(F)CC2)c1O ZINC001140178790 1118242398 /nfs/dbraw/zinc/24/23/98/1118242398.db2.gz XQEBZPFZLGWBSF-ZDUSSCGKSA-N 1 0 287.325 3.578 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1ccncc1OC)c1ccccc1O ZINC000188763304 1128765049 /nfs/dbraw/zinc/76/50/49/1128765049.db2.gz SMNMKAYQTVLEMP-IUODEOHRSA-N 1 0 286.375 3.598 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]Cc2ccc(C)cc2)c1O ZINC000076274231 1118282956 /nfs/dbraw/zinc/28/29/56/1118282956.db2.gz WMRJSMNFCRRATJ-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)cn1 ZINC000062050914 1118347252 /nfs/dbraw/zinc/34/72/52/1118347252.db2.gz YYPGKJZIHFRPHS-IUODEOHRSA-N 1 0 282.387 3.742 20 10 CHCDRO CC[C@H]([NH2+]CC1(O)CCCCCC1)c1ccccc1O ZINC000087088997 1118452616 /nfs/dbraw/zinc/45/26/16/1118452616.db2.gz VTSLWBWJDOWKDP-HNNXBMFYSA-N 1 0 277.408 3.518 20 10 CHCDRO COc1ccc(C[NH2+]C(C)(C)c2c(C)noc2C)cc1C ZINC000285414106 1118464746 /nfs/dbraw/zinc/46/47/46/1118464746.db2.gz FZHVYTIGYMXIRF-UHFFFAOYSA-N 1 0 288.391 3.633 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C2(C3(C)CC3)CC2)cc1 ZINC000398204904 1118499175 /nfs/dbraw/zinc/49/91/75/1118499175.db2.gz ASIOUWPVPMLQRT-UHFFFAOYSA-N 1 0 272.436 3.955 20 10 CHCDRO C[C@H]1CC[N@H+](Cc2ccc(Cl)cc2O)CC1(C)C ZINC001664205643 1118525397 /nfs/dbraw/zinc/52/53/97/1118525397.db2.gz WJIYKSQOTPZBLD-NSHDSACASA-N 1 0 267.800 3.914 20 10 CHCDRO CC1(C[NH2+]Cc2c(O)cccc2Br)CCCC1 ZINC000706843367 1118553074 /nfs/dbraw/zinc/55/30/74/1118553074.db2.gz TYOAYMHZWFDYDW-UHFFFAOYSA-N 1 0 298.224 3.825 20 10 CHCDRO C[C@@H]1CCC[C@@H]1C[NH2+]Cc1c(O)cccc1Br ZINC000706847059 1118553196 /nfs/dbraw/zinc/55/31/96/1118553196.db2.gz VFDUJDUGCHTQQM-GHMZBOCLSA-N 1 0 298.224 3.681 20 10 CHCDRO CC(C)CCO[C@@H]1CC[N@H+](Cc2cccc(Cl)c2[O-])C1 ZINC000180295831 1128785751 /nfs/dbraw/zinc/78/57/51/1128785751.db2.gz NJBOZRDICNMHAX-CQSZACIVSA-N 1 0 297.826 3.683 20 10 CHCDRO CCOc1cccc(C[NH2+][C@H]2CCC[C@H](CC)C2)c1O ZINC000068591619 1128786726 /nfs/dbraw/zinc/78/67/26/1128786726.db2.gz WZWVJHAGXZYZOW-ZFWWWQNUSA-N 1 0 277.408 3.849 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]CC1CCC(F)(F)CC1 ZINC000693368814 1118583049 /nfs/dbraw/zinc/58/30/49/1118583049.db2.gz YJQMVBOOWKJCPC-UHFFFAOYSA-N 1 0 289.753 3.961 20 10 CHCDRO COc1cccc(C[NH2+][C@H](C)CCC(C)(C)C)c1O ZINC000076768612 1128788355 /nfs/dbraw/zinc/78/83/55/1128788355.db2.gz XFVAUSIEKFTIFN-GFCCVEGCSA-N 1 0 265.397 3.705 20 10 CHCDRO CCO[C@@H]1CCC[C@H]1[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000834911268 1118629182 /nfs/dbraw/zinc/62/91/82/1118629182.db2.gz ISRZTMHTHFPHMZ-NUEKZKHPSA-N 1 0 277.408 3.617 20 10 CHCDRO C[C@H]1CCCCC[N@@H+]1Cc1c(O)cccc1Br ZINC000707146649 1118648097 /nfs/dbraw/zinc/64/80/97/1118648097.db2.gz PDYHPGVUHXHYLP-NSHDSACASA-N 1 0 298.224 3.919 20 10 CHCDRO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1c(O)cccc1Br ZINC000707147215 1118648383 /nfs/dbraw/zinc/64/83/83/1118648383.db2.gz WDBZUJBMAUEOFX-PHIMTYICSA-N 1 0 298.224 3.918 20 10 CHCDRO COc1cc(C)cc(C[N@@H+]2CCC[C@H](C(C)C)C2)c1O ZINC000780496916 1118756535 /nfs/dbraw/zinc/75/65/35/1118756535.db2.gz KZSVSJBNMRWKMZ-AWEZNQCLSA-N 1 0 277.408 3.577 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]CCC2CC(F)(F)C2)cc1 ZINC000835060675 1118836386 /nfs/dbraw/zinc/83/63/86/1118836386.db2.gz UNHLTVQUIGLGKM-ARJAWSKDSA-N 1 0 294.389 3.791 20 10 CHCDRO [O-]c1cc(F)cc(F)c1C[N@@H+]1CC[C@@H](c2ccccc2)C1 ZINC001140582466 1119148229 /nfs/dbraw/zinc/14/82/29/1119148229.db2.gz JAFALQQWJJBLNT-CYBMUJFWSA-N 1 0 289.325 3.660 20 10 CHCDRO C[C@H]([NH2+]Cc1cc(F)ccc1O)C1CCCCC1 ZINC000226611331 1119224828 /nfs/dbraw/zinc/22/48/28/1119224828.db2.gz OSBAWYCLJGASBU-NSHDSACASA-N 1 0 251.345 3.590 20 10 CHCDRO C[C@H]1CCC[C@@H](C[NH2+]Cc2c(O)cccc2Cl)C1 ZINC000226646780 1119256100 /nfs/dbraw/zinc/25/61/00/1119256100.db2.gz KJJDTBUTIJDDQR-NWDGAFQWSA-N 1 0 267.800 3.962 20 10 CHCDRO CCC1(C[NH2+]Cc2ccc(N3CCCC3)cc2)CC1 ZINC000226785281 1119335855 /nfs/dbraw/zinc/33/58/55/1119335855.db2.gz DXPAQJSPWKNFOP-UHFFFAOYSA-N 1 0 258.409 3.567 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CC[C@@H]3CCCC[C@H]3C2)c1O ZINC000250520127 1119441940 /nfs/dbraw/zinc/44/19/40/1119441940.db2.gz RTJCURGMCJBNIQ-GJZGRUSLSA-N 1 0 289.419 3.803 20 10 CHCDRO C[C@H]([NH2+]CC1(N(C)C)CCC1)c1ccc2ccccc2c1O ZINC000317975883 1119448110 /nfs/dbraw/zinc/44/81/10/1119448110.db2.gz HGEQFSADYRYOSO-AWEZNQCLSA-N 1 0 298.430 3.680 20 10 CHCDRO CSC[C@@H](C)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000168786671 1119477939 /nfs/dbraw/zinc/47/79/39/1119477939.db2.gz NRIBYLOGNHYPPK-NEPJUHHUSA-N 1 0 275.417 3.948 20 10 CHCDRO Cc1ccccc1[C@H]1C[N@H+](Cc2ccccc2O)[C@H](C)CO1 ZINC000179578517 1119751838 /nfs/dbraw/zinc/75/18/38/1119751838.db2.gz XGLFVBJYTAXYJL-DNVCBOLYSA-N 1 0 297.398 3.663 20 10 CHCDRO C[C@H]1[C@H](c2ccccc2)CC[N@@H+]1Cc1ccccc1O ZINC000179580503 1119751941 /nfs/dbraw/zinc/75/19/41/1119751941.db2.gz XEHIIQGXXJSQSB-WMLDXEAASA-N 1 0 267.372 3.770 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H]2CCC23CCCC3)cc1 ZINC000694340112 1119858718 /nfs/dbraw/zinc/85/87/18/1119858718.db2.gz NPAOPKXZDPPYME-INIZCTEOSA-N 1 0 258.409 3.565 20 10 CHCDRO CC(C)CCC[NH2+]CCCSc1nccs1 ZINC000309404124 1119988852 /nfs/dbraw/zinc/98/88/52/1119988852.db2.gz WWLIHLPFNNVHOK-UHFFFAOYSA-N 1 0 258.456 3.651 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCC(F)(F)C2)c1 ZINC000310976470 1120000972 /nfs/dbraw/zinc/00/09/72/1120000972.db2.gz QHHTVMYVFOLJAG-MNOVXSKESA-N 1 0 255.308 3.539 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCC(F)(F)C2)c1 ZINC000310976468 1120001206 /nfs/dbraw/zinc/00/12/06/1120001206.db2.gz QHHTVMYVFOLJAG-GHMZBOCLSA-N 1 0 255.308 3.539 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]Cc1ccc(Cl)s1)CC2 ZINC000311037781 1120011845 /nfs/dbraw/zinc/01/18/45/1120011845.db2.gz FWHPTOWRGZXLEO-NSHDSACASA-N 1 0 279.792 3.884 20 10 CHCDRO Cc1cc(C)cc([C@@H](C)[NH2+]Cc2ccccc2O)c1 ZINC000107319889 1120058758 /nfs/dbraw/zinc/05/87/58/1120058758.db2.gz DZYGPZNCNDZWSQ-CQSZACIVSA-N 1 0 255.361 3.860 20 10 CHCDRO CCSCC[C@@H](C)[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000168809205 1120096927 /nfs/dbraw/zinc/09/69/27/1120096927.db2.gz HHIWVUYQBJPZNQ-OLZOCXBDSA-N 1 0 267.438 3.883 20 10 CHCDRO CC(C)c1cc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)on1 ZINC000169228440 1120105355 /nfs/dbraw/zinc/10/53/55/1120105355.db2.gz BLWYWTJIYBWXTH-CYBMUJFWSA-N 1 0 287.407 3.715 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCCO2)c1cccc(O)c1 ZINC000921688988 1120113773 /nfs/dbraw/zinc/11/37/73/1120113773.db2.gz NTNRWRJBDYADPU-CYBMUJFWSA-N 1 0 283.371 3.568 20 10 CHCDRO C[C@@H]([NH2+]CC1CCOCC1)c1ccc2ccccc2c1O ZINC000111159193 1120138334 /nfs/dbraw/zinc/13/83/34/1120138334.db2.gz ZIOUFXBSXRDPJW-CYBMUJFWSA-N 1 0 285.387 3.623 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCCN(C)c2ccccc2)c(O)c1 ZINC000314041387 1120166030 /nfs/dbraw/zinc/16/60/30/1120166030.db2.gz BOWWFWPLVBZNLZ-INIZCTEOSA-N 1 0 298.430 3.878 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)Cc2ccco2)c(O)c1C ZINC000756379210 1120282640 /nfs/dbraw/zinc/28/26/40/1120282640.db2.gz MEDFNSCYGYHPRX-TZMCWYRMSA-N 1 0 273.376 3.884 20 10 CHCDRO CC[C@@H](C[NH2+][C@@H](C)c1ccc(C)c(C)c1O)N1CCCC1 ZINC000756400919 1120311842 /nfs/dbraw/zinc/31/18/42/1120311842.db2.gz LFCVONACOJMYIO-HOTGVXAUSA-N 1 0 290.451 3.534 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H](C)N(C)c2ccccc2)c1 ZINC000756415084 1120329447 /nfs/dbraw/zinc/32/94/47/1120329447.db2.gz KFTPSUPOGFGRJZ-JKSUJKDBSA-N 1 0 298.430 3.876 20 10 CHCDRO c1cc(N2CCCCC2)ccc1C[NH2+]CC1(C2CC2)CC1 ZINC000228717690 1120331456 /nfs/dbraw/zinc/33/14/56/1120331456.db2.gz RNDMBZTZWIZJFW-UHFFFAOYSA-N 1 0 284.447 3.957 20 10 CHCDRO C[N@H+](Cc1ccc(OCc2ccccc2)cc1O)C1CC1 ZINC000182990485 1120332851 /nfs/dbraw/zinc/33/28/51/1120332851.db2.gz PIOBUUPNPPQSJD-UHFFFAOYSA-N 1 0 283.371 3.565 20 10 CHCDRO CCc1ccc(C[NH2+][C@@H](C)c2ccccc2O)s1 ZINC000183419639 1120341146 /nfs/dbraw/zinc/34/11/46/1120341146.db2.gz OSXDJFOVYVZLMZ-NSHDSACASA-N 1 0 261.390 3.867 20 10 CHCDRO Cc1cccc(C)c1C[NH2+]Cc1c(O)cccc1Cl ZINC000132121980 1120352174 /nfs/dbraw/zinc/35/21/74/1120352174.db2.gz VYXHCQGXTDKNBT-UHFFFAOYSA-N 1 0 275.779 3.952 20 10 CHCDRO Cc1cncc([C@H](C)[NH2+]Cc2ccc3c(c2)CCCN3C)c1 ZINC000184329446 1120355319 /nfs/dbraw/zinc/35/53/19/1120355319.db2.gz UWHBUFYDRNGVTL-HNNXBMFYSA-N 1 0 295.430 3.623 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](CCO)C2CCCCC2)c1 ZINC000185828713 1120386465 /nfs/dbraw/zinc/38/64/65/1120386465.db2.gz WIVUMVGZKUPAQN-YOEHRIQHSA-N 1 0 291.435 3.683 20 10 CHCDRO C[C@H](CCC1CC1)[NH2+]CCCSc1nccs1 ZINC000186345992 1120396094 /nfs/dbraw/zinc/39/60/94/1120396094.db2.gz MVKQRFJGEQLHCK-LLVKDONJSA-N 1 0 270.467 3.794 20 10 CHCDRO C[C@H]([NH2+]C1(Cc2ccccc2)CC1)c1cc(F)ccc1O ZINC000186579638 1120402578 /nfs/dbraw/zinc/40/25/78/1120402578.db2.gz DFIUYIXNTQMQPN-ZDUSSCGKSA-N 1 0 285.362 3.957 20 10 CHCDRO C[C@]1(CC[NH2+]Cc2ccc3c(c2)CCCO3)CC1(F)F ZINC000922248921 1120484579 /nfs/dbraw/zinc/48/45/79/1120484579.db2.gz GKVSGBHQDYRCDO-HNNXBMFYSA-N 1 0 281.346 3.537 20 10 CHCDRO CC1(C[NH2+]Cc2ccc3c(c2)CCCO3)CC(F)(F)C1 ZINC000922331304 1120515671 /nfs/dbraw/zinc/51/56/71/1120515671.db2.gz UVRQMVPQUZORJS-UHFFFAOYSA-N 1 0 281.346 3.537 20 10 CHCDRO CCN1CCCC[C@H]1C[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000756565186 1120531648 /nfs/dbraw/zinc/53/16/48/1120531648.db2.gz WIJFHZXBQPGNHH-OCCSQVGLSA-N 1 0 296.842 3.571 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(F)cc2)c(O)c1 ZINC000020090630 1120582707 /nfs/dbraw/zinc/58/27/07/1120582707.db2.gz PDMSCETXUAJOJV-LBPRGKRZSA-N 1 0 259.324 3.691 20 10 CHCDRO Cc1cnc(C[NH2+]C/C=C/c2ccc(N(C)C)cc2)c(C)c1 ZINC000922740226 1120589839 /nfs/dbraw/zinc/58/98/39/1120589839.db2.gz DXYQJHIIZZLEAO-AATRIKPKSA-N 1 0 295.430 3.567 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@@H]2C[C@H]2C(F)(F)F)c(Cl)c1 ZINC000922730443 1120590830 /nfs/dbraw/zinc/59/08/30/1120590830.db2.gz XHFVMXJFTXQDIK-WCBMZHEXSA-N 1 0 293.716 3.642 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+][C@H]1CCCc2cccnc21 ZINC000922879739 1120616875 /nfs/dbraw/zinc/61/68/75/1120616875.db2.gz BEWPYVWBQUJYSS-AWEZNQCLSA-N 1 0 288.778 3.608 20 10 CHCDRO C[C@@H]([NH2+]CC[C@H]1CC1(Cl)Cl)c1cc(F)ccc1O ZINC000857082389 1120628346 /nfs/dbraw/zinc/62/83/46/1120628346.db2.gz NDDGDQQZBHOHFI-BDAKNGLRSA-N 1 0 292.181 3.766 20 10 CHCDRO CC(C)C[C@@H]1OCCC[C@H]1[NH2+][C@@H](C)c1ccccc1O ZINC000186826564 1120675106 /nfs/dbraw/zinc/67/51/06/1120675106.db2.gz FWPZYJXBHUORFR-LXZKKBNFSA-N 1 0 277.408 3.637 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)CCc1ccco1 ZINC000766030031 1120675110 /nfs/dbraw/zinc/67/51/10/1120675110.db2.gz SRZKOUNOHVBZDZ-OAHLLOKOSA-N 1 0 286.419 3.765 20 10 CHCDRO CCOc1cccc(C[NH2+]C(CC)(CC)CC)c1O ZINC000086642401 1120698906 /nfs/dbraw/zinc/69/89/06/1120698906.db2.gz SZRKBJNHJZLVKC-UHFFFAOYSA-N 1 0 265.397 3.849 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCCOCC2CC2)cc1 ZINC000162860696 1120902389 /nfs/dbraw/zinc/90/23/89/1120902389.db2.gz UGYREYCVENHMOL-OAHLLOKOSA-N 1 0 290.451 3.610 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]CCCCCSC)c1 ZINC000186781603 1120934664 /nfs/dbraw/zinc/93/46/64/1120934664.db2.gz QGEOICSCNJGYDS-LBPRGKRZSA-N 1 0 283.437 3.585 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(C)c(C)n1)c1ccccc1O ZINC000314846380 1120978124 /nfs/dbraw/zinc/97/81/24/1120978124.db2.gz UYHXINBVTLYUCP-INIZCTEOSA-N 1 0 270.376 3.645 20 10 CHCDRO CC[NH+](CC)CCC[C@H](C)[N@H+](CC)Cc1ccccc1O ZINC001167838913 1121042868 /nfs/dbraw/zinc/04/28/68/1121042868.db2.gz XDPOKZXVIXPMRB-INIZCTEOSA-N 1 0 292.467 3.725 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCCC1(C)C)c1cc(F)ccc1O ZINC000094618522 1121087325 /nfs/dbraw/zinc/08/73/25/1121087325.db2.gz UMMBXKNWSZVRDR-IINYFYTJSA-N 1 0 251.345 3.761 20 10 CHCDRO CC1(C)C[C@@H](C[NH2+]Cc2c(O)cccc2Cl)C(C)(C)O1 ZINC000709708737 1121129504 /nfs/dbraw/zinc/12/95/04/1121129504.db2.gz YGQSZGHJLOXEOP-NSHDSACASA-N 1 0 297.826 3.729 20 10 CHCDRO Cc1cc(C[NH2+]CC[C@H]2CCOC2)c(C)n1-c1ccccc1 ZINC000318836996 1121160103 /nfs/dbraw/zinc/16/01/03/1121160103.db2.gz LYOUJJIEEUBLMY-KRWDZBQOSA-N 1 0 298.430 3.610 20 10 CHCDRO CCc1cccc(C[N@@H+]2CCC[C@H](CCF)C2)c1O ZINC000701676228 1121163715 /nfs/dbraw/zinc/16/37/15/1121163715.db2.gz XPHAIMGMNFLGGW-CYBMUJFWSA-N 1 0 265.372 3.526 20 10 CHCDRO CCCC[C@H](COC)[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000766076207 1121184132 /nfs/dbraw/zinc/18/41/32/1121184132.db2.gz QMGLLLDIHGIBCN-GDBMZVCRSA-N 1 0 278.440 3.608 20 10 CHCDRO c1cc(N2CCCCC2)ccc1C[NH2+]C1CCSCC1 ZINC000062426166 1121188669 /nfs/dbraw/zinc/18/86/69/1121188669.db2.gz PTIRIOIJCURLCJ-UHFFFAOYSA-N 1 0 290.476 3.662 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CCCC(F)(F)CC1 ZINC000702773214 1121213272 /nfs/dbraw/zinc/21/32/72/1121213272.db2.gz YXLLHUUZIFZAPB-UHFFFAOYSA-N 1 0 275.726 3.667 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@H]1CCC[C@H](C)O1 ZINC001203162003 1121227070 /nfs/dbraw/zinc/22/70/70/1121227070.db2.gz VBDIUTDTZFPIFL-DZGCQCFKSA-N 1 0 286.419 3.534 20 10 CHCDRO CCCC[N@H+](Cc1cccnc1)Cc1ccccc1O ZINC000282524860 1121320359 /nfs/dbraw/zinc/32/03/59/1121320359.db2.gz UJFRUZFFMUNALO-UHFFFAOYSA-N 1 0 270.376 3.590 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCCC12CC2)c1cc(F)ccc1O ZINC000706226653 1121420219 /nfs/dbraw/zinc/42/02/19/1121420219.db2.gz SDSWRBHGIMQVAW-NWDGAFQWSA-N 1 0 263.356 3.762 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]C[C@@H]1CCCC13CC3)CC2 ZINC000707057395 1121449096 /nfs/dbraw/zinc/44/90/96/1121449096.db2.gz KCNFUJJVFZPTNR-UONOGXRCSA-N 1 0 257.377 3.549 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCCO[C@H]2CC(C)C)c1 ZINC000248583114 1121575271 /nfs/dbraw/zinc/57/52/71/1121575271.db2.gz WNYLAORRVYKIBP-ZVZYQTTQSA-N 1 0 291.435 3.945 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]C2(C)CCCCC2)c1 ZINC000237032893 1121647279 /nfs/dbraw/zinc/64/72/79/1121647279.db2.gz SNEFSXVQLFSTER-UHFFFAOYSA-N 1 0 263.381 3.603 20 10 CHCDRO CC[N@H+](CCC(F)(F)F)Cc1c(O)cccc1Cl ZINC000688499758 1129004118 /nfs/dbraw/zinc/00/41/18/1129004118.db2.gz KKSUQQXJBBOJRZ-UHFFFAOYSA-N 1 0 281.705 3.820 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CCc2ccccc2C)c(Cl)c1 ZINC001177981461 1121761859 /nfs/dbraw/zinc/76/18/59/1121761859.db2.gz LTUJMAYLXKTJEO-UHFFFAOYSA-N 1 0 289.806 3.995 20 10 CHCDRO COc1cc(C)cc(C[NH2+]Cc2ccc(OC)c(C)c2)c1 ZINC001178276622 1121777121 /nfs/dbraw/zinc/77/71/21/1121777121.db2.gz ZPSQRXDKQZEBSJ-UHFFFAOYSA-N 1 0 285.387 3.610 20 10 CHCDRO C[N@H+](Cc1cc2oc3ccccc3c2cc1O)[C@@H]1CCOC1 ZINC000730259798 1121799736 /nfs/dbraw/zinc/79/97/36/1121799736.db2.gz DFJZCVXAZPYFQT-CYBMUJFWSA-N 1 0 297.354 3.512 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C[C@@H]2CCCC2(C)C)cc1F ZINC001178783471 1121815670 /nfs/dbraw/zinc/81/56/70/1121815670.db2.gz RCJVZLDQCVMOMG-AWEZNQCLSA-N 1 0 278.415 3.808 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)[C@@H]1CC1(C)C ZINC001178977456 1121831135 /nfs/dbraw/zinc/83/11/35/1121831135.db2.gz MBFUYOIKRYIKOO-SWLSCSKDSA-N 1 0 296.405 3.945 20 10 CHCDRO C[C@H]1C[NH+](Cc2ccc(N(C)C)c3ccccc23)C[C@H](C)O1 ZINC001204233574 1121831666 /nfs/dbraw/zinc/83/16/66/1121831666.db2.gz RPVVQDIGGITWEL-GJZGRUSLSA-N 1 0 298.430 3.515 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C[C@@H]2CCC[C@@H]2C2CC2)cc1F ZINC001178950018 1121832352 /nfs/dbraw/zinc/83/23/52/1121832352.db2.gz JNMRHIOPTUYFIG-JKSUJKDBSA-N 1 0 290.426 3.808 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CC(C)(C)C)cc1F ZINC000731360312 1121863661 /nfs/dbraw/zinc/86/36/61/1121863661.db2.gz AWZQKDGDABKHBK-UHFFFAOYSA-N 1 0 266.404 3.808 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H]2[C@@H]3CCC[C@@H]32)cc1F ZINC001179266709 1121865555 /nfs/dbraw/zinc/86/55/55/1121865555.db2.gz WEQJRDYUTLYJKM-HALDLXJZSA-N 1 0 276.399 3.560 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)CCc2ccccc2F)cc1C ZINC000731662009 1121879735 /nfs/dbraw/zinc/87/97/35/1121879735.db2.gz HWOIGQHNPJTNQK-UHFFFAOYSA-N 1 0 287.378 3.823 20 10 CHCDRO C[C@@H]([NH2+]CC1=Cc2ccccc2OC1)c1ccccc1O ZINC001179489454 1121883667 /nfs/dbraw/zinc/88/36/67/1121883667.db2.gz OQRIZYUSYVPVDA-CYBMUJFWSA-N 1 0 281.355 3.519 20 10 CHCDRO COc1ccc(C[NH2+]Cc2ccc3c(c2)C[C@H](C)O3)cc1C ZINC001179536823 1121886176 /nfs/dbraw/zinc/88/61/76/1121886176.db2.gz ACKAVUCHQXMEDT-AWEZNQCLSA-N 1 0 297.398 3.617 20 10 CHCDRO COc1cc(C)c(C[N@@H+]2Cc3ccccc3C[C@H]2C)c(O)c1 ZINC001180097113 1121943393 /nfs/dbraw/zinc/94/33/93/1121943393.db2.gz BCOIRQFJNGYORO-CQSZACIVSA-N 1 0 297.398 3.656 20 10 CHCDRO Cc1cc(C[NH2+]CC2(C)COC2)c(C)n1-c1cccc(C)c1 ZINC000732989670 1121950898 /nfs/dbraw/zinc/95/08/98/1121950898.db2.gz OKLVRPHRZZGDPL-UHFFFAOYSA-N 1 0 298.430 3.529 20 10 CHCDRO CC[C@@H]1C[C@@H](C)C[N@@H+]1C/C=C\c1ccc(N(C)C)cc1 ZINC001180203296 1121963562 /nfs/dbraw/zinc/96/35/62/1121963562.db2.gz OFHJXFDUKUCKMF-IKJDWHLJSA-N 1 0 272.436 3.886 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2ccc([C@H]3C[C@H]3C)o2)c1 ZINC000733325031 1121976432 /nfs/dbraw/zinc/97/64/32/1121976432.db2.gz SUDMBULWKYJXMY-DOMZBBRYSA-N 1 0 271.360 3.707 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2ccc([C@@H]3C[C@H]3C)o2)c1 ZINC000733325032 1121976698 /nfs/dbraw/zinc/97/66/98/1121976698.db2.gz SUDMBULWKYJXMY-IUODEOHRSA-N 1 0 271.360 3.707 20 10 CHCDRO C[C@H]1CC[C@H]([NH2+]Cc2ccc(N(C)C)c(F)c2)CC1 ZINC000733328092 1121978534 /nfs/dbraw/zinc/97/85/34/1121978534.db2.gz NDEKPHGJHJCGTG-MQMHXKEQSA-N 1 0 264.388 3.560 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C[C@]23C[C@H]2CCC3)cc1 ZINC000710498385 1121992016 /nfs/dbraw/zinc/99/20/16/1121992016.db2.gz LJDVPWAHAIGTEM-AEFFLSMTSA-N 1 0 272.436 3.813 20 10 CHCDRO CC[C@@H]1[C@H](C)CC[N@@H+]1Cc1ccc(N(C)C)cc1C ZINC001181102711 1122033033 /nfs/dbraw/zinc/03/30/33/1122033033.db2.gz RYWXQRCVCSWNNA-CXAGYDPISA-N 1 0 260.425 3.681 20 10 CHCDRO CC[N@@H+](Cc1c(O)cccc1Br)CC1CCC1 ZINC001181175127 1122040933 /nfs/dbraw/zinc/04/09/33/1122040933.db2.gz LOVIYFNTEWTKHL-UHFFFAOYSA-N 1 0 298.224 3.777 20 10 CHCDRO COc1ccc(O)c(C[NH2+]C[C@@H]2CCC[C@H](C)[C@@H]2C)c1 ZINC001181234591 1122043970 /nfs/dbraw/zinc/04/39/70/1122043970.db2.gz MMYUIUUSCMXIHT-IHRRRGAJSA-N 1 0 277.408 3.563 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CC[C@H](C)C3(CCC3)C2)c1 ZINC000779604441 1129031857 /nfs/dbraw/zinc/03/18/57/1129031857.db2.gz LQDZIBGXSRYYFZ-AWEZNQCLSA-N 1 0 289.419 3.803 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1O ZINC000271700424 1122171664 /nfs/dbraw/zinc/17/16/64/1122171664.db2.gz TZFIFKJABZNANC-VXGBXAGGSA-N 1 0 286.331 3.712 20 10 CHCDRO CC(C)(C)O[C@H]1C[C@@H]([NH2+]Cc2ccc3ccccc3c2O)C1 ZINC001182534642 1122174748 /nfs/dbraw/zinc/17/47/48/1122174748.db2.gz YBQTXTIJUDTEIJ-IYBDPMFKSA-N 1 0 299.414 3.981 20 10 CHCDRO CSc1ccc(C[NH2+]Cc2cc(Cl)ccc2O)o1 ZINC001182685859 1122182569 /nfs/dbraw/zinc/18/25/69/1122182569.db2.gz UTRSLHBYVZYLOJ-UHFFFAOYSA-N 1 0 283.780 3.650 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H]2CCO[C@H](CC(C)C)C2)cc1C ZINC000271994743 1122186072 /nfs/dbraw/zinc/18/60/72/1122186072.db2.gz MPMKADPRSJVDGU-IAGOWNOFSA-N 1 0 291.435 3.692 20 10 CHCDRO COc1cc(C)c(C[NH+]2CCC(C3CCC3)CC2)c(O)c1 ZINC001182806018 1122190381 /nfs/dbraw/zinc/19/03/81/1122190381.db2.gz ONIBFCICLGRVSZ-UHFFFAOYSA-N 1 0 289.419 3.721 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+][C@@H]1CCOC2(CCCCC2)C1 ZINC000272527104 1122205641 /nfs/dbraw/zinc/20/56/41/1122205641.db2.gz YZCRKJBIDPSSRK-OAHLLOKOSA-N 1 0 293.382 3.503 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]CC[C@H]1CC=CCC1 ZINC001183323958 1122216930 /nfs/dbraw/zinc/21/69/30/1122216930.db2.gz HWMRFWJGSIUJOF-INIZCTEOSA-N 1 0 272.436 3.897 20 10 CHCDRO Cc1cnc([C@H](C)C[NH2+]Cc2c(O)cccc2Cl)s1 ZINC000273340430 1122228945 /nfs/dbraw/zinc/22/89/45/1122228945.db2.gz AGRMTRHYFCLFBV-SECBINFHSA-N 1 0 296.823 3.704 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccsc2)c(O)c1C ZINC000273400949 1122231271 /nfs/dbraw/zinc/23/12/71/1122231271.db2.gz NDCAYVHBPFAXOR-LBPRGKRZSA-N 1 0 261.390 3.921 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2)c(O)c1C ZINC000273401876 1122231886 /nfs/dbraw/zinc/23/18/86/1122231886.db2.gz NIQBKOQZZHPBTI-HNNXBMFYSA-N 1 0 298.430 3.926 20 10 CHCDRO C[C@@H]([NH2+]CCCc1nccs1)c1cc(Cl)ccc1O ZINC000273493083 1122236083 /nfs/dbraw/zinc/23/60/83/1122236083.db2.gz OQVRRKHJVKEBJB-SNVBAGLBSA-N 1 0 296.823 3.786 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCO[C@@H](C(C)(C)C)C2)c(O)c1 ZINC000273503351 1122236180 /nfs/dbraw/zinc/23/61/80/1122236180.db2.gz QMXILWBGWYPVMH-JJRVBVJISA-N 1 0 291.435 3.945 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCOC2(CCC2)C1)c1cc(Cl)ccc1O ZINC000273491823 1122236558 /nfs/dbraw/zinc/23/65/58/1122236558.db2.gz OKIKZCKABGZJPX-WCQYABFASA-N 1 0 295.810 3.798 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCOC3(CCC3)C2)c(O)c1C ZINC000273530919 1122237091 /nfs/dbraw/zinc/23/70/91/1122237091.db2.gz WHTCGCOJVGYZHA-LSDHHAIUSA-N 1 0 289.419 3.761 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCc3c2cccc3O)c(O)c1 ZINC000273606057 1122239841 /nfs/dbraw/zinc/23/98/41/1122239841.db2.gz UEQZSGKFPWCZSL-BLLLJJGKSA-N 1 0 283.371 3.744 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCCSC1)c1cc(Cl)ccc1O ZINC000273586200 1122240383 /nfs/dbraw/zinc/24/03/83/1122240383.db2.gz NWPCCDFMIOXBIT-MWLCHTKSSA-N 1 0 271.813 3.592 20 10 CHCDRO CSCC1CC[NH+](Cc2cc(Cl)c(C)cc2O)CC1 ZINC001184097453 1122254692 /nfs/dbraw/zinc/25/46/92/1122254692.db2.gz IONOGFNWVJLGCI-UHFFFAOYSA-N 1 0 299.867 3.929 20 10 CHCDRO CC[C@@H]([NH2+]CCN(C)c1ccccc1)c1ccccc1O ZINC000183327503 1129044815 /nfs/dbraw/zinc/04/48/15/1129044815.db2.gz VPNBGFGZCSDYAP-QGZVFWFLSA-N 1 0 284.403 3.569 20 10 CHCDRO CSCC[C@H](C)[NH2+]Cc1cc(Cl)c(C)cc1O ZINC000825297517 1122426951 /nfs/dbraw/zinc/42/69/51/1122426951.db2.gz HDNDFOGSDMAGLU-JTQLQIEISA-N 1 0 273.829 3.585 20 10 CHCDRO COc1ccc(O)c(C[N@H+](C)C(C)(C)Cc2ccccc2)c1 ZINC001203681397 1122462778 /nfs/dbraw/zinc/46/27/78/1122462778.db2.gz WBXADCYUBBCKTI-UHFFFAOYSA-N 1 0 299.414 3.854 20 10 CHCDRO CCOc1cccc(C[N@H+](CC2CCC2)C(C)C)c1O ZINC000775175873 1122466556 /nfs/dbraw/zinc/46/65/56/1122466556.db2.gz HKPZSXJVRGIRMH-UHFFFAOYSA-N 1 0 277.408 3.801 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CCCOC(C)(C)C)cc1Cl ZINC000827169547 1122481218 /nfs/dbraw/zinc/48/12/18/1122481218.db2.gz DTCAXFHVZFSWDK-UHFFFAOYSA-N 1 0 285.815 3.649 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cccc(F)c1F)c1ccccc1O ZINC000775413770 1122556574 /nfs/dbraw/zinc/55/65/74/1122556574.db2.gz AQKDBMGJBGUWTI-CQSZACIVSA-N 1 0 277.314 3.911 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@H]2CCC[C@@H]2OC)cc1 ZINC000775417558 1122558274 /nfs/dbraw/zinc/55/82/74/1122558274.db2.gz NCSRQESRKCYZMO-LESCRADOSA-N 1 0 290.451 3.608 20 10 CHCDRO CC[C@@H]([NH2+]CCc1cc(C)ccc1OC)c1ccccc1O ZINC000775484710 1122616640 /nfs/dbraw/zinc/61/66/40/1122616640.db2.gz HQXXCLHZMTZMSI-QGZVFWFLSA-N 1 0 299.414 3.993 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCCOC1)c1cc(Cl)ccc1O ZINC000775490645 1122620562 /nfs/dbraw/zinc/62/05/62/1122620562.db2.gz CVUJNVFPFIBKDF-FZMZJTMJSA-N 1 0 283.799 3.513 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)COc1ccccc1)c1ccccc1O ZINC000775495870 1122624310 /nfs/dbraw/zinc/62/43/10/1122624310.db2.gz DYECPANTQMFFKX-RHSMWYFYSA-N 1 0 285.387 3.900 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)COc1ccccc1)c1ccccc1O ZINC000775495871 1122624316 /nfs/dbraw/zinc/62/43/16/1122624316.db2.gz DYECPANTQMFFKX-WMLDXEAASA-N 1 0 285.387 3.900 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)CN(CC)CC)c1cc(Cl)ccc1O ZINC000775498054 1122626773 /nfs/dbraw/zinc/62/67/73/1122626773.db2.gz GNGOBCVSVMHQGO-SWLSCSKDSA-N 1 0 298.858 3.817 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)CCOC)c1cc(Cl)ccc1O ZINC000775501458 1122628551 /nfs/dbraw/zinc/62/85/51/1122628551.db2.gz QVRJOWNKZUAPET-MFKMUULPSA-N 1 0 271.788 3.511 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(C)no1)c1cc(Cl)ccc1O ZINC000775501237 1122628561 /nfs/dbraw/zinc/62/85/61/1122628561.db2.gz CRKPKWUOBUMNRB-ZDUSSCGKSA-N 1 0 280.755 3.583 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cccc(O)c1)c1cc(Cl)ccc1O ZINC000775501804 1122628755 /nfs/dbraw/zinc/62/87/55/1122628755.db2.gz SHCOMBUHSGAFSQ-OAHLLOKOSA-N 1 0 291.778 3.992 20 10 CHCDRO CC[C@H]([NH2+]Cc1cccc(O)c1)c1cc(Cl)ccc1O ZINC000775501802 1122629000 /nfs/dbraw/zinc/62/90/00/1122629000.db2.gz SHCOMBUHSGAFSQ-HNNXBMFYSA-N 1 0 291.778 3.992 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCCc2nc(C)ncc21)c1ccccc1O ZINC000775508737 1122630174 /nfs/dbraw/zinc/63/01/74/1122630174.db2.gz WSAUITUDUMSDJS-RDJZCZTQSA-N 1 0 297.402 3.609 20 10 CHCDRO CC[C@@H]([NH2+]CCN1[C@H](C)CCC[C@@H]1C)c1ccccc1O ZINC000775502969 1122630884 /nfs/dbraw/zinc/63/08/84/1122630884.db2.gz ZHCZGPFXDOFQKM-HLLBOEOZSA-N 1 0 290.451 3.696 20 10 CHCDRO CC[C@H]([NH2+]C[C@@]1(C)CCOC1)c1cc(Cl)ccc1O ZINC000775503161 1122631174 /nfs/dbraw/zinc/63/11/74/1122631174.db2.gz CTMBRQHLBZTILS-DZGCQCFKSA-N 1 0 283.799 3.513 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccc(F)cc1F)c1ccccc1O ZINC000775503558 1122631202 /nfs/dbraw/zinc/63/12/02/1122631202.db2.gz JFZKUOLCLUQOPF-MRXNPFEDSA-N 1 0 291.341 3.954 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CCCSC1)c1cc(Cl)ccc1O ZINC000775510941 1122633301 /nfs/dbraw/zinc/63/33/01/1122633301.db2.gz BGPYOPZJOOKZIB-WCQYABFASA-N 1 0 285.840 3.982 20 10 CHCDRO CC[C@@H]([NH2+][C@H](CC)C1CCOCC1)c1ccccc1O ZINC000775512050 1122633776 /nfs/dbraw/zinc/63/37/76/1122633776.db2.gz JNGIRTSZNAMXRX-HZPDHXFCSA-N 1 0 277.408 3.638 20 10 CHCDRO CC[C@H](C[C@@H](C)CO)[NH2+][C@@H](CC)c1cc(Cl)ccc1O ZINC000775513272 1122633843 /nfs/dbraw/zinc/63/38/43/1122633843.db2.gz PLVVRBQJFXNPCX-KYOSRNDESA-N 1 0 299.842 3.883 20 10 CHCDRO CC[C@H]([NH2+]C1CCC(C)(O)CC1)c1cc(Cl)ccc1O ZINC000775512910 1122634407 /nfs/dbraw/zinc/63/44/07/1122634407.db2.gz SCOZMCYCJLEBIO-UGWHAMFMSA-N 1 0 297.826 3.780 20 10 CHCDRO CC[C@H]([NH2+]C1CC=CC1)c1cc(Cl)ccc1O ZINC000775513763 1122634847 /nfs/dbraw/zinc/63/48/47/1122634847.db2.gz MAQQUUOHIJEEGK-ZDUSSCGKSA-N 1 0 251.757 3.805 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](C)SC)c1cc(Cl)ccc1O ZINC000775524663 1122641609 /nfs/dbraw/zinc/64/16/09/1122641609.db2.gz VRWNVBNHMLDKGY-CABZTGNLSA-N 1 0 273.829 3.838 20 10 CHCDRO CC[C@H]([NH2+]C1CC(C)C1)c1cc(Cl)ccc1O ZINC000775525135 1122641643 /nfs/dbraw/zinc/64/16/43/1122641643.db2.gz DJPAGDFCIJSIIE-OCTTZUBCSA-N 1 0 253.773 3.885 20 10 CHCDRO CC[C@@H]([NH2+][C@H](CO)c1sccc1C)c1ccccc1O ZINC000775524499 1122643026 /nfs/dbraw/zinc/64/30/26/1122643026.db2.gz APNUEOUFYRDOHK-ZIAGYGMSSA-N 1 0 291.416 3.536 20 10 CHCDRO CC[C@H]([NH2+]CC(C)(C)C[C@H](C)O)c1cc(Cl)ccc1O ZINC000775527708 1122644927 /nfs/dbraw/zinc/64/49/27/1122644927.db2.gz SQLCFLJYCFDGOR-FZMZJTMJSA-N 1 0 299.842 3.883 20 10 CHCDRO CCOc1cccc(CC[NH2+][C@H](C)c2ccccc2O)c1 ZINC000183622775 1129070698 /nfs/dbraw/zinc/07/06/98/1129070698.db2.gz RBOBCUBZSVWVPY-CQSZACIVSA-N 1 0 285.387 3.684 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCc2cc(F)ccc2C1)c1ccccc1O ZINC001168407191 1122733901 /nfs/dbraw/zinc/73/39/01/1122733901.db2.gz NAFJPCSGNKHPBN-LRDDRELGSA-N 1 0 285.362 3.739 20 10 CHCDRO COc1ccc(N(CCC(C)C)CCC2(O)CCC2)cc1 ZINC001194073287 1122745013 /nfs/dbraw/zinc/74/50/13/1122745013.db2.gz AMNLOQZICMMBHQ-UHFFFAOYSA-N 1 0 291.435 3.853 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)Cc2ccsc2)cc1C ZINC000048557107 1122746218 /nfs/dbraw/zinc/74/62/18/1122746218.db2.gz GOHCXKKGGVBKSL-CYBMUJFWSA-N 1 0 275.417 3.786 20 10 CHCDRO C[C@@H](Nc1ccc(N2CCCCC2)cn1)c1ccccc1O ZINC000183650911 1129076419 /nfs/dbraw/zinc/07/64/19/1129076419.db2.gz APCKVPXFEZVTMK-CQSZACIVSA-N 1 0 297.402 3.951 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2nc(C)cs2)c1 ZINC000080273389 1129079798 /nfs/dbraw/zinc/07/97/98/1129079798.db2.gz IIBXYNQPVZSJSB-WDEREUQCSA-N 1 0 292.404 3.578 20 10 CHCDRO Cc1cc(Cl)cc(C[NH+]2CCC(C)CC2)c1O ZINC000775638553 1122846147 /nfs/dbraw/zinc/84/61/47/1122846147.db2.gz KVKILIPTABWWOV-UHFFFAOYSA-N 1 0 253.773 3.586 20 10 CHCDRO Cc1cccc(C[N@H+](C)Cc2ccccc2Cl)c1O ZINC000775642939 1122851197 /nfs/dbraw/zinc/85/11/97/1122851197.db2.gz PWVGVNORKJVINL-UHFFFAOYSA-N 1 0 275.779 3.986 20 10 CHCDRO Cc1cccc(C[N@@H+]2[C@H](C)C[C@@H]3CCCC[C@H]32)c1O ZINC000775701323 1122911906 /nfs/dbraw/zinc/91/19/06/1122911906.db2.gz KICDQJHAJIBREY-IJEWVQPXSA-N 1 0 259.393 3.854 20 10 CHCDRO CC[C@H]1c2ccccc2CC[N@H+]1Cc1cc(OC)ccc1O ZINC000775698651 1122912342 /nfs/dbraw/zinc/91/23/42/1122912342.db2.gz QANLWFXKDNHVPO-SFHVURJKSA-N 1 0 297.398 3.910 20 10 CHCDRO c1ccc(OCCC[NH2+]Cc2ccc3c(c2)CCCO3)cc1 ZINC001199052129 1123019922 /nfs/dbraw/zinc/01/99/22/1123019922.db2.gz CQIFXPLBHHWGKR-UHFFFAOYSA-N 1 0 297.398 3.570 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+]2C[C@@H]3[C@H](C2)C3(C)C)cc1 ZINC001203941910 1123042509 /nfs/dbraw/zinc/04/25/09/1123042509.db2.gz GPGCIEYXKCNZCD-CALCHBBNSA-N 1 0 272.436 3.621 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2C[C@H]3CC[C@@H]2C3)cc1 ZINC001203943388 1123045052 /nfs/dbraw/zinc/04/50/52/1123045052.db2.gz YVOGZSAQZVZAEP-DOTOQJQBSA-N 1 0 258.409 3.517 20 10 CHCDRO Cc1cccc(C)c1C[N@@H+]1CCc2cccc(O)c2C1 ZINC001137852606 1123054459 /nfs/dbraw/zinc/05/44/59/1123054459.db2.gz JILBRBWPKCSYKM-UHFFFAOYSA-N 1 0 267.372 3.567 20 10 CHCDRO CCOc1ccc(C[NH2+][C@H]2CCc3ccc(C)cc32)c(O)c1 ZINC000776174617 1123101664 /nfs/dbraw/zinc/10/16/64/1123101664.db2.gz QCFVNAOQSRHIAN-SFHVURJKSA-N 1 0 297.398 3.876 20 10 CHCDRO CC(C)Nc1ccc(N(C)c2ccc(N)cc2)cc1 ZINC001201498916 1123111175 /nfs/dbraw/zinc/11/11/75/1123111175.db2.gz GMTYEXPNQJCSMH-UHFFFAOYSA-N 1 0 255.365 3.857 20 10 CHCDRO COc1cccc(C[NH2+][C@@H](C)c2ccc(C)s2)c1O ZINC000049158125 1123132217 /nfs/dbraw/zinc/13/22/17/1123132217.db2.gz HYRWLYDANCJJPF-NSHDSACASA-N 1 0 277.389 3.622 20 10 CHCDRO Cc1ccncc1[C@H](C)[NH2+]Cc1cc(Cl)cc(C)c1O ZINC000776255437 1123188371 /nfs/dbraw/zinc/18/83/71/1123188371.db2.gz XIFDUMHSZKWJOQ-LBPRGKRZSA-N 1 0 290.794 3.908 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C(C2CCC2)C2CCC2)cc1F ZINC001202315340 1123198173 /nfs/dbraw/zinc/19/81/73/1123198173.db2.gz SARHMEXFLOHKDC-UHFFFAOYSA-N 1 0 290.426 3.950 20 10 CHCDRO Cc1cc(C[N@H+]2CCOC[C@H](C)C2)c(C)n1-c1ccccc1 ZINC001137854125 1123214569 /nfs/dbraw/zinc/21/45/69/1123214569.db2.gz JIXYIIOLAGMRSA-OAHLLOKOSA-N 1 0 298.430 3.562 20 10 CHCDRO Cc1cc(C[N@H+]2CCOC[C@@H](C)C2)c(C)n1-c1ccccc1 ZINC001137854124 1123214740 /nfs/dbraw/zinc/21/47/40/1123214740.db2.gz JIXYIIOLAGMRSA-HNNXBMFYSA-N 1 0 298.430 3.562 20 10 CHCDRO COc1ccc(C[NH2+]CC(C)(C)C(C)(F)F)cc1C ZINC000696613661 1123235503 /nfs/dbraw/zinc/23/55/03/1123235503.db2.gz GMTHEBUBTMGVIY-UHFFFAOYSA-N 1 0 271.351 3.775 20 10 CHCDRO COc1cccc(C[NH2+][C@H]2CCC(C)(C)C[C@@H]2C)c1O ZINC000237237530 1123237771 /nfs/dbraw/zinc/23/77/71/1123237771.db2.gz KGUVDIXXZDKDQG-JSGCOSHPSA-N 1 0 277.408 3.705 20 10 CHCDRO COc1cc(C[NH2+]C[C@H](C)SC)c(O)c(C(C)(C)C)c1 ZINC000850221589 1123248096 /nfs/dbraw/zinc/24/80/96/1123248096.db2.gz MEEJEZQPOTWKBX-NSHDSACASA-N 1 0 297.464 3.539 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@@H](C)c2ccccn2)c(Cl)c1 ZINC000850341651 1123254855 /nfs/dbraw/zinc/25/48/55/1123254855.db2.gz AZNZJDVCOHEUJJ-GFCCVEGCSA-N 1 0 290.794 3.642 20 10 CHCDRO CCOc1cccc(CNc2[nH+]c(C)ccc2CC)c1O ZINC000850356789 1123255482 /nfs/dbraw/zinc/25/54/82/1123255482.db2.gz SCJWGIZDIKRJBV-UHFFFAOYSA-N 1 0 286.375 3.669 20 10 CHCDRO COCc1csc(C[NH2+]Cc2cc(Cl)ccc2O)c1 ZINC000850377343 1123260184 /nfs/dbraw/zinc/26/01/84/1123260184.db2.gz FKWMIVGFUOTPDT-UHFFFAOYSA-N 1 0 297.807 3.543 20 10 CHCDRO FC1(F)CC12CCC([NH2+]Cc1ccc3c(c1)CCO3)CC2 ZINC000850391360 1123262018 /nfs/dbraw/zinc/26/20/18/1123262018.db2.gz NNECBHAXPGMTLE-UHFFFAOYSA-N 1 0 293.357 3.679 20 10 CHCDRO Cc1cccc2c1CCC[C@H]2[NH2+]Cc1ccccc1O ZINC000850411685 1123264152 /nfs/dbraw/zinc/26/41/52/1123264152.db2.gz IGMWPDFRSHBHOV-QGZVFWFLSA-N 1 0 267.372 3.868 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](C)c1ccccn1)c1ccc(C)cc1O ZINC000850481642 1123273227 /nfs/dbraw/zinc/27/32/27/1123273227.db2.gz IHMFWOAETPCYHH-HOCLYGCPSA-N 1 0 284.403 3.940 20 10 CHCDRO CC[C@H]([NH2+]CCC1CC(OC)C1)c1cc(Cl)ccc1O ZINC000850482388 1123273460 /nfs/dbraw/zinc/27/34/60/1123273460.db2.gz OXPIHVAWFZKFEX-HGMXIMQMSA-N 1 0 297.826 3.901 20 10 CHCDRO CC[C@H]([NH2+]CCC1CC(OC)C1)c1ccc(C)cc1O ZINC000850481708 1123273604 /nfs/dbraw/zinc/27/36/04/1123273604.db2.gz JCRSVIXJCGAIRZ-XUJLQICISA-N 1 0 277.408 3.556 20 10 CHCDRO CSCC1(CC[NH2+][C@H](C)c2cc(F)ccc2O)CC1 ZINC000850505902 1123275860 /nfs/dbraw/zinc/27/58/60/1123275860.db2.gz CQDWDULTTQGCGC-LLVKDONJSA-N 1 0 283.412 3.715 20 10 CHCDRO C[C@H]([NH2+][C@H]1C=CCC1)c1cc2c(cc1O)CCCC2 ZINC000850507986 1123277049 /nfs/dbraw/zinc/27/70/49/1123277049.db2.gz HEPJOZDISPVNGB-WFASDCNBSA-N 1 0 257.377 3.640 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCc2cnccc2C)c(O)c1C ZINC000850507084 1123277114 /nfs/dbraw/zinc/27/71/14/1123277114.db2.gz MFWHARSWNVKAED-HNNXBMFYSA-N 1 0 284.403 3.606 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1C=CCC1)c1cc(Cl)ccc1O ZINC000850510352 1123278133 /nfs/dbraw/zinc/27/81/33/1123278133.db2.gz SUDWVOKEVOCSAA-DGCLKSJQSA-N 1 0 251.757 3.805 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCCOC(C)(C)C)c(O)c1C ZINC000850527409 1123282247 /nfs/dbraw/zinc/28/22/47/1123282247.db2.gz WXKGDHHIEWGPNP-AWEZNQCLSA-N 1 0 279.424 3.865 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1C[C@H](c2ccccc2)CO1)c1ccccc1O ZINC000850531490 1123285203 /nfs/dbraw/zinc/28/52/03/1123285203.db2.gz JXTHCYKIJILNCU-PVAVHDDUSA-N 1 0 297.398 3.616 20 10 CHCDRO C[C@@H]([NH2+]CCC(C)(C)F)c1cc(Cl)ccc1O ZINC000850532600 1123286342 /nfs/dbraw/zinc/28/63/42/1123286342.db2.gz UVOMWFYLFFOSJM-SECBINFHSA-N 1 0 259.752 3.834 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(COC)cs1)c1ccccc1O ZINC000850533483 1123286301 /nfs/dbraw/zinc/28/63/01/1123286301.db2.gz ZQAFMOIZXJAQBN-HNNXBMFYSA-N 1 0 291.416 3.841 20 10 CHCDRO C[C@H]([NH2+]CCCc1ccco1)c1ccc(N(C)C)cc1 ZINC000850569411 1123294251 /nfs/dbraw/zinc/29/42/51/1123294251.db2.gz CVDBPRASKPCPEY-AWEZNQCLSA-N 1 0 272.392 3.629 20 10 CHCDRO C[C@H]([NH2+]CCCc1ccco1)c1cc(Cl)ccc1O ZINC000850569403 1123294454 /nfs/dbraw/zinc/29/44/54/1123294454.db2.gz CSQSKLQOMSZKII-NSHDSACASA-N 1 0 279.767 3.922 20 10 CHCDRO C[C@@H]1[C@H](C)SCC[N@@H+]1C/C=C/c1ccc(N(C)C)cc1 ZINC001204768499 1123419936 /nfs/dbraw/zinc/41/99/36/1123419936.db2.gz JTMQJDLPADYMKL-MUHKLVGJSA-N 1 0 290.476 3.592 20 10 CHCDRO Oc1ccc2ccncc2c1C[N@@H+]1CCC[C@@H](CCF)C1 ZINC000853564207 1123443849 /nfs/dbraw/zinc/44/38/49/1123443849.db2.gz KNTAGFFXMLIZMP-ZDUSSCGKSA-N 1 0 288.366 3.512 20 10 CHCDRO C[C@H]([NH2+]CCc1cscn1)c1ccc2ccccc2c1O ZINC000111627223 1123457173 /nfs/dbraw/zinc/45/71/73/1123457173.db2.gz NXLNIAOONSGBKY-LBPRGKRZSA-N 1 0 298.411 3.895 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCc3cc(N)ccc32)c1 ZINC000854225719 1123477770 /nfs/dbraw/zinc/47/77/70/1123477770.db2.gz JTVKXMWAAJGYNC-PXAZEXFGSA-N 1 0 282.387 3.621 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cccc(N)c1)c1ccc(N(C)C)cc1 ZINC000854217005 1123478099 /nfs/dbraw/zinc/47/80/99/1123478099.db2.gz GXFVITXWQLMCNO-GOSISDBHSA-N 1 0 283.419 3.576 20 10 CHCDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]CC1CSC1 ZINC000895422622 1123478838 /nfs/dbraw/zinc/47/88/38/1123478838.db2.gz KEJUUYVGRQHBPV-UHFFFAOYSA-N 1 0 285.412 3.512 20 10 CHCDRO COc1cccc(C[NH2+][C@@H]2CCCC[C@@H]2C(C)C)c1O ZINC000112675769 1123495779 /nfs/dbraw/zinc/49/57/79/1123495779.db2.gz RFCHLLPMTCHUHM-HUUCEWRRSA-N 1 0 277.408 3.705 20 10 CHCDRO CCc1cccc(C[NH2+]C(C)(C)[C@H](O)c2ccccc2)c1O ZINC000895661345 1123502162 /nfs/dbraw/zinc/50/21/62/1123502162.db2.gz HDPNTORSRIVZGJ-GOSISDBHSA-N 1 0 299.414 3.556 20 10 CHCDRO Cc1cccc(C[NH2+]C[C@]2(C)CCOC3(CCC3)C2)c1O ZINC000895819578 1123517647 /nfs/dbraw/zinc/51/76/47/1123517647.db2.gz BIMKNPURGKBCBW-QGZVFWFLSA-N 1 0 289.419 3.530 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H](C)Cc2ccccc2F)c1 ZINC000113326435 1123521894 /nfs/dbraw/zinc/52/18/94/1123521894.db2.gz IBERDGQGCZIHFJ-ZDUSSCGKSA-N 1 0 273.351 3.561 20 10 CHCDRO CCCc1ccc(C[NH2+]Cc2cccc(OC)c2O)s1 ZINC000857046707 1123581774 /nfs/dbraw/zinc/58/17/74/1123581774.db2.gz PGFKJCXNPIZZLI-UHFFFAOYSA-N 1 0 291.416 3.705 20 10 CHCDRO CC[C@@H]([NH2+]CC[C@H]1CC1(F)F)c1ccc(C)cc1O ZINC000857080645 1123584872 /nfs/dbraw/zinc/58/48/72/1123584872.db2.gz JZBDXYIHDCYYFO-WCQYABFASA-N 1 0 269.335 3.787 20 10 CHCDRO CC[C@H]([NH2+]CC(C)(C)CCOC)c1ccc(N(C)C)cc1 ZINC000183934729 1129131276 /nfs/dbraw/zinc/13/12/76/1129131276.db2.gz SKUUJGRAXNGJES-KRWDZBQOSA-N 1 0 292.467 3.856 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+]CC[C@@H]2CC2(F)F)c2c1c(F)ccc2O ZINC000857082194 1123586153 /nfs/dbraw/zinc/58/61/53/1123586153.db2.gz UQVBZMUNPQCGOE-KKZNHRDASA-N 1 0 285.309 3.715 20 10 CHCDRO CC[C@@H]([NH2+]CC(C)(C)CCOC)c1ccc(N(C)C)cc1 ZINC000183934747 1129131481 /nfs/dbraw/zinc/13/14/81/1129131481.db2.gz SKUUJGRAXNGJES-QGZVFWFLSA-N 1 0 292.467 3.856 20 10 CHCDRO CCSC1(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)CC1 ZINC000691823709 1123596469 /nfs/dbraw/zinc/59/64/69/1123596469.db2.gz VTEXTQGTVKVJNN-ZDUSSCGKSA-N 1 0 278.465 3.689 20 10 CHCDRO Cc1cccc(C[NH2+]Cc2ccc(N(C)C)cc2C)c1 ZINC000115629309 1123619941 /nfs/dbraw/zinc/61/99/41/1123619941.db2.gz OYUJEKOTOOAPPZ-UHFFFAOYSA-N 1 0 268.404 3.659 20 10 CHCDRO Cc1ccc(C(C)(C)C[NH2+]Cc2ccc(N(C)C)cc2)nc1 ZINC000858241496 1123639127 /nfs/dbraw/zinc/63/91/27/1123639127.db2.gz VWGRZTGIHORWFT-UHFFFAOYSA-N 1 0 297.446 3.523 20 10 CHCDRO C[C@@H](C[NH2+]Cc1cc(Cl)ccc1O)c1ccccc1 ZINC000020551998 1123648198 /nfs/dbraw/zinc/64/81/98/1123648198.db2.gz VWRLTNOVDQSWPU-LBPRGKRZSA-N 1 0 275.779 3.939 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccns1)c1ccc(Cl)cc1O ZINC000858576111 1123664101 /nfs/dbraw/zinc/66/41/01/1123664101.db2.gz IIYJXCMNJOWRFU-BDAKNGLRSA-N 1 0 282.796 3.914 20 10 CHCDRO C[C@@H]([NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F)c1ccns1 ZINC000858576476 1123664720 /nfs/dbraw/zinc/66/47/20/1123664720.db2.gz KXHPPLUUAYRLAX-KKZNHRDASA-N 1 0 292.379 3.887 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]C[C@@H]2CCCC23CC3)c1O ZINC000858594007 1123666757 /nfs/dbraw/zinc/66/67/57/1123666757.db2.gz LLPUBERSNWWVCC-STQMWFEESA-N 1 0 275.392 3.632 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]C[C@H]1CCC2(CCCC2)O1 ZINC000691832343 1123742168 /nfs/dbraw/zinc/74/21/68/1123742168.db2.gz WVEWAWRIYMPMPY-GFCCVEGCSA-N 1 0 295.810 3.627 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C2Cc3ccccc3C2)c1 ZINC000184005876 1129145082 /nfs/dbraw/zinc/14/50/82/1129145082.db2.gz DFAYEHSCHMWBPW-ZDUSSCGKSA-N 1 0 267.372 3.519 20 10 CHCDRO C[C@@H](CCCc1cccnc1)[NH2+][C@@H](C)c1ccccc1O ZINC000840772481 1123789499 /nfs/dbraw/zinc/78/94/99/1123789499.db2.gz UPZJMJBJUGXCCH-GJZGRUSLSA-N 1 0 284.403 3.849 20 10 CHCDRO CCc1cccc(C[NH2+][C@H](c2ccccn2)C2CCC2)c1O ZINC000862478103 1123813486 /nfs/dbraw/zinc/81/34/86/1123813486.db2.gz SIMFBKZEWPEMKO-SFHVURJKSA-N 1 0 296.414 3.981 20 10 CHCDRO Cc1cc(O)c(C[NH+]2CC(Cc3ccco3)C2)cc1Cl ZINC000862487383 1123813888 /nfs/dbraw/zinc/81/38/88/1123813888.db2.gz QCQXXTZPQKAIBD-UHFFFAOYSA-N 1 0 291.778 3.622 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1O)c1ccc2c(c1)OCCO2 ZINC000192785072 1123816528 /nfs/dbraw/zinc/81/65/28/1123816528.db2.gz FXYLHWFVTGJULA-OLZOCXBDSA-N 1 0 299.370 3.575 20 10 CHCDRO C[C@@H]1C[N@@H+](Cc2cc3c(cc2O)CCC3)C[C@H](C)C1(F)F ZINC000863274974 1123857593 /nfs/dbraw/zinc/85/75/93/1123857593.db2.gz OVERCQVXNHPGDK-TXEJJXNPSA-N 1 0 295.373 3.604 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]CCC1=CCCC1 ZINC000120148176 1123937517 /nfs/dbraw/zinc/93/75/17/1123937517.db2.gz QGFUNBWXZICMCU-UHFFFAOYSA-N 1 0 251.757 3.636 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccc(OC)cc1)c1ccc(C)cc1O ZINC000794791574 1123948804 /nfs/dbraw/zinc/94/88/04/1123948804.db2.gz BAYRQDSUWJACMV-SFHVURJKSA-N 1 0 299.414 3.993 20 10 CHCDRO CC[C@H]([NH2+]CCN(C)c1ccccc1)c1ccc(C)cc1O ZINC000794790938 1123949021 /nfs/dbraw/zinc/94/90/21/1123949021.db2.gz GKORLCDGVHPGCS-SFHVURJKSA-N 1 0 298.430 3.878 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)CN1CCCCC1)c1ccc(C)cc1O ZINC000794799141 1123950465 /nfs/dbraw/zinc/95/04/65/1123950465.db2.gz ZAWOPKRJJPIWLC-DOTOQJQBSA-N 1 0 290.451 3.616 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1Cc2ccccc2O1)c1ccc(C)cc1O ZINC000794793517 1123950561 /nfs/dbraw/zinc/95/05/61/1123950561.db2.gz OWPGJYWEWYFRHD-DOTOQJQBSA-N 1 0 297.398 3.745 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](CCO)CC(C)C)c1ccc(C)cc1O ZINC000794802150 1123950647 /nfs/dbraw/zinc/95/06/47/1123950647.db2.gz MVAZOZXNXNENQM-RDJZCZTQSA-N 1 0 293.451 3.786 20 10 CHCDRO CC[C@H](C[C@@H](C)CO)[NH2+][C@H](CC)c1ccc(C)cc1O ZINC000794803673 1123954248 /nfs/dbraw/zinc/95/42/48/1123954248.db2.gz ROHLLAQICFWWSD-IIAWOOMASA-N 1 0 279.424 3.538 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1CCCS1)c1ccc(C)cc1O ZINC000794812541 1123959009 /nfs/dbraw/zinc/95/90/09/1123959009.db2.gz XCPIDPKFDAHLGN-TZMCWYRMSA-N 1 0 265.422 3.637 20 10 CHCDRO CC[C@H]([NH2+]C1CCC(COC)CC1)c1ccccc1O ZINC000840882492 1123971487 /nfs/dbraw/zinc/97/14/87/1123971487.db2.gz WATUTFCQDNAQMC-XUJLQICISA-N 1 0 277.408 3.638 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1ccc(N(C)CC)cc1)[C@H](O)C(C)C ZINC000840882087 1123982176 /nfs/dbraw/zinc/98/21/76/1123982176.db2.gz MCBXPBIREKEPLA-FHLIZLRMSA-N 1 0 292.467 3.589 20 10 CHCDRO Cc1cccc(C[N@H+]2C[C@H](C)[C@@H]3CCCC[C@@H]32)c1O ZINC000783593268 1123998394 /nfs/dbraw/zinc/99/83/94/1123998394.db2.gz OVPWXOLRKLXXNO-BPUTZDHNSA-N 1 0 259.393 3.711 20 10 CHCDRO Cc1cc(C)c(C[N@H+](C)Cc2ccccc2O)c(C)c1 ZINC000303460209 1124005895 /nfs/dbraw/zinc/00/58/95/1124005895.db2.gz LHHCBOWGIAFVDM-UHFFFAOYSA-N 1 0 269.388 3.949 20 10 CHCDRO Cc1ncc([C@H](C)[NH2+]Cc2cc(C)c(C)cc2O)s1 ZINC000865701150 1124007156 /nfs/dbraw/zinc/00/71/56/1124007156.db2.gz HMVHJPNRJHJPAE-NSHDSACASA-N 1 0 276.405 3.625 20 10 CHCDRO Cc1cnc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)s1 ZINC000840935238 1124030984 /nfs/dbraw/zinc/03/09/84/1124030984.db2.gz JCUUWZXEZNXDBT-ZDUSSCGKSA-N 1 0 289.448 3.677 20 10 CHCDRO CC(C)(C[NH2+]Cc1ccc2ccccc2c1O)OCC1CC1 ZINC000840960900 1124042511 /nfs/dbraw/zinc/04/25/11/1124042511.db2.gz XMAPKGUZUHKEHG-UHFFFAOYSA-N 1 0 299.414 3.840 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCCC[C@@H]2F)c1 ZINC000866450790 1124067359 /nfs/dbraw/zinc/06/73/59/1124067359.db2.gz ZQXXANGIOHETMJ-FPMFFAJLSA-N 1 0 251.345 3.632 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cccc2c1CCOC2)c1ccccc1O ZINC000866478985 1124071127 /nfs/dbraw/zinc/07/11/27/1124071127.db2.gz NRMUEPMIPMEFGF-GOSISDBHSA-N 1 0 297.398 3.706 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H](C)CC2CCC2)c1O ZINC000866487167 1124071499 /nfs/dbraw/zinc/07/14/99/1124071499.db2.gz VJAWIXJCANBHAR-RYUDHWBXSA-N 1 0 263.381 3.630 20 10 CHCDRO CS[C@H]1C[C@H]([NH2+][C@@H](C)c2ccc(C)c(C)c2O)C1 ZINC000866488844 1124072756 /nfs/dbraw/zinc/07/27/56/1124072756.db2.gz VQZYTWLBOGKVRQ-AVGNSLFASA-N 1 0 265.422 3.554 20 10 CHCDRO CC[C@H]([NH2+]C1Cc2ccccc2C1)c1ccccc1O ZINC000121092279 1124075386 /nfs/dbraw/zinc/07/53/86/1124075386.db2.gz DHFSTJPLDNYVRJ-KRWDZBQOSA-N 1 0 267.372 3.600 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2CCC23CCOCC3)c1 ZINC000866528913 1124078226 /nfs/dbraw/zinc/07/82/26/1124078226.db2.gz KEYWWMWURGQINE-CABCVRRESA-N 1 0 289.419 3.558 20 10 CHCDRO C[C@H]([NH2+]C1([C@H]2CCCCO2)CCC1)c1ccccc1O ZINC000866623095 1124091036 /nfs/dbraw/zinc/09/10/36/1124091036.db2.gz RYIGPSCHCZOKDR-XJKSGUPXSA-N 1 0 275.392 3.535 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C2([C@H]3CCCCO3)CCC2)c(O)c1 ZINC000866622962 1124091145 /nfs/dbraw/zinc/09/11/45/1124091145.db2.gz KTNYAKULLASEAQ-RHSMWYFYSA-N 1 0 289.419 3.843 20 10 CHCDRO CC[C@H](C[C@@H](C)O)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000866635051 1124092777 /nfs/dbraw/zinc/09/27/77/1124092777.db2.gz MHYZCLYWMPPIED-UMVBOHGHSA-N 1 0 287.403 3.746 20 10 CHCDRO C[C@H]([NH2+]Cc1ccccc1O)c1cccc(F)c1F ZINC000121930028 1124451725 /nfs/dbraw/zinc/45/17/25/1124451725.db2.gz JQIPBZBZWYQULN-JTQLQIEISA-N 1 0 263.287 3.521 20 10 CHCDRO CC[C@@H]([NH2+]Cc1c(F)cccc1OC)c1ccccc1O ZINC001120345259 1131273490 /nfs/dbraw/zinc/27/34/90/1131273490.db2.gz SYKKOWOFPKOQSJ-OAHLLOKOSA-N 1 0 289.350 3.781 20 10 CHCDRO COCC(C)(C)CC[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000872104743 1124682562 /nfs/dbraw/zinc/68/25/62/1124682562.db2.gz OIHQXTYCWIXSBO-YPMHNXCESA-N 1 0 295.398 3.732 20 10 CHCDRO Cc1ccc(C[N@@H+]2CCC[C@@H](OC3CCC3)CC2)c(O)c1 ZINC000872259659 1124699418 /nfs/dbraw/zinc/69/94/18/1124699418.db2.gz FPMGZLWAQDJYPL-QGZVFWFLSA-N 1 0 289.419 3.624 20 10 CHCDRO CCC[N@H+](Cc1ccc2c[nH]nc2c1)Cc1ccccc1O ZINC000124037418 1124703245 /nfs/dbraw/zinc/70/32/45/1124703245.db2.gz ZNKHTYQWTXQMOQ-UHFFFAOYSA-N 1 0 295.386 3.681 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2cc(N)cc(F)c2)c(O)c1C ZINC000873289435 1124762570 /nfs/dbraw/zinc/76/25/70/1124762570.db2.gz UXICFSFVBUVTHH-GFCCVEGCSA-N 1 0 288.366 3.581 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2ccc(F)cc2)c1 ZINC000020095653 1124804884 /nfs/dbraw/zinc/80/48/84/1124804884.db2.gz KNLOQMIBPZDQRL-NWDGAFQWSA-N 1 0 289.350 3.952 20 10 CHCDRO CC(C)[N@H+](CCC[C@H]1CCO1)Cc1ccc(N(C)C)cc1 ZINC000876584719 1124964021 /nfs/dbraw/zinc/96/40/21/1124964021.db2.gz NFGAIXHXGAXRNI-SFHVURJKSA-N 1 0 290.451 3.532 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(C)cc1O)c1ccc(OC)cc1 ZINC000876883702 1124986506 /nfs/dbraw/zinc/98/65/06/1124986506.db2.gz FVZWOGMJCOCMHJ-QGZVFWFLSA-N 1 0 285.387 3.950 20 10 CHCDRO COc1ccc(F)cc1[C@@H](C)[NH2+]Cc1ccc(C)cc1O ZINC000876942372 1124991389 /nfs/dbraw/zinc/99/13/89/1124991389.db2.gz XPXFZBJLZGJWHB-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO Cc1csc(CCCC[NH2+]Cc2c(C)cccc2O)n1 ZINC000877003520 1124996649 /nfs/dbraw/zinc/99/66/49/1124996649.db2.gz WFBHWIBSKXGZDG-UHFFFAOYSA-N 1 0 290.432 3.578 20 10 CHCDRO CSC(C)(C)CC[NH2+]CCCSc1nccs1 ZINC000877061379 1125003471 /nfs/dbraw/zinc/00/34/71/1125003471.db2.gz GHAWRYBNYLRZTR-UHFFFAOYSA-N 1 0 290.523 3.747 20 10 CHCDRO Cc1cccc(O)c1C[NH2+][C@H]1CCCc2sccc21 ZINC000877386294 1125026303 /nfs/dbraw/zinc/02/63/03/1125026303.db2.gz HZCMWJQMYVBLKG-AWEZNQCLSA-N 1 0 273.401 3.929 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]CCC(C)(C)SC)c1 ZINC000877532769 1125040633 /nfs/dbraw/zinc/04/06/33/1125040633.db2.gz HEWYUWYWXKYNCK-LLVKDONJSA-N 1 0 283.437 3.583 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2cnccc2C(C)(C)C)c(O)c1 ZINC000877588617 1125049414 /nfs/dbraw/zinc/04/94/14/1125049414.db2.gz URIGNQXAFKSUGL-UHFFFAOYSA-N 1 0 284.403 3.683 20 10 CHCDRO CC[C@@H](C[NH2+]Cc1ccc(C)cc1O)CC(F)(F)F ZINC000877589455 1125050430 /nfs/dbraw/zinc/05/04/30/1125050430.db2.gz NOULABBIQBCXBU-LLVKDONJSA-N 1 0 275.314 3.769 20 10 CHCDRO CN1CCCc2cc(C[NH2+][C@@H]3CCc4ccccc43)ccc21 ZINC000126650323 1125064921 /nfs/dbraw/zinc/06/49/21/1125064921.db2.gz KFYMCJKDNJQYSX-LJQANCHMSA-N 1 0 292.426 3.846 20 10 CHCDRO C[C@H](C[N@@H+]1Cc2cccc(O)c2C1)c1ccc(F)cc1 ZINC000877703087 1125065737 /nfs/dbraw/zinc/06/57/37/1125065737.db2.gz QXOZJTFVKPLWPS-GFCCVEGCSA-N 1 0 271.335 3.651 20 10 CHCDRO C[C@@H](C[N@@H+]1Cc2cccc(O)c2C1)c1ccc(F)cc1 ZINC000877703088 1125065809 /nfs/dbraw/zinc/06/58/09/1125065809.db2.gz QXOZJTFVKPLWPS-LBPRGKRZSA-N 1 0 271.335 3.651 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)C1CCSCC1)c1ccccc1O ZINC000877755669 1125071520 /nfs/dbraw/zinc/07/15/20/1125071520.db2.gz KWPAHUYBZNFWQH-VXGBXAGGSA-N 1 0 265.422 3.575 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H](C)c2ccccc2O)c1C ZINC000877756357 1125071683 /nfs/dbraw/zinc/07/16/83/1125071683.db2.gz IILBCEIPBFBBOT-AWEZNQCLSA-N 1 0 255.361 3.860 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)c2ccccc2O)c(F)c1 ZINC000877757298 1125074619 /nfs/dbraw/zinc/07/46/19/1125074619.db2.gz IHQSBOAQIVLYKK-GFCCVEGCSA-N 1 0 259.324 3.691 20 10 CHCDRO COc1cc(C[NH2+][C@@H](C)c2ccccc2O)ccc1Cl ZINC000877758338 1125074865 /nfs/dbraw/zinc/07/48/65/1125074865.db2.gz TYWQLALIFNDTBF-NSHDSACASA-N 1 0 291.778 3.905 20 10 CHCDRO C[C@H]([NH2+]Cc1cnc(C2CC2)s1)c1ccccc1O ZINC000877757379 1125075307 /nfs/dbraw/zinc/07/53/07/1125075307.db2.gz VCHZDZNJXKVMJW-JTQLQIEISA-N 1 0 274.389 3.577 20 10 CHCDRO Cc1cc(C[NH2+][C@@H](C)c2ccccc2O)cc(C)c1O ZINC000877757969 1125075402 /nfs/dbraw/zinc/07/54/02/1125075402.db2.gz BAUPGOZJLOCRON-ZDUSSCGKSA-N 1 0 271.360 3.565 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H]2CC=CC[C@H]2C(F)(F)F)c1O ZINC000877760904 1125077036 /nfs/dbraw/zinc/07/70/36/1125077036.db2.gz NRBDJUIZRWIOMP-CHWSQXEVSA-N 1 0 285.309 3.687 20 10 CHCDRO COCC1(CC[NH2+]Cc2cc(Cl)c(C)cc2O)CCC1 ZINC000826011839 1125117163 /nfs/dbraw/zinc/11/71/63/1125117163.db2.gz JJQIVEGYWLFFBI-UHFFFAOYSA-N 1 0 297.826 3.650 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC[C@H](c3cccnc3)C2)cc1 ZINC000878753349 1125176335 /nfs/dbraw/zinc/17/63/35/1125176335.db2.gz JBYZWXGYUKGUPF-SFHVURJKSA-N 1 0 295.430 3.527 20 10 CHCDRO CC[N@@H+]1CC[C@@H](C[NH2+][C@@H](C)c2ccc3ccccc3c2O)C1 ZINC000193494879 1125199392 /nfs/dbraw/zinc/19/93/92/1125199392.db2.gz AKWOZKOBNZUWOX-GJZGRUSLSA-N 1 0 298.430 3.538 20 10 CHCDRO CSc1ccccc1C[NH2+][C@H](C)c1ccccc1O ZINC000879649149 1125222668 /nfs/dbraw/zinc/22/26/68/1125222668.db2.gz JLKKKSQTMCHHOP-GFCCVEGCSA-N 1 0 273.401 3.965 20 10 CHCDRO COc1cncc(/C=C/CC[NH2+][C@@H](C)c2ccccc2O)c1 ZINC000879649756 1125222698 /nfs/dbraw/zinc/22/26/98/1125222698.db2.gz GBZMMWAWEBULFB-DYLGSBMWSA-N 1 0 298.386 3.550 20 10 CHCDRO COc1ccccc1CCC[NH2+][C@@H](C)c1ccccc1O ZINC000879650637 1125224515 /nfs/dbraw/zinc/22/45/15/1125224515.db2.gz KYYFCVDNYPTVLH-AWEZNQCLSA-N 1 0 285.387 3.684 20 10 CHCDRO CC[C@@H](C)C[C@@H](C)[NH2+]Cc1cc(Cl)cc(OC)c1O ZINC000228675605 1125251104 /nfs/dbraw/zinc/25/11/04/1125251104.db2.gz NWHNUNQXKPACRS-GHMZBOCLSA-N 1 0 285.815 3.969 20 10 CHCDRO CC[C@@H](C)[NH2+][C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000130082138 1125356405 /nfs/dbraw/zinc/35/64/05/1125356405.db2.gz NVJUVSPSEQLDGU-OLZOCXBDSA-N 1 0 298.377 3.645 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]C1(c2ccccc2F)CC1 ZINC000130547190 1125363089 /nfs/dbraw/zinc/36/30/89/1125363089.db2.gz DLFDOQMSRSCGJM-UHFFFAOYSA-N 1 0 291.753 3.964 20 10 CHCDRO CCSc1ccc(C[NH2+]Cc2ccccc2O)cc1 ZINC000883236567 1125382213 /nfs/dbraw/zinc/38/22/13/1125382213.db2.gz FIMKRKBQMJTMOD-UHFFFAOYSA-N 1 0 273.401 3.794 20 10 CHCDRO C[C@@H]([NH2+]CC(C)(C)CC(F)F)c1ccccc1O ZINC000883259377 1125387139 /nfs/dbraw/zinc/38/71/39/1125387139.db2.gz KSNQZBVQMWXQJX-SNVBAGLBSA-N 1 0 257.324 3.724 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CC(C)(C)CC(F)F)c1O ZINC000883260309 1125387320 /nfs/dbraw/zinc/38/73/20/1125387320.db2.gz QEBFHPJVALPWER-JTQLQIEISA-N 1 0 287.350 3.733 20 10 CHCDRO CC[C@H]([NH2+]C1(c2ncccn2)CCC1)c1ccc(C)cc1O ZINC000883311644 1125393300 /nfs/dbraw/zinc/39/33/00/1125393300.db2.gz HUDCTJHOMOJFFX-HNNXBMFYSA-N 1 0 297.402 3.611 20 10 CHCDRO CC[C@@H]([NH2+]C1(c2ncccn2)CCC1)c1ccc(C)cc1O ZINC000883311645 1125393702 /nfs/dbraw/zinc/39/37/02/1125393702.db2.gz HUDCTJHOMOJFFX-OAHLLOKOSA-N 1 0 297.402 3.611 20 10 CHCDRO C[C@H]([NH2+]CCCSc1nccs1)C(C)(C)C ZINC000132279118 1125417138 /nfs/dbraw/zinc/41/71/38/1125417138.db2.gz JRTSVFRUZOOEKQ-JTQLQIEISA-N 1 0 258.456 3.650 20 10 CHCDRO CCOc1cccc(C[N@H+](C)[C@H](C)C(C)(C)C)c1O ZINC000132571668 1125419672 /nfs/dbraw/zinc/41/96/72/1125419672.db2.gz ZUWZCCVFWZOYTD-GFCCVEGCSA-N 1 0 265.397 3.657 20 10 CHCDRO CC/C=C\C[NH2+]Cc1ccc(N(CC)CC)c(F)c1 ZINC001202561396 1125430777 /nfs/dbraw/zinc/43/07/77/1125430777.db2.gz VLCNLPGKIYLHFC-FPLPWBNLSA-N 1 0 264.388 3.728 20 10 CHCDRO CC[C@H]1CCCC[N@@H+]1Cc1cc(F)cc(Cl)c1[O-] ZINC001237798556 1129186552 /nfs/dbraw/zinc/18/65/52/1129186552.db2.gz JAPJVJBNLDGOBV-LBPRGKRZSA-N 1 0 271.763 3.949 20 10 CHCDRO CC[C@@H]([NH2+]CCCC(C)(F)F)c1ccccc1O ZINC000295946737 1129219375 /nfs/dbraw/zinc/21/93/75/1129219375.db2.gz GRVNBOSKQXNSBE-GFCCVEGCSA-N 1 0 257.324 3.868 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]Cc1ccc(Cl)cc1)CC2 ZINC000295829078 1129219665 /nfs/dbraw/zinc/21/96/65/1129219665.db2.gz DWCXKQCCKUSZHF-AWEZNQCLSA-N 1 0 273.763 3.823 20 10 CHCDRO C[C@@H](CCc1ccco1)[NH2+][C@H]1CCc2cccc(O)c21 ZINC000295989598 1129220400 /nfs/dbraw/zinc/22/04/00/1129220400.db2.gz NRRIJSUUFWAVEG-WFASDCNBSA-N 1 0 271.360 3.583 20 10 CHCDRO COc1cccc(C[N@@H+]2[C@H](C)C[C@H]3CCCC[C@H]32)c1O ZINC000245713025 1129221163 /nfs/dbraw/zinc/22/11/63/1129221163.db2.gz GHZOTOPTAGAWBR-UMVBOHGHSA-N 1 0 275.392 3.554 20 10 CHCDRO CCOc1cccc(C[N@@H+]2C[C@@H](C)[C@H]2c2ccccc2)c1O ZINC000245762165 1129224058 /nfs/dbraw/zinc/22/40/58/1129224058.db2.gz PZVHFWPBAYRNFV-KDOFPFPSSA-N 1 0 297.398 3.984 20 10 CHCDRO Cc1cccc(C[N@H+]2C[C@H](C)OC[C@H]2c2ccccc2)c1O ZINC000245859436 1129229649 /nfs/dbraw/zinc/22/96/49/1129229649.db2.gz OKPFWYRNUGWYSC-YJBOKZPZSA-N 1 0 297.398 3.663 20 10 CHCDRO Cc1cccc(C[N@H+]2C[C@@H](c3ccccc3)OC[C@H]2C)c1O ZINC000245848420 1129229941 /nfs/dbraw/zinc/22/99/41/1129229941.db2.gz LVPSTXSRHAIHQG-QAPCUYQASA-N 1 0 297.398 3.663 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)C1CC1)c1cc2c(cc1O)CCCC2 ZINC000184892735 1129261111 /nfs/dbraw/zinc/26/11/11/1129261111.db2.gz LOIBZBJOPYUAPR-VXGBXAGGSA-N 1 0 259.393 3.720 20 10 CHCDRO Cc1noc(C)c1[C@H](C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000378918766 1129284787 /nfs/dbraw/zinc/28/47/87/1129284787.db2.gz BTUSCEZRJIEOPF-ZDUSSCGKSA-N 1 0 299.418 3.742 20 10 CHCDRO CCOc1ccc(C[NH2+]C[C@H](C)C(C)(C)C)c(O)c1 ZINC000734509972 1129310184 /nfs/dbraw/zinc/31/01/84/1129310184.db2.gz PLFGIFUSTDONOJ-LBPRGKRZSA-N 1 0 265.397 3.563 20 10 CHCDRO CCc1ccc(CC[N@H+](C)Cc2ccccc2O)cc1 ZINC000734487798 1129310999 /nfs/dbraw/zinc/31/09/99/1129310999.db2.gz YSGKRXLZVHPNIX-UHFFFAOYSA-N 1 0 269.388 3.629 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](C)SC)c1ccc(N(C)C)cc1 ZINC000090725669 1129325927 /nfs/dbraw/zinc/32/59/27/1129325927.db2.gz RKWTWTWVWBGHLY-SWLSCSKDSA-N 1 0 266.454 3.545 20 10 CHCDRO CCOc1ccc(C[NH2+]C(C)(C)c2cccs2)c(O)c1 ZINC000735085473 1129330691 /nfs/dbraw/zinc/33/06/91/1129330691.db2.gz CBSOUTFCHOHNCY-UHFFFAOYSA-N 1 0 291.416 3.877 20 10 CHCDRO C[C@H]([NH2+]CC[C@H]1CCCO1)c1ccc2ccccc2c1O ZINC000038095430 1129336281 /nfs/dbraw/zinc/33/62/81/1129336281.db2.gz RJHXNUFPDCEZJB-DZGCQCFKSA-N 1 0 285.387 3.765 20 10 CHCDRO c1ccc2c(c1)SC[C@H]2[NH2+]Cc1ccc2c(c1)CCO2 ZINC000735508496 1129348370 /nfs/dbraw/zinc/34/83/70/1129348370.db2.gz BSWLMKNTPMOFLO-OAHLLOKOSA-N 1 0 283.396 3.558 20 10 CHCDRO C[C@H](Cc1ccccc1Cl)[NH2+]Cc1ccc(N)cc1 ZINC001246167691 1131369592 /nfs/dbraw/zinc/36/95/92/1131369592.db2.gz ABWTVIZPOGCDBV-GFCCVEGCSA-N 1 0 274.795 3.643 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2ccccc2O)cc1C ZINC000091974503 1129375772 /nfs/dbraw/zinc/37/57/72/1129375772.db2.gz ODYXJXXAOAFNJJ-UHFFFAOYSA-N 1 0 255.361 3.641 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2ccccc2O)c(C)c1 ZINC000091956831 1129376290 /nfs/dbraw/zinc/37/62/90/1129376290.db2.gz MEJWLLZFFMQQDA-UHFFFAOYSA-N 1 0 255.361 3.641 20 10 CHCDRO Cc1cc(C[N@H+](C)C[C@H]2CCCO2)c(O)c(C(C)(C)C)c1 ZINC000738066878 1129390089 /nfs/dbraw/zinc/39/00/89/1129390089.db2.gz POKUFBFXPNLXQI-OAHLLOKOSA-N 1 0 291.435 3.609 20 10 CHCDRO CCO[C@@H]1C[C@@H]([NH2+][C@H](C)c2ccc(F)cc2[O-])C12CCC2 ZINC000248489484 1129419900 /nfs/dbraw/zinc/41/99/00/1129419900.db2.gz HKDASKGAXQDXBM-HFBAOOFYSA-N 1 0 293.382 3.530 20 10 CHCDRO C[C@@H](Cc1ccc(O)cc1)[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC000093324532 1129421104 /nfs/dbraw/zinc/42/11/04/1129421104.db2.gz UYHOYHMXYNWAJQ-HNNXBMFYSA-N 1 0 298.430 3.521 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2[C@@H]3c4ccccc4C[C@H]23)c(O)c1 ZINC000248532672 1129421293 /nfs/dbraw/zinc/42/12/93/1129421293.db2.gz YSCZOSGSBFVGMP-DOFJYSBOSA-N 1 0 293.410 3.937 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](C)[C@@H](C)c2cccc(O)c2)cc1C ZINC000093315579 1129421519 /nfs/dbraw/zinc/42/15/19/1129421519.db2.gz ZTQHIBJDVSZOOC-AWEZNQCLSA-N 1 0 285.387 3.908 20 10 CHCDRO C[N@H+](Cc1ccc(N2CCCCC2)cc1)C1CCC1 ZINC000093475689 1129424564 /nfs/dbraw/zinc/42/45/64/1129424564.db2.gz OSJMERHXTDHTCF-UHFFFAOYSA-N 1 0 258.409 3.661 20 10 CHCDRO COc1cccc(C[N@@H+]2CC[C@@H](c3ccccc3)[C@H]2C)c1O ZINC000093689634 1129427058 /nfs/dbraw/zinc/42/70/58/1129427058.db2.gz SEURTYUTNDHCMB-RHSMWYFYSA-N 1 0 297.398 3.779 20 10 CHCDRO CCO[C@@H]1C[C@@H]([NH2+][C@@H](CC)c2ccccc2O)C12CCC2 ZINC000248894979 1129430499 /nfs/dbraw/zinc/43/04/99/1129430499.db2.gz UPNGIJQUSVSVEX-USXIJHARSA-N 1 0 289.419 3.781 20 10 CHCDRO Cc1ccc2c(c1)C[N@@H+](Cc1cc(C)c(C)cc1O)CCO2 ZINC000795711508 1129438520 /nfs/dbraw/zinc/43/85/20/1129438520.db2.gz RWLSBZIWASJDGT-UHFFFAOYSA-N 1 0 297.398 3.712 20 10 CHCDRO Cc1csc([C@H](C)[NH2+][C@@H](C)c2cc(F)ccc2O)n1 ZINC000094618314 1129448250 /nfs/dbraw/zinc/44/82/50/1129448250.db2.gz DIBZUVJEYXYVOX-UWVGGRQHSA-N 1 0 280.368 3.708 20 10 CHCDRO CCCC[N@H+](CCCCF)Cc1ccccc1O ZINC000796061949 1129464166 /nfs/dbraw/zinc/46/41/66/1129464166.db2.gz OFDBLHNRDJJIAP-UHFFFAOYSA-N 1 0 253.361 3.744 20 10 CHCDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]CCC1CC1 ZINC000742382923 1129473142 /nfs/dbraw/zinc/47/31/42/1129473142.db2.gz MXUSLDOCBUCHJZ-UHFFFAOYSA-N 1 0 267.372 3.949 20 10 CHCDRO COC[C@H]([NH2+]Cc1cc(-c2ccccc2)ccc1O)C(C)C ZINC000742373971 1129475269 /nfs/dbraw/zinc/47/52/69/1129475269.db2.gz MJQUVQRXOAGAAY-SFHVURJKSA-N 1 0 299.414 3.820 20 10 CHCDRO Cc1cccc(F)c1C[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000742380109 1129476091 /nfs/dbraw/zinc/47/60/91/1129476091.db2.gz HMMBUUFUEMKTAC-UHFFFAOYSA-N 1 0 290.357 3.629 20 10 CHCDRO CC[C@H]1C[N@H+](Cc2c(O)ccc3ccccc32)CCS1 ZINC000743396698 1129521740 /nfs/dbraw/zinc/52/17/40/1129521740.db2.gz BSKVFQFTCWYBHO-AWEZNQCLSA-N 1 0 287.428 3.873 20 10 CHCDRO CC[C@]1(C)CCC[N@H+](Cc2c(O)ccc3ccncc32)C1 ZINC000743386107 1129521800 /nfs/dbraw/zinc/52/18/00/1129521800.db2.gz BGABQUITVAHXFX-GOSISDBHSA-N 1 0 284.403 3.953 20 10 CHCDRO CSCCC[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000743839747 1129539469 /nfs/dbraw/zinc/53/94/69/1129539469.db2.gz WZUWHSVMBDDKIE-UHFFFAOYSA-N 1 0 292.492 3.862 20 10 CHCDRO CC[N@H+](CCC1CC1)Cc1cc(Br)ccc1O ZINC000743870853 1129541975 /nfs/dbraw/zinc/54/19/75/1129541975.db2.gz DQNOVBBRZXVSNC-UHFFFAOYSA-N 1 0 298.224 3.777 20 10 CHCDRO CCC[N@H+](CCOc1ccccc1C)Cc1ccccc1O ZINC000743870505 1129541886 /nfs/dbraw/zinc/54/18/86/1129541886.db2.gz UQVUZKFFOLXRNM-UHFFFAOYSA-N 1 0 299.414 3.992 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCC[C@H](C)[C@@H]2C)c1 ZINC000251890955 1129546905 /nfs/dbraw/zinc/54/69/05/1129546905.db2.gz RTYOOPIAZDHRTK-WFGGJUAMSA-N 1 0 277.408 3.876 20 10 CHCDRO Cc1cc(N2CCCCC2)ccc1C1=CCC[N@@H+](C)C1 ZINC001241571889 1129584292 /nfs/dbraw/zinc/58/42/92/1129584292.db2.gz KFEHUOOGQUQBCJ-UHFFFAOYSA-N 1 0 270.420 3.704 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2C[C@@H](OC(C)C)C2(C)C)c(O)c1 ZINC000766330128 1129603295 /nfs/dbraw/zinc/60/32/95/1129603295.db2.gz GXLLEPALNBYOGR-IAOVAPTHSA-N 1 0 291.435 3.943 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)c1ccccc1 ZINC000746047184 1129623450 /nfs/dbraw/zinc/62/34/50/1129623450.db2.gz JSBKYYNQTMRWNK-OAHLLOKOSA-N 1 0 268.404 3.912 20 10 CHCDRO CO[C@]1(C)C[C@H]([NH2+][C@H](C)c2ccc(N(C)C)cc2)C1(C)C ZINC000766382690 1129660841 /nfs/dbraw/zinc/66/08/41/1129660841.db2.gz XYVAYVDTDVEOAX-RPVQJOFSSA-N 1 0 290.451 3.607 20 10 CHCDRO CCO[C@H](CC[NH2+][C@H](C)c1ccc(N(C)C)cc1)C(C)C ZINC000766387511 1129663547 /nfs/dbraw/zinc/66/35/47/1129663547.db2.gz HEKBJFOPIPJVLB-CRAIPNDOSA-N 1 0 292.467 3.854 20 10 CHCDRO Cc1cc(C[N@@H+]2CC[C@@H]3C[C@@H]32)ccc1N1CCCCC1 ZINC000828533723 1131389590 /nfs/dbraw/zinc/38/95/90/1131389590.db2.gz JUOQNSCEAFDQJO-AEFFLSMTSA-N 1 0 270.420 3.580 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CC(C)(C)C[C@H](C)O)cc1 ZINC000305772014 1129674343 /nfs/dbraw/zinc/67/43/43/1129674343.db2.gz RWAHCMVPJRVDIQ-GJZGRUSLSA-N 1 0 292.467 3.590 20 10 CHCDRO C[C@@H]1SCC[C@H]1[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000380317771 1129728791 /nfs/dbraw/zinc/72/87/91/1129728791.db2.gz MUZAAWIRWFSXJD-WMLDXEAASA-N 1 0 290.476 3.661 20 10 CHCDRO CCOC1(C[NH2+][C@H](C)c2cc(C)ccc2O)CCCC1 ZINC000380515331 1129831293 /nfs/dbraw/zinc/83/12/93/1129831293.db2.gz APBBWAXQTQIBNH-CQSZACIVSA-N 1 0 277.408 3.701 20 10 CHCDRO Cc1cc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)cs1 ZINC000381283943 1129836399 /nfs/dbraw/zinc/83/63/99/1129836399.db2.gz LWNHWCQIMLOKDV-CYBMUJFWSA-N 1 0 274.433 3.973 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2c(O)cccc2Cl)c(C)c1 ZINC000113324257 1129836556 /nfs/dbraw/zinc/83/65/56/1129836556.db2.gz VYXXAQXQLPTYBD-UHFFFAOYSA-N 1 0 275.779 3.952 20 10 CHCDRO Cn1cccc1[C@H]1CCC[N@@H+]1Cc1c(O)cccc1Cl ZINC000768199820 1129839170 /nfs/dbraw/zinc/83/91/70/1129839170.db2.gz ZITJNQYMTMYDNE-OAHLLOKOSA-N 1 0 290.794 3.721 20 10 CHCDRO Cc1ccc(OCC[N@@H+](C)Cc2cc(C)ccc2O)cc1 ZINC000768213260 1129844007 /nfs/dbraw/zinc/84/40/07/1129844007.db2.gz PIWZVWLJXZVGIB-UHFFFAOYSA-N 1 0 285.387 3.520 20 10 CHCDRO CN(C)c1ccc(C[N@H+](Cc2cccc(O)c2)C2CC2)cc1 ZINC000768258898 1129846670 /nfs/dbraw/zinc/84/66/70/1129846670.db2.gz YKUNAPLXGWHKLI-UHFFFAOYSA-N 1 0 296.414 3.623 20 10 CHCDRO C[N@H+](Cc1ccc(F)c(F)c1)Cc1cc(Cl)ccc1O ZINC000768263519 1129848713 /nfs/dbraw/zinc/84/87/13/1129848713.db2.gz TZGHOKGUNVZVLE-UHFFFAOYSA-N 1 0 297.732 3.956 20 10 CHCDRO CCOc1cccc(C[N@H+](CC)CCc2ccccc2)c1O ZINC000768336539 1129852906 /nfs/dbraw/zinc/85/29/06/1129852906.db2.gz VNFQAPAAWJZEKR-UHFFFAOYSA-N 1 0 299.414 3.856 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CC[C@H](c3ccccc3)C2)c1 ZINC000768361490 1129853641 /nfs/dbraw/zinc/85/36/41/1129853641.db2.gz RMSFYRZKBBLSTC-INIZCTEOSA-N 1 0 297.398 3.780 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CCC[C@H]1c1ccccn1 ZINC000768359958 1129853702 /nfs/dbraw/zinc/85/37/02/1129853702.db2.gz HYHXUFWNCWETFR-HNNXBMFYSA-N 1 0 288.778 3.778 20 10 CHCDRO COc1cc(C[N@H+](C)[C@H]2CCC[C@@H](C)C2)c(O)cc1C ZINC000768442717 1129857612 /nfs/dbraw/zinc/85/76/12/1129857612.db2.gz ZJYVLOKHWMICPL-DOMZBBRYSA-N 1 0 277.408 3.720 20 10 CHCDRO C[N@H+](CCC1CC1)Cc1cc2c(cc1O)CCCC2 ZINC000768461817 1129858804 /nfs/dbraw/zinc/85/88/04/1129858804.db2.gz FQEXXVMPFMFEJR-UHFFFAOYSA-N 1 0 259.393 3.503 20 10 CHCDRO COCC[C@@H]1CCCC[N@H+](Cc2cc(C)c(C)cc2O)C1 ZINC000768541243 1129861593 /nfs/dbraw/zinc/86/15/93/1129861593.db2.gz LWULOXNLXHCYNN-INIZCTEOSA-N 1 0 291.435 3.648 20 10 CHCDRO Cc1cc(C[NH2+]C(C)C)c(C)n1-c1cccc(C)c1 ZINC000743503775 1129862194 /nfs/dbraw/zinc/86/21/94/1129862194.db2.gz XYHJUVDXZIUWSK-UHFFFAOYSA-N 1 0 256.393 3.901 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C2(C)Cc3ccccc3C2)cc1C ZINC000768661762 1129867474 /nfs/dbraw/zinc/86/74/74/1129867474.db2.gz KHTNKFLICQYIFH-UHFFFAOYSA-N 1 0 281.399 3.656 20 10 CHCDRO COCC1(C[NH2+][C@H](C)c2cc(Cl)ccc2O)CCC1 ZINC000800492777 1129879126 /nfs/dbraw/zinc/87/91/26/1129879126.db2.gz OQSPZGRECYAQRO-LLVKDONJSA-N 1 0 283.799 3.513 20 10 CHCDRO Cc1cccc(C[NH2+]CCc2cccc3[nH]ccc32)c1O ZINC000800535519 1129882105 /nfs/dbraw/zinc/88/21/05/1129882105.db2.gz CFBUSCDXABSYGZ-UHFFFAOYSA-N 1 0 280.371 3.514 20 10 CHCDRO C[C@@H](CCC1CC1)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000768951388 1129885819 /nfs/dbraw/zinc/88/58/19/1129885819.db2.gz GKIOSZKKVFLFGA-LBPRGKRZSA-N 1 0 264.388 3.560 20 10 CHCDRO CC[N@H+](CCc1ccccn1)Cc1c(O)cccc1Cl ZINC000769039523 1129887786 /nfs/dbraw/zinc/88/77/86/1129887786.db2.gz XCUPOEFOWGJHCK-UHFFFAOYSA-N 1 0 290.794 3.505 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CC[C@H](c3ccc(F)cc3)C2)cc1 ZINC000769398568 1129906057 /nfs/dbraw/zinc/90/60/57/1129906057.db2.gz SWASZPLUUAWYRN-KRWDZBQOSA-N 1 0 298.405 3.881 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCS[C@H](c3ccccc3)C2)c1 ZINC000769426328 1129908156 /nfs/dbraw/zinc/90/81/56/1129908156.db2.gz PZLZLTLCTMFVSV-SFHVURJKSA-N 1 0 299.439 3.991 20 10 CHCDRO COc1cccc(O)c1C[N@@H+]1Cc2ccccc2C(C)(C)C1 ZINC000769427672 1129908418 /nfs/dbraw/zinc/90/84/18/1129908418.db2.gz TYLQSAZWCXQNIL-UHFFFAOYSA-N 1 0 297.398 3.694 20 10 CHCDRO COc1cccc(C[N@@H+]2CCCC[C@H]2CC(C)C)c1O ZINC000769483992 1129909559 /nfs/dbraw/zinc/90/95/59/1129909559.db2.gz BFEZILGBIRTLJZ-HNNXBMFYSA-N 1 0 277.408 3.801 20 10 CHCDRO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)C[C@H]1C[C@@H]1C ZINC000769487678 1129909898 /nfs/dbraw/zinc/90/98/98/1129909898.db2.gz KVBPPNUHAISCFE-GOEBONIOSA-N 1 0 260.425 3.619 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC[C@@](C)(c3ccccc3)C2)c1 ZINC000769503412 1129913951 /nfs/dbraw/zinc/91/39/51/1129913951.db2.gz KKEGDHFJGAKGBX-LJQANCHMSA-N 1 0 281.399 3.864 20 10 CHCDRO COc1cccc(O)c1C[N@@H+]1CC[C@@H](c2ccccc2)[C@H]1C ZINC000769498647 1129914080 /nfs/dbraw/zinc/91/40/80/1129914080.db2.gz NTUSHKQWBQQRHK-GDBMZVCRSA-N 1 0 297.398 3.779 20 10 CHCDRO CCS[C@H]1CC[C@H]([N@H+](C)Cc2ccc(N(C)C)cc2)C1 ZINC000769550336 1129917408 /nfs/dbraw/zinc/91/74/08/1129917408.db2.gz RBZKDZDHJWWRNA-IRXDYDNUSA-N 1 0 292.492 3.859 20 10 CHCDRO CCCC[N@@H+](Cc1ccccc1O)C[C@@H]1CC[C@@H](C)O1 ZINC000801594586 1129930830 /nfs/dbraw/zinc/93/08/30/1129930830.db2.gz GUKJFJLTGAGNIT-ZBFHGGJFSA-N 1 0 277.408 3.562 20 10 CHCDRO C[C@H]1CC(CC[NH2+]Cc2c(O)cccc2Cl)C[C@H](C)O1 ZINC000801731313 1129940645 /nfs/dbraw/zinc/94/06/45/1129940645.db2.gz XWNDHESKSKINEX-RYUDHWBXSA-N 1 0 297.826 3.729 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CCC2C[C@@H](C)O[C@H](C)C2)cc1C ZINC000801730107 1129940931 /nfs/dbraw/zinc/94/09/31/1129940931.db2.gz FMVZCNGVSYMCPN-HUUCEWRRSA-N 1 0 291.435 3.692 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2ccc(N3CCCCC3)cc2)[C@H]1C ZINC000770283035 1129943073 /nfs/dbraw/zinc/94/30/73/1129943073.db2.gz IEXVWJUGEKJLFR-CVEARBPZSA-N 1 0 272.436 3.907 20 10 CHCDRO CC[C@@H]1CN(C)c2ccccc2C[N@@H+]1Cc1ccccc1O ZINC000770505299 1129947954 /nfs/dbraw/zinc/94/79/54/1129947954.db2.gz NVVMLJHMHIATNF-QGZVFWFLSA-N 1 0 296.414 3.623 20 10 CHCDRO Oc1ccccc1C[NH2+][C@@H]1CC[C@@H](c2ccccc2)C1 ZINC000770739524 1129957346 /nfs/dbraw/zinc/95/73/46/1129957346.db2.gz CRSQIHHETOSGGZ-NVXWUHKLSA-N 1 0 267.372 3.818 20 10 CHCDRO CCc1cccc(C[NH2+]CCSC(C)(C)C)c1O ZINC000691484961 1129974878 /nfs/dbraw/zinc/97/48/78/1129974878.db2.gz WGSXCXNBTANSAA-UHFFFAOYSA-N 1 0 267.438 3.576 20 10 CHCDRO CCSCC[C@H](C)[NH2+]Cc1cccc(CC)c1O ZINC000691498838 1129977484 /nfs/dbraw/zinc/97/74/84/1129977484.db2.gz DHUUOZBJCPUONG-LBPRGKRZSA-N 1 0 267.438 3.576 20 10 CHCDRO CCc1cccc(C[NH2+]CCCCCSC)c1O ZINC000691499723 1129977628 /nfs/dbraw/zinc/97/76/28/1129977628.db2.gz HZOXLPITVJKDNR-UHFFFAOYSA-N 1 0 267.438 3.578 20 10 CHCDRO C[C@H]([NH2+]CC[C@@H]1C[C@@H](C)O[C@@H](C)C1)c1ccccc1O ZINC000802309700 1129991384 /nfs/dbraw/zinc/99/13/84/1129991384.db2.gz UERMYHJGAGWOSP-XGUBFFRZSA-N 1 0 277.408 3.637 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CC[C@H]2c2ccccc2)cc1 ZINC000771937341 1129997339 /nfs/dbraw/zinc/99/73/39/1129997339.db2.gz ASSSDRHKOURLNT-SFHVURJKSA-N 1 0 266.388 3.700 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)Cc2cccc(O)c2)cc1 ZINC000771935306 1129997415 /nfs/dbraw/zinc/99/74/15/1129997415.db2.gz LVDHNNIOQDFAKX-UHFFFAOYSA-N 1 0 298.430 3.870 20 10 CHCDRO Cn1ccc2c1cc[nH+]c2-c1cnc2ccccc2c1 ZINC001239790499 1130108138 /nfs/dbraw/zinc/10/81/38/1130108138.db2.gz SQITZEQUWIYCCD-UHFFFAOYSA-N 1 0 259.312 3.789 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C2CC3(C2)COC(C)(C)C3)c(O)c1 ZINC000903322184 1130154080 /nfs/dbraw/zinc/15/40/80/1130154080.db2.gz AHXHSVZUQQWKRD-WRSVWVKZSA-N 1 0 289.419 3.699 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CC[C@@H]2CCC(F)(F)C2)c1O ZINC000903340771 1130162702 /nfs/dbraw/zinc/16/27/02/1130162702.db2.gz JLAWSNONNMUOAK-RYUDHWBXSA-N 1 0 299.361 3.877 20 10 CHCDRO C[C@H]([NH2+][C@@H](c1ccccn1)C1CC1)c1ccc(N(C)C)cc1 ZINC000903341306 1130163341 /nfs/dbraw/zinc/16/33/41/1130163341.db2.gz XLAMYHDHSHAZRZ-IFXJQAMLSA-N 1 0 295.430 3.950 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCOC12CCCC2)c1ccc(Cl)cc1O ZINC000903388771 1130169756 /nfs/dbraw/zinc/16/97/56/1130169756.db2.gz NMQWBIRRIRANPE-IAQYHMDHSA-N 1 0 295.810 3.798 20 10 CHCDRO C[C@H]([NH2+][C@H](c1ccncc1)C1CC1)c1cc(F)ccc1O ZINC000903428982 1130175431 /nfs/dbraw/zinc/17/54/31/1130175431.db2.gz RIUFIUOFIMFPSP-GTNSWQLSSA-N 1 0 286.350 3.728 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@H](CC(C)C)N(C)C)c(O)c1 ZINC000788505289 1130191464 /nfs/dbraw/zinc/19/14/64/1130191464.db2.gz FYARVPHKFOICRS-HOTGVXAUSA-N 1 0 292.467 3.636 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CCN(C(C)C)C(C)C)c(O)c1 ZINC000788506596 1130192012 /nfs/dbraw/zinc/19/20/12/1130192012.db2.gz WSVVJEAXMCPCNM-INIZCTEOSA-N 1 0 292.467 3.778 20 10 CHCDRO CCCC(O)(CCC)C[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000788602418 1130197078 /nfs/dbraw/zinc/19/70/78/1130197078.db2.gz NJQRFJZIAXBYQI-HNNXBMFYSA-N 1 0 293.451 3.991 20 10 CHCDRO CSC1(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)CCC1 ZINC000788604472 1130197581 /nfs/dbraw/zinc/19/75/81/1130197581.db2.gz AUQDBBVFBAGDDV-PWSUYJOCSA-N 1 0 295.423 3.955 20 10 CHCDRO CC[C@@H]1[C@H](C)CC[N@@H+]1Cc1c([O-])ccc(Cl)c1F ZINC001462123240 1130199989 /nfs/dbraw/zinc/19/99/89/1130199989.db2.gz ATGXFJBSBPHUES-BXKDBHETSA-N 1 0 271.763 3.805 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C2C[C@@H](C)O[C@H](C)C2)c(O)c1 ZINC000788684200 1130200340 /nfs/dbraw/zinc/20/03/40/1130200340.db2.gz BMVNWZKJLFSSCH-MCIONIFRSA-N 1 0 277.408 3.616 20 10 CHCDRO CCC[N@@H+](Cc1ccccc1O)C[C@@H](O)CC1CCCC1 ZINC000789327428 1130243346 /nfs/dbraw/zinc/24/33/46/1130243346.db2.gz OYLKYVDDHUMFEY-KRWDZBQOSA-N 1 0 291.435 3.545 20 10 CHCDRO C[C@@H]1CC[C@H]([NH2+]Cc2cc3ccccc3cc2O)C1 ZINC001170112115 1130264038 /nfs/dbraw/zinc/26/40/38/1130264038.db2.gz HDRVPHCESCUCOU-WBMJQRKESA-N 1 0 255.361 3.824 20 10 CHCDRO CC(C)(C)N1CC[C@H]1C[NH2+]Cc1ccc2ccccc2c1O ZINC000826791026 1130282340 /nfs/dbraw/zinc/28/23/40/1130282340.db2.gz QLNBJHJWYCZCOP-INIZCTEOSA-N 1 0 298.430 3.508 20 10 CHCDRO C[C@]1(C2CC2)C[N@H+](Cc2ccc3ccccc3c2O)CCO1 ZINC000826877324 1130305296 /nfs/dbraw/zinc/30/52/96/1130305296.db2.gz DKHBAEJFAGGMNL-LJQANCHMSA-N 1 0 297.398 3.546 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C(C)C)C(C)(C)O)c1ccc(N(C)C)cc1 ZINC000790701702 1130326579 /nfs/dbraw/zinc/32/65/79/1130326579.db2.gz MEDBHDNWYDJXSV-SJORKVTESA-N 1 0 292.467 3.589 20 10 CHCDRO Cc1nc(C[NH2+][C@H](C)c2cc(Cl)ccc2O)cs1 ZINC000756433240 1130423312 /nfs/dbraw/zinc/42/33/12/1130423312.db2.gz CFMCVJAIYVPOJT-MRVPVSSYSA-N 1 0 282.796 3.661 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+][C@@H]1CCCc2ccc(F)cc21 ZINC000793304638 1130539601 /nfs/dbraw/zinc/53/96/01/1130539601.db2.gz LUIRFOJBFVJROD-MRXNPFEDSA-N 1 0 289.325 3.838 20 10 CHCDRO CCOCc1cc(C[NH2+]C[C@H]2CC[C@H](C)C2)ccc1OC ZINC000793346146 1130548043 /nfs/dbraw/zinc/54/80/43/1130548043.db2.gz DBGLREMFBFABSP-GJZGRUSLSA-N 1 0 291.435 3.758 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)C2CCC(F)(F)CC2)c(O)c1 ZINC000793390908 1130551891 /nfs/dbraw/zinc/55/18/91/1130551891.db2.gz UXNHWRZUJJKRRZ-NSHDSACASA-N 1 0 299.361 3.704 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CC3(CCC3)[C@@H]2C2CC2)c(O)c1 ZINC000811514010 1130620314 /nfs/dbraw/zinc/62/03/14/1130620314.db2.gz ZSNIYCUDKXMZEQ-KRWDZBQOSA-N 1 0 287.403 3.555 20 10 CHCDRO Cc1cccc(C[N@H+]2C[C@@H](C(F)(F)F)CC[C@H]2C)c1O ZINC000780793149 1130692480 /nfs/dbraw/zinc/69/24/80/1130692480.db2.gz KNCXXURSBXRSDP-YPMHNXCESA-N 1 0 287.325 3.863 20 10 CHCDRO CO[C@H](C)C1C[NH+](Cc2cccc(-c3ccccc3)c2O)C1 ZINC001234999650 1130700448 /nfs/dbraw/zinc/70/04/48/1130700448.db2.gz XRBMWTHZMYHZJM-CQSZACIVSA-N 1 0 297.398 3.526 20 10 CHCDRO CCO[C@@H]1CC[N@H+](Cc2cccc(-c3ccccc3)c2O)C1 ZINC001234999723 1130700870 /nfs/dbraw/zinc/70/08/70/1130700870.db2.gz YGKQWDROVGISJK-QGZVFWFLSA-N 1 0 297.398 3.670 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@](C)(OC)C2CC2)cc1 ZINC000812734653 1130708995 /nfs/dbraw/zinc/70/89/95/1130708995.db2.gz PPNPZFDGLPOCTF-KDOFPFPSSA-N 1 0 290.451 3.608 20 10 CHCDRO COc1ccc2c(c1)C[C@H](C)[N@@H+](Cc1ccccc1O)[C@H]2C ZINC000781925933 1130748038 /nfs/dbraw/zinc/74/80/38/1130748038.db2.gz CJTVZJDFYBRCEK-KBPBESRZSA-N 1 0 297.398 3.909 20 10 CHCDRO Cc1cccc(C[N@H+]2CC[C@@]3(CC[C@H](C)C3)C2)c1O ZINC000781929029 1130750298 /nfs/dbraw/zinc/75/02/98/1130750298.db2.gz OLUABMXWDQCXJK-SUMWQHHRSA-N 1 0 259.393 3.713 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)CSC(C)(C)C)c1 ZINC000813330910 1130760009 /nfs/dbraw/zinc/76/00/09/1130760009.db2.gz IYEBCFUWPRURAO-NWDGAFQWSA-N 1 0 297.464 3.972 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cccc(C)c2C)c1 ZINC000813331675 1130760991 /nfs/dbraw/zinc/76/09/91/1130760991.db2.gz QZHGTBBLKJTGOC-AWEZNQCLSA-N 1 0 285.387 3.868 20 10 CHCDRO CC(C)(C)c1ccc(C[NH+]2C3CCC2CC3)c(O)c1 ZINC001235679629 1130767497 /nfs/dbraw/zinc/76/74/97/1130767497.db2.gz HEGVTJUYCUXFLB-UHFFFAOYSA-N 1 0 259.393 3.817 20 10 CHCDRO CC(C)(C)c1ccc(C[N@@H+]2CCC[C@@H]2CF)c(O)c1 ZINC001235678418 1130768223 /nfs/dbraw/zinc/76/82/23/1130768223.db2.gz BMRACFWGRXMNRH-CQSZACIVSA-N 1 0 265.372 3.624 20 10 CHCDRO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(N)cc2)cc1 ZINC001235679166 1130768813 /nfs/dbraw/zinc/76/88/13/1130768813.db2.gz PMOHAWAKDQXSPA-SFHVURJKSA-N 1 0 266.388 3.914 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]CC(C)(C)C(C)C)c1 ZINC000782534482 1130782805 /nfs/dbraw/zinc/78/28/05/1130782805.db2.gz FFZJJYLUCMPCKR-UHFFFAOYSA-N 1 0 265.397 3.563 20 10 CHCDRO CN(C)c1ccc(C[NH2+]Cc2ccc3c(c2)CCCC3)cc1 ZINC000813768919 1130782830 /nfs/dbraw/zinc/78/28/30/1130782830.db2.gz LXQWDYMWLFZTKX-UHFFFAOYSA-N 1 0 294.442 3.921 20 10 CHCDRO COc1ccc(CC(C)(C)[NH2+]Cc2cc(C)ccc2O)cc1 ZINC000782536805 1130782991 /nfs/dbraw/zinc/78/29/91/1130782991.db2.gz YMZJKGUSSNNOBZ-UHFFFAOYSA-N 1 0 299.414 3.820 20 10 CHCDRO CCOC(C)(C)C[NH2+][C@H](CC)c1cc(Cl)ccc1O ZINC000783313065 1130815161 /nfs/dbraw/zinc/81/51/61/1130815161.db2.gz MCQPZOLEUGKXKM-CYBMUJFWSA-N 1 0 285.815 3.901 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCC=CO1)c1cc2c(cc1O)CCCC2 ZINC000783312191 1130815822 /nfs/dbraw/zinc/81/58/22/1130815822.db2.gz ZTGJRISTKCTQOO-XJKSGUPXSA-N 1 0 287.403 3.614 20 10 CHCDRO Cc1ccc(CC[NH2+][C@@H](C)c2ccccc2O)c(C)c1 ZINC000783505326 1130830782 /nfs/dbraw/zinc/83/07/82/1130830782.db2.gz VTYIMXJVWFWWQE-HNNXBMFYSA-N 1 0 269.388 3.902 20 10 CHCDRO CCC1(CC)[C@H]([NH2+][C@H](C)c2ccccc2O)C[C@@H]1OC ZINC000783518668 1130833759 /nfs/dbraw/zinc/83/37/59/1130833759.db2.gz NKBBZSUPYLATIM-WQVCFCJDSA-N 1 0 277.408 3.637 20 10 CHCDRO CCOc1ccc(O)c(C[NH+](C2CCC2)C2CCC2)c1 ZINC000814177586 1130834051 /nfs/dbraw/zinc/83/40/51/1130834051.db2.gz HROWHGKJZSHCOS-UHFFFAOYSA-N 1 0 275.392 3.698 20 10 CHCDRO CCCCn1cc(C[NH2+][C@H](C)c2ccccc2O)c(C)n1 ZINC000783525651 1130834738 /nfs/dbraw/zinc/83/47/38/1130834738.db2.gz MPJSQRMGINENDS-CQSZACIVSA-N 1 0 287.407 3.548 20 10 CHCDRO CC(C)[C@@H]1[N@H+](Cc2cc(F)ccc2O)CC12CCC2 ZINC000814171904 1130839037 /nfs/dbraw/zinc/83/90/37/1130839037.db2.gz YSTAGRMHAZLSCC-HNNXBMFYSA-N 1 0 263.356 3.542 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2cc(F)ccc2O)[C@H]2CCCC[C@H]12 ZINC000783592152 1130841645 /nfs/dbraw/zinc/84/16/45/1130841645.db2.gz DGEMNQLAZUNGGF-DFBGVHRSSA-N 1 0 263.356 3.542 20 10 CHCDRO COc1ccc(C[NH2+][C@H]2C[C@@H]3[C@H](C2)C3(C)C)cc1C ZINC001170732324 1130842067 /nfs/dbraw/zinc/84/20/67/1130842067.db2.gz YLQXAFSGJHGYFE-QDMKHBRRSA-N 1 0 259.393 3.528 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCS[C@@H]2C)cc1F ZINC000783628739 1130843157 /nfs/dbraw/zinc/84/31/57/1130843157.db2.gz LUNLMTYOWGOYJX-IUODEOHRSA-N 1 0 296.455 3.656 20 10 CHCDRO Cc1cccc(C[NH2+]C(C)(C)CC(F)(F)F)c1O ZINC000783717369 1130851483 /nfs/dbraw/zinc/85/14/83/1130851483.db2.gz JXMQNBXMENVNOD-UHFFFAOYSA-N 1 0 261.287 3.521 20 10 CHCDRO COc1cccc(C[N@@H+]2CCCC3(CCCC3)C2)c1O ZINC000783743014 1130852272 /nfs/dbraw/zinc/85/22/72/1130852272.db2.gz DKHGIKLCYXZSOG-UHFFFAOYSA-N 1 0 275.392 3.557 20 10 CHCDRO C[N@@H+](Cc1cc2c(cc1O)CCC2)C[C@@H]1CC=CCC1 ZINC000784012435 1130868630 /nfs/dbraw/zinc/86/86/30/1130868630.db2.gz CVORUPRHAFCMGT-CQSZACIVSA-N 1 0 271.404 3.669 20 10 CHCDRO Nc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2F)cc1 ZINC001236128245 1130870902 /nfs/dbraw/zinc/87/09/02/1130870902.db2.gz IWBUICAXINNDFE-QGZVFWFLSA-N 1 0 288.341 3.884 20 10 CHCDRO COc1cc(C)cc(C[N@@H+]2CC[C@@H](C(C)(C)C)C2)c1O ZINC000784037700 1130871714 /nfs/dbraw/zinc/87/17/14/1130871714.db2.gz YUWNZMUMUOLHHN-CQSZACIVSA-N 1 0 277.408 3.577 20 10 CHCDRO CCCC[C@@H]1CN(Cc2ccc3ccccc3c2O)CC[NH2+]1 ZINC001236137578 1130874805 /nfs/dbraw/zinc/87/48/05/1130874805.db2.gz NPTLCPDDHADPTF-QGZVFWFLSA-N 1 0 298.430 3.509 20 10 CHCDRO CC(C)c1ccc(C[N@@H+]2CCc3c(N)cccc3C2)c(O)c1 ZINC001236365658 1130920794 /nfs/dbraw/zinc/92/07/94/1130920794.db2.gz PRRKYUJBDZBSKU-UHFFFAOYSA-N 1 0 296.414 3.656 20 10 CHCDRO CCC[C@H](C(=O)c1ccccc1)[N@H+](C)Cc1ccc(N)cc1 ZINC001236424025 1130937617 /nfs/dbraw/zinc/93/76/17/1130937617.db2.gz QDPAFDPPGQXHLK-GOSISDBHSA-N 1 0 296.414 3.752 20 10 CHCDRO Cc1cccc(CCC[NH2+][C@@H](C)c2cc(F)ccc2O)n1 ZINC000797016981 1130953285 /nfs/dbraw/zinc/95/32/85/1130953285.db2.gz MRYYNBCNXJXZOW-ZDUSSCGKSA-N 1 0 288.366 3.518 20 10 CHCDRO CCc1ccc([C@H](O)C[NH2+][C@@H](C)c2ccc(C)cc2O)cc1 ZINC000797027763 1130954011 /nfs/dbraw/zinc/95/40/11/1130954011.db2.gz VHCLCYLZTCMZDE-IFXJQAMLSA-N 1 0 299.414 3.647 20 10 CHCDRO CCc1ccc([C@@H](O)C[NH2+][C@@H](C)c2cc(C)ccc2O)cc1 ZINC000797027498 1130954375 /nfs/dbraw/zinc/95/43/75/1130954375.db2.gz UQAALQJVSDGIPB-LIRRHRJNSA-N 1 0 299.414 3.647 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H]2C=CCCCCC2)c1 ZINC000815083431 1130957351 /nfs/dbraw/zinc/95/73/51/1130957351.db2.gz YDVPXOCFQZHVTN-KGLIPLIRSA-N 1 0 275.392 3.940 20 10 CHCDRO Cc1ccc([C@H](O)[C@H](C)[NH2+][C@H](C)c2ccc(C)cc2O)cc1 ZINC000797061046 1130957798 /nfs/dbraw/zinc/95/77/98/1130957798.db2.gz MYYQTFOUSSLXFW-ZRGWGRIASA-N 1 0 299.414 3.782 20 10 CHCDRO C[C@H]([NH2+][C@H]1CSC[C@H]1C)c1cc2c(cc1O)CCCC2 ZINC000797066665 1130958990 /nfs/dbraw/zinc/95/89/90/1130958990.db2.gz UIRDSXAKLJYBLE-WQGACYEGSA-N 1 0 291.460 3.673 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CC[C@@H](C)F)cc1F ZINC000815148650 1130966870 /nfs/dbraw/zinc/96/68/70/1130966870.db2.gz CTXMHOBYSRMXPD-GFCCVEGCSA-N 1 0 270.367 3.510 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2c(F)cc(F)c(F)c2F)c1 ZINC000797467898 1130988979 /nfs/dbraw/zinc/98/89/79/1130988979.db2.gz BFSIEHNNQWRWDZ-UHFFFAOYSA-N 1 0 299.267 3.547 20 10 CHCDRO Cc1cnc(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)s1 ZINC000815583535 1131002695 /nfs/dbraw/zinc/00/26/95/1131002695.db2.gz IFHNJRYNQXTKHJ-LBPRGKRZSA-N 1 0 276.405 3.625 20 10 CHCDRO CCc1ccc(C[N@@H+]2CC[C@H](F)C(F)(F)CC2)c(O)c1 ZINC001236783276 1131005695 /nfs/dbraw/zinc/00/56/95/1131005695.db2.gz JOFIJURIRBJKTF-AWEZNQCLSA-N 1 0 287.325 3.524 20 10 CHCDRO CCc1ccc(C[N@@H+]2CCC[C@@H]2c2ccccn2)c(O)c1 ZINC001236790843 1131005785 /nfs/dbraw/zinc/00/57/85/1131005785.db2.gz YJITVLGDBYTUPO-QGZVFWFLSA-N 1 0 282.387 3.687 20 10 CHCDRO CCc1ccc(C[NH+]2CCc3ccccc3CC2)c(O)c1 ZINC001236786738 1131006341 /nfs/dbraw/zinc/00/63/41/1131006341.db2.gz HUSFOCXQTDJCBJ-UHFFFAOYSA-N 1 0 281.399 3.555 20 10 CHCDRO CCc1ccc(C[N@@H+]2Cc3ccccc3C[C@@H]2C)c(O)c1 ZINC001236789659 1131007227 /nfs/dbraw/zinc/00/72/27/1131007227.db2.gz CUELXOFGMMWPTP-AWEZNQCLSA-N 1 0 281.399 3.901 20 10 CHCDRO CCc1ccc(C[N@@H+]2CC[C@H]3CCC[C@@H]3C2)c(O)c1 ZINC001236786811 1131007339 /nfs/dbraw/zinc/00/73/39/1131007339.db2.gz PKRPRRZZAJEXSX-HUUCEWRRSA-N 1 0 259.393 3.577 20 10 CHCDRO CCc1ccc(C[N@@H+]2Cc3cccc(C)c3C2)c(O)c1 ZINC001236784026 1131007388 /nfs/dbraw/zinc/00/73/88/1131007388.db2.gz RDVMYLFJTCAMCL-UHFFFAOYSA-N 1 0 267.372 3.779 20 10 CHCDRO CCc1ccc(C[NH+]2CC3CCC(CC3)C2)c(O)c1 ZINC001236792975 1131008859 /nfs/dbraw/zinc/00/88/59/1131008859.db2.gz URARQRNGFXANEE-UHFFFAOYSA-N 1 0 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CHCDRO Cc1cccc(O)c1C[NH+]1CCC(Oc2ccccc2)CC1 ZINC001237484328 1131104474 /nfs/dbraw/zinc/10/44/74/1131104474.db2.gz BOVYFMSBXOZXGL-UHFFFAOYSA-N 1 0 297.398 3.744 20 10 CHCDRO Oc1c(C[NH2+]CCc2ccsc2)ccc2ccccc21 ZINC000816532300 1131105198 /nfs/dbraw/zinc/10/51/98/1131105198.db2.gz AJUVYESECCJTTC-UHFFFAOYSA-N 1 0 283.396 3.939 20 10 CHCDRO C[C@H]([NH2+]CCc1ccc2[nH]ccc2c1)c1ccccc1O ZINC000799728017 1131105443 /nfs/dbraw/zinc/10/54/43/1131105443.db2.gz DORJZTUYJLJSIA-ZDUSSCGKSA-N 1 0 280.371 3.767 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccc2[nH]ccc2c1)c1cc(F)ccc1O ZINC000799727863 1131105697 /nfs/dbraw/zinc/10/56/97/1131105697.db2.gz ARDNVVOCADGHHM-GFCCVEGCSA-N 1 0 298.361 3.906 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+]1CC[C@H]2CCCC[C@@H]2C1 ZINC001237496219 1131106647 /nfs/dbraw/zinc/10/66/47/1131106647.db2.gz XEKDFCDBZCNCBE-HUUCEWRRSA-N 1 0 259.393 3.713 20 10 CHCDRO Oc1cccc(C[NH2+]Cc2ccc3ccccc3c2O)c1 ZINC000816544631 1131106808 /nfs/dbraw/zinc/10/68/08/1131106808.db2.gz NUTRMSMPTZCQTF-UHFFFAOYSA-N 1 0 279.339 3.541 20 10 CHCDRO CC[C@@]1(C)C[N@H+](Cc2ccc3ccccc3c2O)CCO1 ZINC000816586312 1131108702 /nfs/dbraw/zinc/10/87/02/1131108702.db2.gz FMGMZTAVFODULA-SFHVURJKSA-N 1 0 285.387 3.546 20 10 CHCDRO C[C@@H](C[NH2+]Cc1ccc2ccccc2c1O)c1ccncc1 ZINC000816554590 1131110258 /nfs/dbraw/zinc/11/02/58/1131110258.db2.gz CPRPQIFDTBTQTP-AWEZNQCLSA-N 1 0 292.382 3.834 20 10 CHCDRO CC(C)C1C[NH+](Cc2ccc3ccccc3c2O)C1 ZINC000816594736 1131114253 /nfs/dbraw/zinc/11/42/53/1131114253.db2.gz NUBQJMMQUBTJHA-UHFFFAOYSA-N 1 0 255.361 3.633 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]C[C@@H](c1ccccc1)C1CC1 ZINC000816619175 1131116121 /nfs/dbraw/zinc/11/61/21/1131116121.db2.gz VOYRCSAZSVGZEG-KRWDZBQOSA-N 1 0 285.362 3.815 20 10 CHCDRO CC1(C)CC[C@@H]1[NH2+]Cc1ccc2ccccc2c1O ZINC000816610161 1131116598 /nfs/dbraw/zinc/11/65/98/1131116598.db2.gz ZXMNMHDGDNDKMH-HNNXBMFYSA-N 1 0 255.361 3.824 20 10 CHCDRO C[C@H]1C[N@H+](Cc2ccc(N3CCCCC3)cc2)[C@H]1C ZINC000816648340 1131119361 /nfs/dbraw/zinc/11/93/61/1131119361.db2.gz 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ZINC001238060621 1131166956 /nfs/dbraw/zinc/16/69/56/1131166956.db2.gz KOCJNEGCQYNDNG-UHFFFAOYSA-N 1 0 273.351 3.780 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]C[C@@H]1CC13CCSCC3)CC2 ZINC000817590624 1131175336 /nfs/dbraw/zinc/17/53/36/1131175336.db2.gz ZFXYGZBXRQYBNP-KBPBESRZSA-N 1 0 289.444 3.502 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccc(N)cc1)c1csc(Cl)c1 ZINC000817956662 1131190547 /nfs/dbraw/zinc/19/05/47/1131190547.db2.gz AALIYLIZROOCFW-SNVBAGLBSA-N 1 0 280.824 3.877 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccc(N)cc1)c1cccc(Cl)c1 ZINC000817956174 1131191066 /nfs/dbraw/zinc/19/10/66/1131191066.db2.gz SPPFGAVLNULKAN-GFCCVEGCSA-N 1 0 274.795 3.816 20 10 CHCDRO Cc1cccc2c1[C@H](C)C[C@H]2[NH2+]CCc1ccc(N)cc1 ZINC000817958175 1131191160 /nfs/dbraw/zinc/19/11/60/1131191160.db2.gz SQRNGPVLPYJPCX-RDTXWAMCSA-N 1 0 280.415 3.958 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccc(N)cc1)c1ccc(C)cc1O ZINC000817958857 1131191334 /nfs/dbraw/zinc/19/13/34/1131191334.db2.gz ZXGZDQFQGFTMAI-QGZVFWFLSA-N 1 0 284.403 3.566 20 10 CHCDRO C[C@H]([NH2+]CCc1ccc(N)cc1)c1cc(Cl)ccc1O ZINC000817958543 1131191393 /nfs/dbraw/zinc/19/13/93/1131191393.db2.gz XAZWMDXINYECOZ-NSHDSACASA-N 1 0 290.794 3.521 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)CCCC[NH3+])c1cccc(Cl)c1[O-] ZINC000817975788 1131193638 /nfs/dbraw/zinc/19/36/38/1131193638.db2.gz BNSRCXRDPLCGTO-SMDDNHRTSA-N 1 0 284.831 3.604 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]Cc1cccc3c1CCCN3)CC2 ZINC000817976055 1131193803 /nfs/dbraw/zinc/19/38/03/1131193803.db2.gz UOQIYTOCLSTAQB-KRWDZBQOSA-N 1 0 294.398 3.527 20 10 CHCDRO CC[C@@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1cccc(Cl)c1[O-] ZINC000817979772 1131194748 /nfs/dbraw/zinc/19/47/48/1131194748.db2.gz FCBOZYKVWGTIJU-SWLSCSKDSA-N 1 0 296.842 3.619 20 10 CHCDRO CCC[C@@H](C)C[NH2+]C[C@H]1CCN(c2ccc(OC)cc2)C1 ZINC000818221061 1131204994 /nfs/dbraw/zinc/20/49/94/1131204994.db2.gz KVZDKGMHQCVOAB-HZPDHXFCSA-N 1 0 290.451 3.547 20 10 CHCDRO COc1ccc(N2CC[C@H](C[NH2+]CCCC(C)C)C2)cc1 ZINC000818222861 1131205009 /nfs/dbraw/zinc/20/50/09/1131205009.db2.gz XJUHOOCOYDBPHN-MRXNPFEDSA-N 1 0 290.451 3.547 20 10 CHCDRO COc1ccc(N2CC[C@H](C[NH2+][C@H](C)C(C)(C)C)C2)cc1 ZINC000818341813 1131209474 /nfs/dbraw/zinc/20/94/74/1131209474.db2.gz GZIXXRLLLRFLQM-HUUCEWRRSA-N 1 0 290.451 3.546 20 10 CHCDRO CCCC[C@@H](C)[NH2+]C[C@@H]1CCN(c2ccc(OC)cc2)C1 ZINC000818344324 1131209951 /nfs/dbraw/zinc/20/99/51/1131209951.db2.gz LDOWUCRAAFSWRE-CVEARBPZSA-N 1 0 290.451 3.690 20 10 CHCDRO CCC[C@@H](CC)[NH2+]C[C@@H]1CCN(c2ccc(OC)cc2)C1 ZINC000818341567 1131210005 /nfs/dbraw/zinc/21/00/05/1131210005.db2.gz ARWDCADKUCOIML-JKSUJKDBSA-N 1 0 290.451 3.690 20 10 CHCDRO C[C@H]([NH2+][C@@H]1C[C@@]1(F)c1ccccc1)c1ccccc1O ZINC000818357241 1131211520 /nfs/dbraw/zinc/21/15/20/1131211520.db2.gz XEBLUOHDLWSGJN-JCURWCKSSA-N 1 0 271.335 3.680 20 10 CHCDRO Cc1cc(C[N@@H+]2C[C@@H]3C[C@@H]3C2)c(C)n1-c1ccccc1 ZINC001137855543 1131423918 /nfs/dbraw/zinc/42/39/18/1131423918.db2.gz AXRBQWOIFQVBTR-CALCHBBNSA-N 1 0 266.388 3.546 20 10 CHCDRO Cc1cc(C[N@@H+](C)[C@H]2CCCOC2)c(C)n1-c1ccccc1 ZINC001137859326 1131424944 /nfs/dbraw/zinc/42/49/44/1131424944.db2.gz TYRPVCASDHOTAN-IBGZPJMESA-N 1 0 298.430 3.705 20 10 CHCDRO CC(=O)[C@@H]1CCC[N@@H+]1Cc1cc(C)n(-c2ccccc2)c1C ZINC001137859085 1131425406 /nfs/dbraw/zinc/42/54/06/1131425406.db2.gz IFIOLXFZFLMEBX-IBGZPJMESA-N 1 0 296.414 3.648 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](Cc1ccccc1)OC)c1ccccc1O ZINC000824590762 1131476719 /nfs/dbraw/zinc/47/67/19/1131476719.db2.gz PJDMMTMOMWCRHD-WMZOPIPTSA-N 1 0 299.414 3.691 20 10 CHCDRO Cc1cccc(C[N@H+]2CC[C@H](C(F)(F)F)C[C@H]2C)c1O ZINC000824714730 1131480642 /nfs/dbraw/zinc/48/06/42/1131480642.db2.gz FGGQWGCJNZODJY-YPMHNXCESA-N 1 0 287.325 3.863 20 10 CHCDRO Cc1c(C[NH+]2C[C@H]3CCC[C@@H]3C2)c2ccccc2n1C ZINC001138252864 1131482561 /nfs/dbraw/zinc/48/25/61/1131482561.db2.gz XBLCNRRCEGWOPG-HUUCEWRRSA-N 1 0 268.404 3.719 20 10 CHCDRO CC[C@H]([NH2+]C[C@@](C)(OC)c1ccccc1)c1ccccc1O ZINC000824780329 1131484280 /nfs/dbraw/zinc/48/42/80/1131484280.db2.gz KMYRLARPSHJOKL-PKOBYXMFSA-N 1 0 299.414 3.995 20 10 CHCDRO CC[C@H]([NH2+]C[C@](C)(OC)c1ccccc1)c1ccccc1O ZINC000824780326 1131484312 /nfs/dbraw/zinc/48/43/12/1131484312.db2.gz KMYRLARPSHJOKL-HKUYNNGSSA-N 1 0 299.414 3.995 20 10 CHCDRO COc1cccc(C[N@@H+]2CC3(CCC3)[C@H]2c2ccco2)c1O ZINC000825103434 1131495813 /nfs/dbraw/zinc/49/58/13/1131495813.db2.gz FGEBBNMPTWMNBS-QGZVFWFLSA-N 1 0 299.370 3.721 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H](C)c2ccccn2)cc1Cl ZINC000825051072 1131495860 /nfs/dbraw/zinc/49/58/60/1131495860.db2.gz WUFPXMAATNGLPU-LLVKDONJSA-N 1 0 276.767 3.600 20 10 CHCDRO COc1ccc(C[NH2+]C2CCC(OC(F)F)CC2)cc1C ZINC000825144529 1131500429 /nfs/dbraw/zinc/50/04/29/1131500429.db2.gz OKSDHXWOANPJEH-UHFFFAOYSA-N 1 0 299.361 3.644 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc(Cl)c(C)cc1O)c1ccncc1 ZINC000825304410 1131505576 /nfs/dbraw/zinc/50/55/76/1131505576.db2.gz XFXLGAOXKDLORY-OAHLLOKOSA-N 1 0 290.794 3.990 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@@H](C)c2nccs2)cc1Cl ZINC000825509949 1131513914 /nfs/dbraw/zinc/51/39/14/1131513914.db2.gz SRVAZSAYXJFCLN-SNVBAGLBSA-N 1 0 296.823 3.704 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)CCCO2)[C@H]1CC1(C)C ZINC001202870777 1131555519 /nfs/dbraw/zinc/55/55/19/1131555519.db2.gz WYUVZEHNYMEWAL-HZPDHXFCSA-N 1 0 273.420 3.926 20 10 CHCDRO Cc1cc(C[N@@H+]2CCC[C@@]3(CC3(F)F)C2)ccc1N(C)C ZINC000844443689 1131566004 /nfs/dbraw/zinc/56/60/04/1131566004.db2.gz KYWQGYVTERAJIC-MRXNPFEDSA-N 1 0 294.389 3.682 20 10 CHCDRO CC[N@H+](Cc1cccc2c1ccn2C)Cc1ccccc1O ZINC001139160935 1131589138 /nfs/dbraw/zinc/58/91/38/1131589138.db2.gz ARDDQXPOEWITHR-UHFFFAOYSA-N 1 0 294.398 3.906 20 10 CHCDRO Cc1cc(C[N@H+]2CCC[C@H](C)[C@@H]2C)ccc1N(C)C ZINC001139672320 1131626474 /nfs/dbraw/zinc/62/64/74/1131626474.db2.gz VLUNCWMXBTYENT-ZFWWWQNUSA-N 1 0 260.425 3.681 20 10 CHCDRO Cc1cc(C[N@@H+]2CCC23CCCC3)ccc1N(C)C ZINC001139671150 1131626683 /nfs/dbraw/zinc/62/66/83/1131626683.db2.gz SNIVBDXMAOVGNM-UHFFFAOYSA-N 1 0 258.409 3.580 20 10 CHCDRO Cc1cc(C[N@@H+]2CCC[C@@H]3CCC[C@H]32)ccc1N(C)C ZINC001139672717 1131627168 /nfs/dbraw/zinc/62/71/68/1131627168.db2.gz CUAYIKDNPQKSMK-FUHWJXTLSA-N 1 0 272.436 3.826 20 10 CHCDRO Cc1cc(C[N@H+]2CCC[C@H]2C(C)C)ccc1N(C)C ZINC001139673163 1131627563 /nfs/dbraw/zinc/62/75/63/1131627563.db2.gz ATWHQSWPNSPCRZ-INIZCTEOSA-N 1 0 260.425 3.681 20 10 CHCDRO Cc1cc(C[N@H+]2C[C@H](C)C[C@H](C)C2)ccc1N(C)C ZINC001139673459 1131627655 /nfs/dbraw/zinc/62/76/55/1131627655.db2.gz RTHAWWWQNACBEJ-OKILXGFUSA-N 1 0 260.425 3.539 20 10 CHCDRO Cc1ccc(C)c(C[NH+]2CCC(c3ccccn3)CC2)c1O ZINC001140181719 1131673436 /nfs/dbraw/zinc/67/34/36/1131673436.db2.gz FCHYJHDWTVTDIV-UHFFFAOYSA-N 1 0 296.414 3.784 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCc3ccc(F)cc3C2)c1O ZINC001140182508 1131674080 /nfs/dbraw/zinc/67/40/80/1131674080.db2.gz TULOQKDKZZRUNT-UHFFFAOYSA-N 1 0 285.362 3.706 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2Cc3ccc(F)cc3C2)c1O ZINC001140182658 1131674437 /nfs/dbraw/zinc/67/44/37/1131674437.db2.gz WHHJTXZXGRUIDV-UHFFFAOYSA-N 1 0 271.335 3.664 20 10 CHCDRO CC[C@@H](OCC[NH2+]Cc1cccc(C)c1O)c1ccccc1 ZINC000846020525 1131678124 /nfs/dbraw/zinc/67/81/24/1131678124.db2.gz JUGXMPMRVUBQTF-GOSISDBHSA-N 1 0 299.414 3.958 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]CC1(c3ccccc3)CC1)CC2 ZINC000834501825 1131681014 /nfs/dbraw/zinc/68/10/14/1131681014.db2.gz KBURDYXUFHWWJH-MRXNPFEDSA-N 1 0 279.383 3.701 20 10 CHCDRO C[C@@]1(CC[NH2+]Cc2cc(Cl)ccc2O)C[C@]1(F)Cl ZINC000846036667 1131681598 /nfs/dbraw/zinc/68/15/98/1131681598.db2.gz NLYIBLYLXULRMR-CHWSQXEVSA-N 1 0 292.181 3.840 20 10 CHCDRO F[C@H]1CCC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000846122513 1131688882 /nfs/dbraw/zinc/68/88/82/1131688882.db2.gz NIODENSVNNBKMV-INIZCTEOSA-N 1 0 276.399 3.611 20 10 CHCDRO CCc1cccc(C[NH2+]Cc2c(O)cccc2Cl)c1 ZINC000846100648 1131689188 /nfs/dbraw/zinc/68/91/88/1131689188.db2.gz QVUDVUCPYMNVKX-UHFFFAOYSA-N 1 0 275.779 3.898 20 10 CHCDRO CCC[C@@H](CC)[NH2+][C@@H](C)c1cccc(OC)c1O ZINC000846149441 1131691235 /nfs/dbraw/zinc/69/12/35/1131691235.db2.gz NEEIZIUINBCMBE-NWDGAFQWSA-N 1 0 251.370 3.630 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H]2CC3CCC2CC3)c1O ZINC000846160091 1131692091 /nfs/dbraw/zinc/69/20/91/1131692091.db2.gz MROUAVXCCRWZJT-LFUGVXIPSA-N 1 0 275.392 3.630 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H]2CCCC2(C)C)c1O ZINC000846150506 1131692270 /nfs/dbraw/zinc/69/22/70/1131692270.db2.gz QNMHIUQBISUAEB-FZMZJTMJSA-N 1 0 263.381 3.630 20 10 CHCDRO CC[C@H](C)C[C@@H](C)[NH2+][C@H](C)c1cccc(OC)c1O ZINC000846155037 1131692271 /nfs/dbraw/zinc/69/22/71/1131692271.db2.gz OTQBOJYYBBXLPP-YNEHKIRRSA-N 1 0 265.397 3.876 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CC2(c3ccccc3)CC2)c1O ZINC000846139088 1131693677 /nfs/dbraw/zinc/69/36/77/1131693677.db2.gz PTCKRLZSJSGSCU-AWEZNQCLSA-N 1 0 297.398 3.783 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H]2CCc3ccccc32)c1O ZINC000846137580 1131693687 /nfs/dbraw/zinc/69/36/87/1131693687.db2.gz SLLQIYSJIBIBEE-BLLLJJGKSA-N 1 0 283.371 3.739 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CCC2CCCC2)c1O ZINC000846135277 1131694081 /nfs/dbraw/zinc/69/40/81/1131694081.db2.gz BRTHIYYPVTYBLR-GFCCVEGCSA-N 1 0 263.381 3.632 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@H](C)c2cnccc2C)c1O ZINC000846145893 1131694673 /nfs/dbraw/zinc/69/46/73/1131694673.db2.gz DHOPDBBFWHIKDK-CHWSQXEVSA-N 1 0 286.375 3.516 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H](C)c2cnccc2C)c1O ZINC000846145901 1131694827 /nfs/dbraw/zinc/69/48/27/1131694827.db2.gz DHOPDBBFWHIKDK-QWHCGFSZSA-N 1 0 286.375 3.516 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]C[C@H]2CCc3ccccc32)c1O ZINC000846144374 1131695071 /nfs/dbraw/zinc/69/50/71/1131695071.db2.gz IWSBZLPRCSQWQC-DZGCQCFKSA-N 1 0 297.398 3.781 20 10 CHCDRO C[C@H]([NH2+]C1(C2CCC2)CC1)c1ccc(N(C)C)cc1 ZINC000846206962 1131696126 /nfs/dbraw/zinc/69/61/26/1131696126.db2.gz JGOMHBAFPZWLDL-ZDUSSCGKSA-N 1 0 258.409 3.736 20 10 CHCDRO CCC[C@H](C)[C@@H](CO)[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000846183993 1131697117 /nfs/dbraw/zinc/69/71/17/1131697117.db2.gz LLPPMKUDFJFFQF-CWRNSKLLSA-N 1 0 279.424 3.538 20 10 CHCDRO Cc1ccc(C[NH+](C)C)cc1N[C@H]1CCc2cccc(O)c21 ZINC000834755603 1131702836 /nfs/dbraw/zinc/70/28/36/1131702836.db2.gz GSERHPAEHJDTRX-INIZCTEOSA-N 1 0 296.414 3.862 20 10 CHCDRO CC(C)C[C@@H]1OCCC[C@H]1[NH2+][C@H]1CCc2cccc(O)c21 ZINC000834769404 1131704267 /nfs/dbraw/zinc/70/42/67/1131704267.db2.gz MPQVSGIBSZBBTC-VYDXJSESSA-N 1 0 289.419 3.563 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]CCCc1ccccc1F)CC2 ZINC000834790594 1131705359 /nfs/dbraw/zinc/70/53/59/1131705359.db2.gz STEMGNKTEUQWAR-MRXNPFEDSA-N 1 0 285.362 3.741 20 10 CHCDRO CC[C@H]([NH2+]CCCC1CCOCC1)c1ccc(C)cc1O ZINC000834818856 1131707485 /nfs/dbraw/zinc/70/74/85/1131707485.db2.gz QFHKTCWGXNJXCP-KRWDZBQOSA-N 1 0 291.435 3.948 20 10 CHCDRO CCC[C@@H](C[NH2+][C@H](C)c1cc(Cl)ccc1O)OC ZINC000834841760 1131711331 /nfs/dbraw/zinc/71/13/31/1131711331.db2.gz ZVCAVGAIRICZDC-PWSUYJOCSA-N 1 0 271.788 3.511 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccnc(C)c1)c1cc(Cl)ccc1O ZINC000834860114 1131713097 /nfs/dbraw/zinc/71/30/97/1131713097.db2.gz ONBJDOZUHBUXHB-OAHLLOKOSA-N 1 0 290.794 3.990 20 10 CHCDRO Cc1cc(C[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)ccn1 ZINC000834860927 1131713860 /nfs/dbraw/zinc/71/38/60/1131713860.db2.gz VOQALEVMSBBVQP-GFCCVEGCSA-N 1 0 290.794 3.908 20 10 CHCDRO C[C@@]1(C[NH2+][C@H]2CCc3cccc(O)c32)CC1(Cl)Cl ZINC000834884049 1131717800 /nfs/dbraw/zinc/71/78/00/1131717800.db2.gz IRVJOGHYFHNFAC-GWCFXTLKSA-N 1 0 286.202 3.553 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2cnccc2C)c(O)c1C ZINC000834887756 1131719495 /nfs/dbraw/zinc/71/94/95/1131719495.db2.gz LVLWRRWMXXQWJE-CQSZACIVSA-N 1 0 270.376 3.563 20 10 CHCDRO CCn1ccnc1[C@H](C)[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000834893298 1131720700 /nfs/dbraw/zinc/72/07/00/1131720700.db2.gz FHOBCAYPTALJMO-QWRGUYRKSA-N 1 0 293.798 3.674 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1C[C@H](C)n2ccnc21)c1ccc(N(C)C)cc1 ZINC000834897580 1131721510 /nfs/dbraw/zinc/72/15/10/1131721510.db2.gz UQFYEPDNMQAGCR-RRQGHBQHSA-N 1 0 298.434 3.696 20 10 CHCDRO CCc1ncc(C[NH2+][C@@H](C)c2ccc(N(C)CC)cc2)o1 ZINC000834900438 1131725192 /nfs/dbraw/zinc/72/51/92/1131725192.db2.gz PUURUWCJQJTCAX-ZDUSSCGKSA-N 1 0 287.407 3.544 20 10 CHCDRO CC[C@H]([NH2+]CC(C)(C)C(C)(C)O)c1ccc(N(C)C)cc1 ZINC000834904602 1131727084 /nfs/dbraw/zinc/72/70/84/1131727084.db2.gz ZRPMMWDULKVXAN-INIZCTEOSA-N 1 0 292.467 3.590 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CCC[C@@H]2CCOC2)cc1 ZINC000834905971 1131729053 /nfs/dbraw/zinc/72/90/53/1131729053.db2.gz VOYNKDFUYZWDFV-JKSUJKDBSA-N 1 0 290.451 3.610 20 10 CHCDRO COCC1(C[NH2+][C@H](C)c2cc(C)ccc2O)CCCC1 ZINC000834906271 1131729274 /nfs/dbraw/zinc/72/92/74/1131729274.db2.gz NUHKAAKNNBIGDY-CQSZACIVSA-N 1 0 277.408 3.558 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H]2CCOC(C)(C)C2)c(O)c1 ZINC000834908202 1131730826 /nfs/dbraw/zinc/73/08/26/1131730826.db2.gz BTUWYVZZPFIKEU-LSDHHAIUSA-N 1 0 291.435 3.865 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CCOC(C)(C)C2)c1 ZINC000834909962 1131731406 /nfs/dbraw/zinc/73/14/06/1131731406.db2.gz MUBFYVXZWIFQPG-KGLIPLIRSA-N 1 0 277.408 3.556 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCOC(C)(C)C2)c1 ZINC000834909958 1131732151 /nfs/dbraw/zinc/73/21/51/1131732151.db2.gz MUBFYVXZWIFQPG-KBPBESRZSA-N 1 0 277.408 3.556 20 10 CHCDRO Oc1cc(Cl)ccc1C[NH+]1CC2CCC(CC2)C1 ZINC001140465850 1131750117 /nfs/dbraw/zinc/75/01/17/1131750117.db2.gz SBIRHFPVQBTFNJ-UHFFFAOYSA-N 1 0 265.784 3.668 20 10 CHCDRO Oc1cc(Cl)ccc1C[N@@H+]1CCC[C@@H]2CCC[C@@H]21 ZINC001140465428 1131750229 /nfs/dbraw/zinc/75/02/29/1131750229.db2.gz NAGBPWHMYKRBBB-FZMZJTMJSA-N 1 0 265.784 3.810 20 10 CHCDRO C[C@H](Cc1ccco1)[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC000835036639 1131760979 /nfs/dbraw/zinc/76/09/79/1131760979.db2.gz PSMNLMIZQNZCMZ-CSPWOOARSA-N 1 0 284.403 3.580 20 10 CHCDRO C[C@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)c1cccc(O)c1 ZINC000835037362 1131761383 /nfs/dbraw/zinc/76/13/83/1131761383.db2.gz JOSLACMSESLQPK-NFAHFFEMSA-N 1 0 296.414 3.822 20 10 CHCDRO C[C@@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)c1cccnc1 ZINC000835036718 1131761682 /nfs/dbraw/zinc/76/16/82/1131761682.db2.gz QMLDXOOEVKCNNM-ZDTYVGOBSA-N 1 0 281.403 3.512 20 10 CHCDRO Cc1ccncc1[C@@H](C)[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC000835042205 1131762382 /nfs/dbraw/zinc/76/23/82/1131762382.db2.gz FBQIMIPXEBBQQN-OGZRUICASA-N 1 0 295.430 3.820 20 10 CHCDRO C[C@@H](c1ccccn1)[N@H+](C)C/C=C/c1ccc(N(C)C)cc1 ZINC000835043621 1131762472 /nfs/dbraw/zinc/76/24/72/1131762472.db2.gz ADNRAIJETNOKQX-WAVCKPEOSA-N 1 0 295.430 3.854 20 10 CHCDRO Cc1ccncc1[C@H](C)[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC000835042201 1131762572 /nfs/dbraw/zinc/76/25/72/1131762572.db2.gz FBQIMIPXEBBQQN-JFDDCEBESA-N 1 0 295.430 3.820 20 10 CHCDRO C[C@H](C[NH2+]C/C=C/c1ccc(N(C)C)cc1)c1ccncc1 ZINC000835043903 1131763057 /nfs/dbraw/zinc/76/30/57/1131763057.db2.gz VTIGGJCHXKKWDS-DWTRPJMMSA-N 1 0 295.430 3.554 20 10 CHCDRO C[C@H]1CC[N@H+](C/C=C/c2ccc(N(C)C)cc2)CCS1 ZINC000835049787 1131765300 /nfs/dbraw/zinc/76/53/00/1131765300.db2.gz STKOCIBOBBUGLU-RGDDUWESSA-N 1 0 290.476 3.593 20 10 CHCDRO Cc1ccncc1C[N@@H+](C)C/C=C\c1ccc(N(C)C)cc1 ZINC000835051085 1131766184 /nfs/dbraw/zinc/76/61/84/1131766184.db2.gz CDOPRNWTPCUROO-WAYWQWQTSA-N 1 0 295.430 3.601 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+][C@@H]2CCC2(C)C)cc1 ZINC000835052593 1131766692 /nfs/dbraw/zinc/76/66/92/1131766692.db2.gz GXOGBVHYDZSGBI-OGZRUICASA-N 1 0 258.409 3.544 20 10 CHCDRO CN(C)c1ccc(O[C@@H](CC[NH+](C)C)c2ccccc2)cc1 ZINC001227939465 1131772055 /nfs/dbraw/zinc/77/20/55/1131772055.db2.gz WMBSCUNCNSKIQH-IBGZPJMESA-N 1 0 298.430 3.824 20 10 CHCDRO CN(C)c1ccc(OC2CC(C)(C)[NH+](C)C(C)(C)C2)cc1 ZINC001227939472 1131772989 /nfs/dbraw/zinc/77/29/89/1131772989.db2.gz WRDZNLAGCAYFPR-UHFFFAOYSA-N 1 0 290.451 3.783 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2C[C@H]2CC(C)(C)C)cc1C ZINC001203048279 1131799207 /nfs/dbraw/zinc/79/92/07/1131799207.db2.gz KYUUWGRSQHEPST-LSDHHAIUSA-N 1 0 261.409 3.918 20 10 CHCDRO COc1ccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)c(C)c2)cc1 ZINC000772999436 1131913683 /nfs/dbraw/zinc/91/36/83/1131913683.db2.gz LDAOPIURUPHKLY-OAHLLOKOSA-N 1 0 298.430 3.920 20 10 CHCDRO C[C@H]1c2ccccc2C[C@H]1[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001203067334 1131922338 /nfs/dbraw/zinc/92/23/38/1131922338.db2.gz FGVBXYIQHVVQKE-IFXJQAMLSA-N 1 0 293.410 3.830 20 10 CHCDRO CC[C@@H]([NH2+][C@H](CO)CC(C)(C)C)c1ccc(N(C)C)cc1 ZINC000773076934 1131936987 /nfs/dbraw/zinc/93/69/87/1131936987.db2.gz PJEJCDHRNYVWOK-DOTOQJQBSA-N 1 0 292.467 3.590 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)C1CCC1)c1ccc(N(C)C)cc1 ZINC000773102067 1131946163 /nfs/dbraw/zinc/94/61/63/1131946163.db2.gz FLGJCKREUJYDOY-GUYCJALGSA-N 1 0 260.425 3.982 20 10 CHCDRO CCN(CC)c1ccc(C[NH+]2CCC(C)(C)CC2)c(O)c1 ZINC001140854982 1131947980 /nfs/dbraw/zinc/94/79/80/1131947980.db2.gz IMGJCBKSCARRTP-UHFFFAOYSA-N 1 0 290.451 3.860 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@H](C)[C@H]2C)c(O)c1 ZINC001140855228 1131948148 /nfs/dbraw/zinc/94/81/48/1131948148.db2.gz SKADXVOFYZGION-LSDHHAIUSA-N 1 0 290.451 3.859 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCC3(CCC3)C2)c(O)c1 ZINC001140856203 1131949549 /nfs/dbraw/zinc/94/95/49/1131949549.db2.gz TTYJSYOIIQKHFZ-UHFFFAOYSA-N 1 0 288.435 3.614 20 10 CHCDRO CN(C)c1ccc(C[NH+]2CCC(CF)CC2)c(Cl)c1 ZINC001140924668 1131965124 /nfs/dbraw/zinc/96/51/24/1131965124.db2.gz LMOQLKZYBUWBBR-UHFFFAOYSA-N 1 0 284.806 3.588 20 10 CHCDRO Cc1ccc(C[N@@H+]2CC[C@@H](c3ccccc3F)C2)c(O)c1 ZINC001140950210 1131970124 /nfs/dbraw/zinc/97/01/24/1131970124.db2.gz VRILDJFXBBJDGN-CQSZACIVSA-N 1 0 285.362 3.829 20 10 CHCDRO Cc1ccc(C[NH+]2CCC(c3ccc(O)cc3)CC2)c(O)c1 ZINC001140957699 1131973344 /nfs/dbraw/zinc/97/33/44/1131973344.db2.gz JUMZGLTYDQKEAO-UHFFFAOYSA-N 1 0 297.398 3.786 20 10 CHCDRO CC(C)C1CC([NH2+]Cc2cc(Cl)ccc2O)C1 ZINC000714640233 1131974652 /nfs/dbraw/zinc/97/46/52/1131974652.db2.gz CGBPKYBKBKFYNB-UHFFFAOYSA-N 1 0 253.773 3.570 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]CCc1cccc(F)c1 ZINC000036778677 1131974895 /nfs/dbraw/zinc/97/48/95/1131974895.db2.gz SVFZADCFCNLRDT-UHFFFAOYSA-N 1 0 279.742 3.517 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)Cc1ccco1)c1ccccc1O ZINC000036993588 1131985844 /nfs/dbraw/zinc/98/58/44/1131985844.db2.gz WUNCNCKKLKQFEO-SWLSCSKDSA-N 1 0 259.349 3.657 20 10 CHCDRO CC[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc2c(c1)CCO2 ZINC000037363321 1132031087 /nfs/dbraw/zinc/03/10/87/1132031087.db2.gz KQMFJXMIXSBONM-ZBFHGGJFSA-N 1 0 259.393 3.680 20 10 CHCDRO CCc1ccccc1C[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001141229176 1132052358 /nfs/dbraw/zinc/05/23/58/1132052358.db2.gz MAFPCTVUXPQULE-UHFFFAOYSA-N 1 0 282.431 3.947 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H]2CSc3ccccc3C2)c1O ZINC001172205387 1132141458 /nfs/dbraw/zinc/14/14/58/1132141458.db2.gz VUKUCIRDFFRXIY-HNNXBMFYSA-N 1 0 285.412 3.507 20 10 CHCDRO CC[C@@H](C)OCC[C@@H](C)[NH2+]Cc1ccc(OC)c(C)c1 ZINC001172322197 1132159257 /nfs/dbraw/zinc/15/92/57/1132159257.db2.gz ARYXDEHGUBATRW-HUUCEWRRSA-N 1 0 279.424 3.687 20 10 CHCDRO CCOc1ccc(O)c(C[NH+]2CC3(C2)CCCCC3)c1 ZINC000839131888 1132182838 /nfs/dbraw/zinc/18/28/38/1132182838.db2.gz GGQMJPQFMVJIAC-UHFFFAOYSA-N 1 0 275.392 3.557 20 10 CHCDRO C[N@H+](Cc1cccc(Cl)c1[O-])C1CC(C)(C)C1 ZINC000839183763 1132188346 /nfs/dbraw/zinc/18/83/46/1132188346.db2.gz BRCKGYIDBLAFBI-UHFFFAOYSA-N 1 0 253.773 3.666 20 10 CHCDRO CCOCC[C@@H](C)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC001172407355 1132198424 /nfs/dbraw/zinc/19/84/24/1132198424.db2.gz AQNVFWXEIDKDDP-MRXNPFEDSA-N 1 0 290.451 3.582 20 10 CHCDRO CCOCC[C@H](C)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC001172407354 1132198544 /nfs/dbraw/zinc/19/85/44/1132198544.db2.gz AQNVFWXEIDKDDP-INIZCTEOSA-N 1 0 290.451 3.582 20 10 CHCDRO C[C@H]([NH2+]CC[C@H](O)c1ccccc1)c1ccc(N(C)C)cc1 ZINC000839563852 1132223282 /nfs/dbraw/zinc/22/32/82/1132223282.db2.gz PEBVMBGJJWIHPA-KXBFYZLASA-N 1 0 298.430 3.527 20 10 CHCDRO CC[C@H]([NH2+]C1CCC(OC)CC1)c1ccc(N(C)C)cc1 ZINC000840791786 1132287407 /nfs/dbraw/zinc/28/74/07/1132287407.db2.gz BTKXMUQXMWNZNP-VJFUWPCTSA-N 1 0 290.451 3.751 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1C[C@H]1c1ccccc1F)c1cc(F)ccc1O ZINC000840788791 1132288060 /nfs/dbraw/zinc/28/80/60/1132288060.db2.gz TUBSCVGNNAPDBU-FUEDEBDSSA-N 1 0 289.325 3.877 20 10 CHCDRO COC1CCC([NH2+][C@H](C)c2cc(Cl)cc(C)c2O)CC1 ZINC000840792427 1132288108 /nfs/dbraw/zinc/28/81/08/1132288108.db2.gz LFOPTAPQHXQZPU-LMWSTFAQSA-N 1 0 297.826 3.962 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC(C)(C)OCC2CC2)c(O)c1C ZINC000840877066 1132300579 /nfs/dbraw/zinc/30/05/79/1132300579.db2.gz SKXFJOOFVHPMAR-AWEZNQCLSA-N 1 0 291.435 3.865 20 10 CHCDRO COCC1CCC([NH2+][C@H](C)c2cc(C)ccc2O)CC1 ZINC000840879331 1132301187 /nfs/dbraw/zinc/30/11/87/1132301187.db2.gz DWPNJGBBZXQLJG-WLYUNCDWSA-N 1 0 277.408 3.556 20 10 CHCDRO CCC1(C[NH2+]Cc2c(O)cc(C)cc2Cl)CCOCC1 ZINC000840902132 1132305847 /nfs/dbraw/zinc/30/58/47/1132305847.db2.gz NCWGZODHZGUBSW-UHFFFAOYSA-N 1 0 297.826 3.650 20 10 CHCDRO Cc1cc(O)c(C[NH+]2CCC(C(F)F)CC2)c(Cl)c1 ZINC000840917028 1132306943 /nfs/dbraw/zinc/30/69/43/1132306943.db2.gz FLNZNHSQGIGSME-UHFFFAOYSA-N 1 0 289.753 3.831 20 10 CHCDRO Cc1cc(N(C)C)ccc1CNc1ccc(C[NH+](C)C)cc1 ZINC000840922485 1132309755 /nfs/dbraw/zinc/30/97/55/1132309755.db2.gz JHHUHAPRQRIFKI-UHFFFAOYSA-N 1 0 297.446 3.735 20 10 CHCDRO Cc1ccc(C(C)(C)[NH2+]Cc2ccc(N(C)C)cc2C)cn1 ZINC000840939814 1132310010 /nfs/dbraw/zinc/31/00/10/1132310010.db2.gz RHTDNMZYMGZIMQ-UHFFFAOYSA-N 1 0 297.446 3.789 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+](C)[C@H](C)c1cccc(O)c1 ZINC000840918459 1132310320 /nfs/dbraw/zinc/31/03/20/1132310320.db2.gz UDFFULFFMQBHEE-OAHLLOKOSA-N 1 0 298.430 3.960 20 10 CHCDRO COC[C@H]1CCCC[N@H+](Cc2c(O)cc(C)cc2Cl)C1 ZINC000840938177 1132310556 /nfs/dbraw/zinc/31/05/56/1132310556.db2.gz LPAAESJIJODXRC-ZDUSSCGKSA-N 1 0 297.826 3.603 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC(F)(F)[C@H](C)C2)c(Cl)c1 ZINC000840946859 1132311639 /nfs/dbraw/zinc/31/16/39/1132311639.db2.gz PPSDWZPNIHYAJV-SNVBAGLBSA-N 1 0 289.753 3.831 20 10 CHCDRO COc1ccc(C[NH2+]Cc2cnccc2C(C)(C)C)cc1C ZINC000840959361 1132313125 /nfs/dbraw/zinc/31/31/25/1132313125.db2.gz RBISEQAFOMORIV-UHFFFAOYSA-N 1 0 298.430 3.986 20 10 CHCDRO C[C@@H](C[NH2+]Cc1ccc(N(C)C)c(F)c1)CC(F)(F)F ZINC000840962393 1132314201 /nfs/dbraw/zinc/31/42/01/1132314201.db2.gz AJDGAWMRKJZDMA-SNVBAGLBSA-N 1 0 292.320 3.570 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2c(O)ccc3ccccc32)CC[C@]1(C)O ZINC001231587457 1132317177 /nfs/dbraw/zinc/31/71/77/1132317177.db2.gz CLLFOENVRJMTDX-KUHUBIRLSA-N 1 0 299.414 3.528 20 10 CHCDRO C[C@@]1(F)CC[N@H+](Cc2c(O)ccc3ccccc32)C[C@H]1F ZINC001231587626 1132317684 /nfs/dbraw/zinc/31/76/84/1132317684.db2.gz WSISTPCOUCEPBE-IAGOWNOFSA-N 1 0 291.341 3.817 20 10 CHCDRO C[C@@]1(CO)CCC[N@H+](Cc2c(O)ccc3ccccc32)CC1 ZINC001231587483 1132318321 /nfs/dbraw/zinc/31/83/21/1132318321.db2.gz CZIVWDIOVFIVQK-LJQANCHMSA-N 1 0 299.414 3.530 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2c(O)ccc3ccccc32)cn1 ZINC001231589065 1132319716 /nfs/dbraw/zinc/31/97/16/1132319716.db2.gz BZHVIZPDTLNOPF-UHFFFAOYSA-N 1 0 292.382 3.881 20 10 CHCDRO C[C@H]1CC(C)(C)CC[C@H]1[NH2+]CCc1ccc(N)cc1 ZINC000841033862 1132321873 /nfs/dbraw/zinc/32/18/73/1132321873.db2.gz CKEZWLVZQALQFX-XJKSGUPXSA-N 1 0 260.425 3.616 20 10 CHCDRO Cc1cccc(C[N@H+]2CC[C@@H](Oc3ccccc3C)C2)c1O ZINC001231593332 1132321872 /nfs/dbraw/zinc/32/18/72/1132321872.db2.gz UMOYMPFOEDIFQB-QGZVFWFLSA-N 1 0 297.398 3.662 20 10 CHCDRO Nc1ccc(CC[NH2+][C@H]2CCC[C@H]2c2ccc(F)cc2)cc1 ZINC000841034609 1132322146 /nfs/dbraw/zinc/32/21/46/1132322146.db2.gz IDWTWYRUZOZVPX-OALUTQOASA-N 1 0 298.405 3.876 20 10 CHCDRO C[C@@H](C[NH2+]CCc1ccc(N)cc1)c1cccc(Cl)c1 ZINC000841038631 1132322529 /nfs/dbraw/zinc/32/25/29/1132322529.db2.gz MNDYYLLQPQDVON-ZDUSSCGKSA-N 1 0 288.822 3.858 20 10 CHCDRO CCc1oc2ccccc2c1C[NH2+]CCc1ccc(N)cc1 ZINC000841037509 1132322693 /nfs/dbraw/zinc/32/26/93/1132322693.db2.gz UJUNDABYVXVUGP-UHFFFAOYSA-N 1 0 294.398 3.910 20 10 CHCDRO Nc1ccc(CC[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2)cc1 ZINC000841037064 1132322983 /nfs/dbraw/zinc/32/29/83/1132322983.db2.gz YDYFFKLMRDZJGL-AZUAARDMSA-N 1 0 294.442 3.812 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C[C@@H](N)c2ccc(C(C)C)cc2)c1 ZINC000841037390 1132323286 /nfs/dbraw/zinc/32/32/86/1132323286.db2.gz PFFWWIWWJWLQQV-GOSISDBHSA-N 1 0 298.430 3.614 20 10 CHCDRO CCC[C@@H](C[NH2+]CCc1ccc(N)cc1)c1ccccc1 ZINC000841036513 1132323374 /nfs/dbraw/zinc/32/33/74/1132323374.db2.gz UBLBBYODXUBZHU-SFHVURJKSA-N 1 0 282.431 3.985 20 10 CHCDRO CCN(CC)c1ccc(CNc2cccc(C[NH2+]C)c2)cc1 ZINC000841042020 1132324029 /nfs/dbraw/zinc/32/40/29/1132324029.db2.gz CYMUCDOHQNKGBY-UHFFFAOYSA-N 1 0 297.446 3.864 20 10 CHCDRO CC[NH2+]Cc1ccccc1NCc1ccc(N(C)C)cc1C ZINC000841044237 1132324509 /nfs/dbraw/zinc/32/45/09/1132324509.db2.gz XYDINFAPLRLYPL-UHFFFAOYSA-N 1 0 297.446 3.783 20 10 CHCDRO C[NH2+]Cc1ccccc1NCc1cc(Cl)cc(C)c1O ZINC000841043466 1132325037 /nfs/dbraw/zinc/32/50/37/1132325037.db2.gz QLIPZOFGPKYGNO-UHFFFAOYSA-N 1 0 290.794 3.686 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2Cc3cccc(C)c3C2)c(O)c1 ZINC001231843421 1132375804 /nfs/dbraw/zinc/37/58/04/1132375804.db2.gz YQDXIZQFURTVSK-UHFFFAOYSA-N 1 0 267.372 3.833 20 10 CHCDRO COc1ccc2c(c1)CC[N@@H+](Cc1c(C)cc(C)cc1O)C2 ZINC001231842469 1132375908 /nfs/dbraw/zinc/37/59/08/1132375908.db2.gz NAXDHVMKEYBBTL-UHFFFAOYSA-N 1 0 297.398 3.576 20 10 CHCDRO COc1cccc2c1CC[N@H+](Cc1c(C)cc(C)cc1O)C2 ZINC001231849957 1132377728 /nfs/dbraw/zinc/37/77/28/1132377728.db2.gz XYJWUSDYDQLCIH-UHFFFAOYSA-N 1 0 297.398 3.576 20 10 CHCDRO Cc1cc(C)c(C[N@H+]2Cc3ccccc3C[C@@H]2C)c(O)c1 ZINC001231849943 1132379031 /nfs/dbraw/zinc/37/90/31/1132379031.db2.gz XFFHRWRUHWFFPQ-HNNXBMFYSA-N 1 0 281.399 3.956 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCOC3(CCCCC3)C2)c(O)c1 ZINC001231850024 1132379950 /nfs/dbraw/zinc/37/99/50/1132379950.db2.gz YVUIOODMZIZNNP-UHFFFAOYSA-N 1 0 289.419 3.544 20 10 CHCDRO COCC[C@@H]1CCCC[N@@H+]1Cc1cc(Cl)c(C)cc1O ZINC001231870804 1132383185 /nfs/dbraw/zinc/38/31/85/1132383185.db2.gz UTRSHPHHPWRDPH-AWEZNQCLSA-N 1 0 297.826 3.745 20 10 CHCDRO Cc1ccc(CC[NH2+][C@@H](C)c2ccc(Cl)cc2O)o1 ZINC000841743504 1132386803 /nfs/dbraw/zinc/38/68/03/1132386803.db2.gz AGJOVDLIKNUWBA-NSHDSACASA-N 1 0 279.767 3.840 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)c1cccnc1 ZINC000841743429 1132388412 /nfs/dbraw/zinc/38/84/12/1132388412.db2.gz GFZDCCWMDQNEOX-QWRGUYRKSA-N 1 0 276.767 3.852 20 10 CHCDRO CC1(F)CC[NH+](Cc2ccc3ccccc3c2O)CC1 ZINC001231879287 1132389697 /nfs/dbraw/zinc/38/96/97/1132389697.db2.gz BGOYKUXPIPFIKU-UHFFFAOYSA-N 1 0 273.351 3.869 20 10 CHCDRO Oc1c(C[N@@H+]2CC[C@H]3CCCO[C@H]3C2)ccc2ccccc21 ZINC001231879348 1132389746 /nfs/dbraw/zinc/38/97/46/1132389746.db2.gz CGPTXAFTCKNZNF-QAPCUYQASA-N 1 0 297.398 3.546 20 10 CHCDRO Cc1ncsc1C[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841746652 1132390023 /nfs/dbraw/zinc/39/00/23/1132390023.db2.gz JSNKQEWVSPAGHJ-QMMMGPOBSA-N 1 0 282.796 3.661 20 10 CHCDRO Cc1cc(C)c(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)cn1 ZINC000841753209 1132391799 /nfs/dbraw/zinc/39/17/99/1132391799.db2.gz DVSWETIRKZNEHW-LBPRGKRZSA-N 1 0 290.794 3.908 20 10 CHCDRO C[C@H]1CCCC[N@@H+]1Cc1ccc2ccccc2c1O ZINC001231878779 1132391958 /nfs/dbraw/zinc/39/19/58/1132391958.db2.gz SXFBSPQGZWLCIS-ZDUSSCGKSA-N 1 0 255.361 3.920 20 10 CHCDRO CO[C@H]1CCCC[C@@H]1[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841752886 1132392221 /nfs/dbraw/zinc/39/22/21/1132392221.db2.gz QZDPWMUPBIIPQV-XEGUGMAKSA-N 1 0 283.799 3.654 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](CO)CC2CCCCC2)c1 ZINC000841762217 1132396568 /nfs/dbraw/zinc/39/65/68/1132396568.db2.gz NWQLRMNWHHMIHA-HOCLYGCPSA-N 1 0 291.435 3.683 20 10 CHCDRO COc1cccc2[nH]cc(C[N@H+](C)Cc3ccccc3O)c21 ZINC001232036925 1132413157 /nfs/dbraw/zinc/41/31/57/1132413157.db2.gz AQOGOUKIMBAOGJ-UHFFFAOYSA-N 1 0 296.370 3.514 20 10 CHCDRO CCc1ccc(C[C@@H](C)[NH2+]Cc2ccccc2O)cc1 ZINC001173236615 1132415597 /nfs/dbraw/zinc/41/55/97/1132415597.db2.gz BADXBPXSOIQQDP-CQSZACIVSA-N 1 0 269.388 3.675 20 10 CHCDRO COc1cc(O)c(C[NH+]2CCC(C)(C)CC2)cc1Cl ZINC001232263898 1132445438 /nfs/dbraw/zinc/44/54/38/1132445438.db2.gz BTLUWGOGYVEHMH-UHFFFAOYSA-N 1 0 283.799 3.676 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CCCC[C@@H](C)C2)cc1Cl ZINC001232266210 1132447345 /nfs/dbraw/zinc/44/73/45/1132447345.db2.gz KNPSUARFZRQZRS-LLVKDONJSA-N 1 0 283.799 3.676 20 10 CHCDRO CCCC[N@H+](CC)Cc1cc(Cl)c(OC)cc1O ZINC001232266495 1132447788 /nfs/dbraw/zinc/44/77/88/1132447788.db2.gz VFMFWWWVICEMQN-UHFFFAOYSA-N 1 0 271.788 3.676 20 10 CHCDRO CN1CCCc2cc(C[NH2+]C3CCC(F)(F)CC3)ccc21 ZINC000842672785 1132449651 /nfs/dbraw/zinc/44/96/51/1132449651.db2.gz BPXYVYOARHXJJF-UHFFFAOYSA-N 1 0 294.389 3.737 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CC2CCC(F)CC2)cc1C ZINC000842777242 1132460878 /nfs/dbraw/zinc/46/08/78/1132460878.db2.gz AGIYHYYQTBZRPN-UHFFFAOYSA-N 1 0 265.372 3.627 20 10 CHCDRO Cc1c(F)cc(C[N@@H+]2CCc3cccc(O)c3C2)cc1F ZINC001232422916 1132469125 /nfs/dbraw/zinc/46/91/25/1132469125.db2.gz FRTAIJOAIPEPGW-UHFFFAOYSA-N 1 0 289.325 3.537 20 10 CHCDRO C[C@@H](C[NH2+][C@H](C)c1cc(Cl)ccc1O)CC(F)F ZINC000842889896 1132474649 /nfs/dbraw/zinc/47/46/49/1132474649.db2.gz IHQGFFBBGPGGLU-RKDXNWHRSA-N 1 0 277.742 3.988 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CC[C@@H]3C[C@@H]3C2)c(O)c1 ZINC000842929582 1132477166 /nfs/dbraw/zinc/47/71/66/1132477166.db2.gz PFLDLTFKZIZWEK-GBJTYRQASA-N 1 0 259.393 3.848 20 10 CHCDRO CC(C)(C)c1cccc(C[NH+]2CCC(CF)CC2)c1O ZINC001143111147 1132503991 /nfs/dbraw/zinc/50/39/91/1132503991.db2.gz ZDYMGBOXSNGYAA-UHFFFAOYSA-N 1 0 279.399 3.871 20 10 CHCDRO CCc1ccc(C[N@H+](C)Cc2ccc(N(C)C)cc2O)cc1 ZINC001232840388 1132528624 /nfs/dbraw/zinc/52/86/24/1132528624.db2.gz WACUIGZAPUKNRK-UHFFFAOYSA-N 1 0 298.430 3.653 20 10 CHCDRO CC1(CC(F)F)C[NH+](Cc2cc(Cl)ccc2O)C1 ZINC000843424656 1132532675 /nfs/dbraw/zinc/53/26/75/1132532675.db2.gz FSGPKUDDULFMKZ-UHFFFAOYSA-N 1 0 275.726 3.523 20 10 CHCDRO C[C@@H]1C[C@H](F)C[N@@H+]1Cc1cc(C(C)(C)C)ccc1O ZINC001233284490 1132594852 /nfs/dbraw/zinc/59/48/52/1132594852.db2.gz WZEFHPWXAFYIOL-RISCZKNCSA-N 1 0 265.372 3.622 20 10 CHCDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CCc3cccnc3C2)c1 ZINC001233286656 1132595869 /nfs/dbraw/zinc/59/58/69/1132595869.db2.gz DDTWTQGMYNCQRZ-UHFFFAOYSA-N 1 0 296.414 3.643 20 10 CHCDRO C[N@H+](CCC1CC1)Cc1cc(C(C)(C)C)ccc1O ZINC001233286737 1132595908 /nfs/dbraw/zinc/59/59/08/1132595908.db2.gz HDUAYOSOINSQKR-UHFFFAOYSA-N 1 0 261.409 3.922 20 10 CHCDRO Nc1ccc(N(/C=C/C2CC[NH2+]CC2)c2ccccc2)cc1 ZINC001159704322 1132896186 /nfs/dbraw/zinc/89/61/86/1132896186.db2.gz XKWPFCHMWDJVLU-NTCAYCPXSA-N 1 0 293.414 3.920 20 10 CHCDRO Cc1cc2ccccc2c(NCc2ccc(N)cc2)[nH+]1 ZINC001162785557 1133112922 /nfs/dbraw/zinc/11/29/22/1133112922.db2.gz GTYVPWGPJYJNBO-UHFFFAOYSA-N 1 0 263.344 3.738 20 10 CHCDRO [O-]c1ccc(Cl)cc1C[N@H+](C1CCC1)C1CCOCC1 ZINC001203665625 1133351259 /nfs/dbraw/zinc/35/12/59/1133351259.db2.gz PZIYGJSKTZJFQU-UHFFFAOYSA-N 1 0 295.810 3.579 20 10 CHCDRO Cc1ccc(C[N@@H+]2CCc3cccc(O)c3C2)c(C)c1 ZINC001203739437 1133362217 /nfs/dbraw/zinc/36/22/17/1133362217.db2.gz JXOPHBKXNRJNJQ-UHFFFAOYSA-N 1 0 267.372 3.567 20 10 CHCDRO Cc1ccccc1[C@@H]1CCC[N@@H+]1Cc1ccc(O)c(O)c1 ZINC001203878894 1133378924 /nfs/dbraw/zinc/37/89/24/1133378924.db2.gz XZHQVDOBGLFGKR-INIZCTEOSA-N 1 0 283.371 3.743 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2C[C@@H]3C[C@H](C2)c2ccccc23)cc1 ZINC001203937539 1133386046 /nfs/dbraw/zinc/38/60/46/1133386046.db2.gz VIWWHRULHHJVRG-CALCHBBNSA-N 1 0 292.426 3.839 20 10 CHCDRO C[C@H]1CC[N@H+](Cc2ccc(N(C)C)c3ccccc23)C1 ZINC001204235059 1133422174 /nfs/dbraw/zinc/42/21/74/1133422174.db2.gz FLNSOKICXAHCQP-AWEZNQCLSA-N 1 0 268.404 3.748 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2ccc(N(C)C)c3ccccc23)C1 ZINC001204235060 1133423275 /nfs/dbraw/zinc/42/32/75/1133423275.db2.gz FLNSOKICXAHCQP-CQSZACIVSA-N 1 0 268.404 3.748 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2C[C@H]3[C@H](CF)[C@H]3C2)c2ccccc21 ZINC001204239704 1133423886 /nfs/dbraw/zinc/42/38/86/1133423886.db2.gz DBZMWZWYGDCTEW-NNZMDNLPSA-N 1 0 298.405 3.553 20 10 CHCDRO CS[C@H]1CCCC[N@H+](Cc2ccc(N(C)C)cc2C)C1 ZINC001204287776 1133428293 /nfs/dbraw/zinc/42/82/93/1133428293.db2.gz OOEHQUARRPWIQZ-KRWDZBQOSA-N 1 0 292.492 3.779 20 10 CHCDRO CS[C@@H]1CCCC[N@H+](Cc2ccc(N(C)C)cc2C)C1 ZINC001204287777 1133428647 /nfs/dbraw/zinc/42/86/47/1133428647.db2.gz OOEHQUARRPWIQZ-QGZVFWFLSA-N 1 0 292.492 3.779 20 10 CHCDRO CCCOc1ccc(C[N@@H+]2CCc3cccc(O)c3C2)cc1 ZINC001204307004 1133433645 /nfs/dbraw/zinc/43/36/45/1133433645.db2.gz FBPFVWNKEYJFIW-UHFFFAOYSA-N 1 0 297.398 3.739 20 10 CHCDRO C[C@@H]1C[C@@H](C)CC[N@@H+]1Cc1ccc(N2CCCC2)cc1 ZINC001204321166 1133436671 /nfs/dbraw/zinc/43/66/71/1133436671.db2.gz HHQZIIRPZPFCKS-JKSUJKDBSA-N 1 0 272.436 3.907 20 10 CHCDRO C[C@H]1C[C@H](C)C[NH+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001204322551 1133436891 /nfs/dbraw/zinc/43/68/91/1133436891.db2.gz RQHIGYQBORZLDO-HOTGVXAUSA-N 1 0 272.436 3.765 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[N@@H+]1CC[C@@H]2CCC[C@@H]2C1 ZINC001204323780 1133436931 /nfs/dbraw/zinc/43/69/31/1133436931.db2.gz JAJPKDRZANNJNH-ZWKOTPCHSA-N 1 0 284.447 3.909 20 10 CHCDRO C[C@]1(F)CCC[N@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001204325816 1133438412 /nfs/dbraw/zinc/43/84/12/1133438412.db2.gz VPIBSJRKYYAHDU-KRWDZBQOSA-N 1 0 276.399 3.611 20 10 CHCDRO CC[N@H+](Cc1cc(C)c(C)o1)Cc1ccc(N(C)C)cc1 ZINC001204540284 1133458863 /nfs/dbraw/zinc/45/88/63/1133458863.db2.gz UYOOSOZJNJKGGS-UHFFFAOYSA-N 1 0 286.419 3.985 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@H]2CCC[C@H]21 ZINC001204887937 1133495920 /nfs/dbraw/zinc/49/59/20/1133495920.db2.gz CRDDQXWSOWFBGJ-CRAIPNDOSA-N 1 0 272.436 3.826 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)CC2(C)CC2)cc1 ZINC001205032161 1133518323 /nfs/dbraw/zinc/51/83/23/1133518323.db2.gz AQKDARJOJINNPA-UHFFFAOYSA-N 1 0 260.425 3.765 20 10 CHCDRO CCc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(C)cc1O)CCO2 ZINC001205277285 1133553528 /nfs/dbraw/zinc/55/35/28/1133553528.db2.gz QQEDZPMCUXEOTF-KRWDZBQOSA-N 1 0 297.398 3.876 20 10 CHCDRO CC(C)c1ccc(O)c(C[N@H+](C)CCc2ccccn2)c1 ZINC001205366540 1133570463 /nfs/dbraw/zinc/57/04/63/1133570463.db2.gz IHIOBIOOKUFDJO-UHFFFAOYSA-N 1 0 284.403 3.585 20 10 CHCDRO CCc1cccc(C[NH2+][C@@H](C)Cc2ccccc2OC)c1O ZINC001205596447 1133592697 /nfs/dbraw/zinc/59/26/97/1133592697.db2.gz XRGTWWNMKKENIQ-AWEZNQCLSA-N 1 0 299.414 3.684 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)cc1Cl ZINC001206762801 1133744701 /nfs/dbraw/zinc/74/47/01/1133744701.db2.gz PWJBYROYURDSFG-UPJWGTAASA-N 1 0 279.811 3.880 20 10 CHCDRO CC1=C[C@H](C)[C@H](C[N@H+](C)Cc2ccccc2O)CC1 ZINC001208179759 1133898565 /nfs/dbraw/zinc/89/85/65/1133898565.db2.gz BZTRLSXBPHQPQB-GJZGRUSLSA-N 1 0 259.393 3.816 20 10 CHCDRO COC1CC[NH+](Cc2ccc(-n3c(C)ccc3C)cc2)CC1 ZINC001209517352 1134034842 /nfs/dbraw/zinc/03/48/42/1134034842.db2.gz CYERLKHOIHNQMK-UHFFFAOYSA-N 1 0 298.430 3.705 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(C[N@@H+]2CCCO[C@@H](C)C2)cc1 ZINC001209519628 1134035302 /nfs/dbraw/zinc/03/53/02/1134035302.db2.gz YZCKUHFEENUZBZ-KRWDZBQOSA-N 1 0 298.430 3.705 20 10 CHCDRO Cc1cc(Nc2cccc(F)c2O)c2ccccc2[nH+]1 ZINC001210195954 1134163621 /nfs/dbraw/zinc/16/36/21/1134163621.db2.gz NPKGKKCWIKBXEZ-UHFFFAOYSA-N 1 0 268.291 3.553 20 10 CHCDRO CC[C@H](C[NH2+][C@H]1CCc2cccc(O)c21)CC(F)(F)F ZINC000402657301 1134669303 /nfs/dbraw/zinc/66/93/03/1134669303.db2.gz JJSWRISMMWBODV-JQWIXIFHSA-N 1 0 287.325 3.948 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1Oc1ccc(N)cc1 ZINC001218337427 1135089357 /nfs/dbraw/zinc/08/93/57/1135089357.db2.gz YYZFFZJSYLGRKL-DNVCBOLYSA-N 1 0 296.414 3.558 20 10 CHCDRO c1cc(N2CC[NH2+]CC2)ccc1OC1CCCCCCC1 ZINC001218352819 1135092246 /nfs/dbraw/zinc/09/22/46/1135092246.db2.gz MVGQOPFLQFQKDK-UHFFFAOYSA-N 1 0 288.435 3.588 20 10 CHCDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]Cc1cccc(C#N)c1 ZINC000314650199 1135146126 /nfs/dbraw/zinc/14/61/26/1135146126.db2.gz GGVZUSMXXFIRFK-BBRMVZONSA-N 1 0 292.382 3.910 20 10 CHCDRO C[C@@H]([NH2+]CCCc1ccccc1)c1ccccc1O ZINC000020122709 171003245 /nfs/dbraw/zinc/00/32/45/171003245.db2.gz HVPBWOHQOVKLLO-CQSZACIVSA-N 1 0 255.361 3.676 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2)s1 ZINC000020146118 171031934 /nfs/dbraw/zinc/03/19/34/171031934.db2.gz BGSQSTRLTWPAOM-CYBMUJFWSA-N 1 0 274.433 3.973 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(F)cc1F ZINC000020146096 171031950 /nfs/dbraw/zinc/03/19/50/171031950.db2.gz KGIQNGDCTUPAQT-GFCCVEGCSA-N 1 0 290.357 3.882 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccccc1 ZINC000020146035 171032073 /nfs/dbraw/zinc/03/20/73/171032073.db2.gz RBZNWQWZGNVTRW-SFHVURJKSA-N 1 0 268.404 3.994 20 10 CHCDRO CC[N@H+](Cc1ccc(N)cc1)Cc1cccc(Cl)c1 ZINC000035361411 172152496 /nfs/dbraw/zinc/15/24/96/172152496.db2.gz NDXVCZROELFDCT-UHFFFAOYSA-N 1 0 274.795 3.944 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCc2ccc(F)cc2)c1 ZINC000035628530 172307359 /nfs/dbraw/zinc/30/73/59/172307359.db2.gz MNGWXVGCUIVBEY-ZDUSSCGKSA-N 1 0 273.351 3.733 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccc(F)c(F)c1 ZINC000037363183 260094704 /nfs/dbraw/zinc/09/47/04/260094704.db2.gz VBNJVDGBTPXMKN-NSHDSACASA-N 1 0 289.325 3.751 20 10 CHCDRO CC[C@@](C)([NH2+]Cc1cc(C)ccc1O)c1nccs1 ZINC000152628831 261066785 /nfs/dbraw/zinc/06/67/85/261066785.db2.gz VQLDTDKGGLSZBS-OAHLLOKOSA-N 1 0 276.405 3.572 20 10 CHCDRO COCC[C@@H](C)[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000152694523 261068355 /nfs/dbraw/zinc/06/83/55/261068355.db2.gz UFZALAKKLDFOJL-HZPDHXFCSA-N 1 0 290.451 3.753 20 10 CHCDRO CC[C@H]([NH2+][C@@H](CCCO)c1ccccc1)c1ccccc1O ZINC000155983542 261111168 /nfs/dbraw/zinc/11/11/68/261111168.db2.gz COXIKLJYSOTAPO-ROUUACIJSA-N 1 0 299.414 3.947 20 10 CHCDRO CC[C@H]([NH2+][C@H](COC)c1ccccc1)c1ccccc1O ZINC000156573508 261126148 /nfs/dbraw/zinc/12/61/48/261126148.db2.gz VCSHDHHASOZJRR-DLBZAZTESA-N 1 0 285.387 3.821 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](C)c1c(C)noc1C)c1ccccc1O ZINC000156866749 261133944 /nfs/dbraw/zinc/13/39/44/261133944.db2.gz AJVHYHUHAAZGAY-NHYWBVRUSA-N 1 0 288.391 3.841 20 10 CHCDRO COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)CC2 ZINC000173228420 261158491 /nfs/dbraw/zinc/15/84/91/261158491.db2.gz IGZRXWSEIHUSNG-IBGZPJMESA-N 1 0 296.414 3.538 20 10 CHCDRO Cc1cccc(C[NH2+]C2(c3ccccc3F)CC2)c1O ZINC000182400035 261937312 /nfs/dbraw/zinc/93/73/12/261937312.db2.gz GJMAHYCAJTXBGE-UHFFFAOYSA-N 1 0 271.335 3.619 20 10 CHCDRO CC(C)c1nc(CC[NH2+][C@H](C)c2ccccc2O)cs1 ZINC000183482887 261977150 /nfs/dbraw/zinc/97/71/50/261977150.db2.gz AGCIJQWFMJHJPK-GFCCVEGCSA-N 1 0 290.432 3.865 20 10 CHCDRO COc1cccc(C[NH2+][C@H](C)c2cc(Cl)ccc2O)c1 ZINC000184884049 262032300 /nfs/dbraw/zinc/03/23/00/262032300.db2.gz GAXGKLWVKNRMLU-LLVKDONJSA-N 1 0 291.778 3.905 20 10 CHCDRO C[C@@H]([NH2+]Cc1nccs1)c1cc2c(cc1O)CCCC2 ZINC000185087820 262040742 /nfs/dbraw/zinc/04/07/42/262040742.db2.gz YXRRFYDPSVQYDH-LLVKDONJSA-N 1 0 288.416 3.578 20 10 CHCDRO COCCCCC[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000185232881 262047178 /nfs/dbraw/zinc/04/71/78/262047178.db2.gz PRLNVXRKZZFZTL-LLVKDONJSA-N 1 0 271.788 3.513 20 10 CHCDRO CCc1noc(CC)c1C[NH2+][C@H](C)c1cc(C)ccc1O ZINC000185678448 262065760 /nfs/dbraw/zinc/06/57/60/262065760.db2.gz KOHZZGWTKHGSSX-GFCCVEGCSA-N 1 0 288.391 3.664 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)ccc1O)C1CCOCC1 ZINC000185782196 262070605 /nfs/dbraw/zinc/07/06/05/262070605.db2.gz QRNMFAKVDPLQTI-MNOVXSKESA-N 1 0 283.799 3.511 20 10 CHCDRO CCOCCC1(C[NH2+][C@@H](C)c2ccc(C)cc2O)CC1 ZINC000186155523 262082000 /nfs/dbraw/zinc/08/20/00/262082000.db2.gz YNISFAWPRBAHSP-AWEZNQCLSA-N 1 0 277.408 3.558 20 10 CHCDRO CC[C@@H]([NH2+]CCCCCSC)c1ccccc1O ZINC000186771037 262109242 /nfs/dbraw/zinc/10/92/42/262109242.db2.gz NRWDXCZFBKZQFH-CQSZACIVSA-N 1 0 267.438 3.966 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCCOCC1)c1ccc2ccccc2c1O ZINC000186234539 262312045 /nfs/dbraw/zinc/31/20/45/262312045.db2.gz SZACOSGZDAOETR-HIFRSBDPSA-N 1 0 285.387 3.765 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCC(F)(F)C2)c1 ZINC000280750776 263064291 /nfs/dbraw/zinc/06/42/91/263064291.db2.gz BQCZFLGKRNKCAS-NWDGAFQWSA-N 1 0 269.335 3.787 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(Cl)nc1)c1ccccc1O ZINC000183326243 327819397 /nfs/dbraw/zinc/81/93/97/327819397.db2.gz JUBUWZTVURLPFU-ZDUSSCGKSA-N 1 0 276.767 3.682 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)Cc2ccc(O)cc2)c(O)c1 ZINC000185351761 327838240 /nfs/dbraw/zinc/83/82/40/327838240.db2.gz PHGRNITXQXJBFA-UONOGXRCSA-N 1 0 285.387 3.688 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CC[C@H](CO)CC1)c1ccc2ccccc2c1O ZINC000185736221 327843569 /nfs/dbraw/zinc/84/35/69/327843569.db2.gz SIQJWTDBYXEYML-FMKPAKJESA-N 1 0 299.414 3.747 20 10 CHCDRO CCC[NH2+][C@@H](CC)c1cc(Br)ccc1O ZINC000019480545 326855694 /nfs/dbraw/zinc/85/56/94/326855694.db2.gz LCXIVURDZVYPGJ-NSHDSACASA-N 1 0 272.186 3.605 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CC[C@@H]2C[C@@H]2C1)c1cc(F)ccc1O ZINC000403360348 327156858 /nfs/dbraw/zinc/15/68/58/327156858.db2.gz MRCWYGATYOHJCW-LOWDOPEQSA-N 1 0 263.356 3.618 20 10 CHCDRO C[C@H]([NH2+][C@@H]1COc2c1cccc2Cl)c1ccccc1O ZINC000374681217 328996146 /nfs/dbraw/zinc/99/61/46/328996146.db2.gz ULDPLWJWYYQUBZ-IINYFYTJSA-N 1 0 289.762 3.830 20 10 CHCDRO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2cc(F)ccc2O)n1 ZINC000180162921 329218288 /nfs/dbraw/zinc/21/82/88/329218288.db2.gz RKUFFXUZOCJKFJ-INIZCTEOSA-N 1 0 286.350 3.572 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+]CC[C@@H]2CCCOC2)c1O ZINC000527925539 330296533 /nfs/dbraw/zinc/29/65/33/330296533.db2.gz MLGQMLYJFKPDKF-STQMWFEESA-N 1 0 297.826 3.821 20 10 CHCDRO Cc1ncccc1C[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000527989346 330299161 /nfs/dbraw/zinc/29/91/61/330299161.db2.gz YBBAQZIGQAGBHX-IINYFYTJSA-N 1 0 286.350 3.573 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc(F)ccc1O)c1ccc(OC)cc1 ZINC000226582074 333265252 /nfs/dbraw/zinc/26/52/52/333265252.db2.gz RXJWVKPXUXFGOY-MRXNPFEDSA-N 1 0 289.350 3.781 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+][C@H]1CCSc2ccccc21 ZINC000226582091 333265276 /nfs/dbraw/zinc/26/52/76/333265276.db2.gz BXNYWCHNTLRGID-AWEZNQCLSA-N 1 0 289.375 3.858 20 10 CHCDRO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1cc(F)ccc1O ZINC000226585238 333265535 /nfs/dbraw/zinc/26/55/35/333265535.db2.gz QPQJHJYOHRTTNR-JTQLQIEISA-N 1 0 293.313 3.530 20 10 CHCDRO COCCC1CC[NH+](Cc2cc(Cl)cc(C)c2O)CC1 ZINC000529638367 333502646 /nfs/dbraw/zinc/50/26/46/333502646.db2.gz RNHYVNJBEKEZNJ-UHFFFAOYSA-N 1 0 297.826 3.603 20 10 CHCDRO CC[C@H]([NH2+]CCCc1nccs1)c1ccccc1O ZINC000274967222 334786006 /nfs/dbraw/zinc/78/60/06/334786006.db2.gz XMRCGALYKJNTDE-ZDUSSCGKSA-N 1 0 276.405 3.522 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H]1CCC[C@H]2C[C@H]21 ZINC000576651342 335231470 /nfs/dbraw/zinc/23/14/70/335231470.db2.gz ZZKUJACODRZETN-IMJJTQAJSA-N 1 0 268.404 3.765 20 10 CHCDRO CC[C@H]([NH2+]CCC(C)(F)F)c1ccc(N(C)C)cc1 ZINC000297404221 522578249 /nfs/dbraw/zinc/57/82/49/522578249.db2.gz SSMMNJGCDTYQSU-AWEZNQCLSA-N 1 0 270.367 3.839 20 10 CHCDRO CC[C@H]([NH2+]CCC(C)(F)F)c1ccc(C)cc1O ZINC000297422889 522578596 /nfs/dbraw/zinc/57/85/96/522578596.db2.gz UVMAEXZICVCYED-LBPRGKRZSA-N 1 0 257.324 3.787 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]C[C@@H]1CCOc3ccccc31)CC2 ZINC000297551419 518203569 /nfs/dbraw/zinc/20/35/69/518203569.db2.gz FRGQRECSVJITRT-HOCLYGCPSA-N 1 0 295.382 3.535 20 10 CHCDRO CC(C)c1ccc(C[NH2+]Cc2ccccc2O)cc1 ZINC000045039576 519836254 /nfs/dbraw/zinc/83/62/54/519836254.db2.gz SWWYTNIFHLRHII-UHFFFAOYSA-N 1 0 255.361 3.805 20 10 CHCDRO CCOC(CC[NH2+][C@@H](CC)c1ccc(C)cc1O)OCC ZINC000279932902 521629624 /nfs/dbraw/zinc/62/96/24/521629624.db2.gz ATTIUQZOHMNDBC-HNNXBMFYSA-N 1 0 295.423 3.531 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccccc1O ZINC000037668243 522652050 /nfs/dbraw/zinc/65/20/50/522652050.db2.gz ZYUSMJSWSIZVTP-HNNXBMFYSA-N 1 0 286.331 3.541 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCO[C@@H](C(C)C)C1)c1ccccc1O ZINC000274930810 522756138 /nfs/dbraw/zinc/75/61/38/522756138.db2.gz QUTGWAOXVKXKTI-JLJPHGGASA-N 1 0 277.408 3.637 20 10 CHCDRO COCC(C)(C)CCC[NH2+]Cc1cc(C)c(C)cc1O ZINC000290198180 522807485 /nfs/dbraw/zinc/80/74/85/522807485.db2.gz UKLMGKUMUQMYAA-UHFFFAOYSA-N 1 0 279.424 3.551 20 10 CHCDRO CC[C@@H]([NH2+]CC(C)(C)CCCO)c1ccc(C)cc1O ZINC000280069716 522814557 /nfs/dbraw/zinc/81/45/57/522814557.db2.gz KYEJNHZGBZLPSG-OAHLLOKOSA-N 1 0 279.424 3.540 20 10 CHCDRO CC[C@@H]([NH2+]CC(C)(C)C[C@H](C)O)c1ccc(C)cc1O ZINC000279999749 522817698 /nfs/dbraw/zinc/81/76/98/522817698.db2.gz FWHCILWAJXAJMX-DZGCQCFKSA-N 1 0 279.424 3.538 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1nnc(C)s1)c1ccc(C)cc1O ZINC000280126270 522915646 /nfs/dbraw/zinc/91/56/46/522915646.db2.gz ORGKINCXGNHVPP-GXFFZTMASA-N 1 0 291.420 3.662 20 10 CHCDRO CC[C@H](c1ccncc1)[N@H+](C)Cc1cccc(C)c1O ZINC000290478319 522965664 /nfs/dbraw/zinc/96/56/64/522965664.db2.gz NYDRXSFBMZJPEA-MRXNPFEDSA-N 1 0 270.376 3.679 20 10 CHCDRO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000079249402 523857944 /nfs/dbraw/zinc/85/79/44/523857944.db2.gz STEITIMCBVELDM-AWEZNQCLSA-N 1 0 297.398 3.789 20 10 CHCDRO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1ccccc1O ZINC000036961160 523858943 /nfs/dbraw/zinc/85/89/43/523858943.db2.gz XQNVCDPMAPHTQA-ZDUSSCGKSA-N 1 0 271.360 3.560 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2)c1 ZINC000020146071 524090765 /nfs/dbraw/zinc/09/07/65/524090765.db2.gz UHBRIOKLECCXTI-CQSZACIVSA-N 1 0 284.403 3.612 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CC[C@H]2CCCCO2)c(O)c1 ZINC000285400520 524329959 /nfs/dbraw/zinc/32/99/59/524329959.db2.gz XCWSSHWPMHQOIJ-HUUCEWRRSA-N 1 0 277.408 3.619 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(F)cc1F)c1ccc(N(C)C)cc1 ZINC000051016881 525442823 /nfs/dbraw/zinc/44/28/23/525442823.db2.gz GNMWDNCGCGGIFZ-LBPRGKRZSA-N 1 0 290.357 3.882 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccco1 ZINC000050286496 525530849 /nfs/dbraw/zinc/53/08/49/525530849.db2.gz UAQLGLZIKXACHK-CYBMUJFWSA-N 1 0 270.376 3.513 20 10 CHCDRO C[C@@H]([NH2+]Cc1cccc(C(F)(F)F)n1)c1ccccc1O ZINC000296256773 525532908 /nfs/dbraw/zinc/53/29/08/525532908.db2.gz DBXYBZSUZSRRBC-SNVBAGLBSA-N 1 0 296.292 3.657 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)[C@H](O)c1ccccc1 ZINC000290197945 525608864 /nfs/dbraw/zinc/60/88/64/525608864.db2.gz GKXJMBPFWYRXPI-KHYOSLBOSA-N 1 0 298.430 3.525 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@](C)(O)c2ccccc2)c(O)c1C ZINC000273575675 525730305 /nfs/dbraw/zinc/73/03/05/525730305.db2.gz LSSIXGCFXDSPQO-DNVCBOLYSA-N 1 0 299.414 3.567 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2COc3ccccc32)c(O)c1 ZINC000290459499 525731756 /nfs/dbraw/zinc/73/17/56/525731756.db2.gz WLVYRWRVRVUUMM-ZIAGYGMSSA-N 1 0 283.371 3.527 20 10 CHCDRO COc1cccc(C[NH2+][C@@H](c2ccccc2)C(C)C)c1O ZINC000036967633 526032171 /nfs/dbraw/zinc/03/21/71/526032171.db2.gz GVQVECYXKLDKBR-QGZVFWFLSA-N 1 0 285.387 3.888 20 10 CHCDRO COc1cccc(C[NH2+][C@H](C)[C@@H](C)c2ccccc2)c1O ZINC000271834522 526036695 /nfs/dbraw/zinc/03/66/95/526036695.db2.gz PORHVRLIPDODJB-ZIAGYGMSSA-N 1 0 285.387 3.683 20 10 CHCDRO COc1cccc(C[NH2+][C@H](c2ccccc2)C2CC2)c1O ZINC000037075289 526039795 /nfs/dbraw/zinc/03/97/95/526039795.db2.gz TZILYMBYOGNSKD-QGZVFWFLSA-N 1 0 283.371 3.642 20 10 CHCDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]C1CC(F)(F)C1 ZINC000277632149 526337842 /nfs/dbraw/zinc/33/78/42/526337842.db2.gz KVYDOBDVQXYUBX-UHFFFAOYSA-N 1 0 289.325 3.947 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]CCc1cccc3[nH]ccc31)CC2 ZINC000296296905 526368750 /nfs/dbraw/zinc/36/87/50/526368750.db2.gz DKHLOOMTZRYMAM-KRWDZBQOSA-N 1 0 292.382 3.693 20 10 CHCDRO Oc1ccccc1C[NH2+]C[C@H]1CCCC[C@H]1C(F)(F)F ZINC000288451423 526374669 /nfs/dbraw/zinc/37/46/69/526374669.db2.gz MYFYZPYJKFJQLC-DGCLKSJQSA-N 1 0 287.325 3.851 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1cc(OC)ccc1O)C1CCC1 ZINC000325046173 1117843610 /nfs/dbraw/zinc/84/36/10/1117843610.db2.gz NZGCRJSVGCZQQV-ABAIWWIYSA-N 1 0 263.381 3.630 20 10 CHCDRO C[N@H+](Cc1ccc[nH]1)Cc1ccc(N2CCCCC2)cc1 ZINC000180173552 1119939479 /nfs/dbraw/zinc/93/94/79/1119939479.db2.gz AEYCFMOHMCNWMB-UHFFFAOYSA-N 1 0 283.419 3.637 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C[C@H]2CCSC2)cc1F ZINC000785462828 1120431569 /nfs/dbraw/zinc/43/15/69/1120431569.db2.gz WYWLVXYFEAYQES-CQSZACIVSA-N 1 0 296.455 3.515 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C(C)C)C1CC1 ZINC000766030735 1120673690 /nfs/dbraw/zinc/67/36/90/1120673690.db2.gz WVVIKXUQOJHMKC-KRWDZBQOSA-N 1 0 260.425 3.585 20 10 CHCDRO Cc1ccc(CC[NH2+]Cc2c(O)cc(C)cc2Cl)o1 ZINC001177250573 1121721332 /nfs/dbraw/zinc/72/13/32/1121721332.db2.gz NEUAPSGSJUGLEG-UHFFFAOYSA-N 1 0 279.767 3.588 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CC[C@H](C(F)(F)F)C2)cc1 ZINC000773809127 1121864911 /nfs/dbraw/zinc/86/49/11/1121864911.db2.gz NLIGAPVBWKUNTI-ZDUSSCGKSA-N 1 0 286.341 3.527 20 10 CHCDRO CN(C)c1ccc(C[NH2+]CC(C)(C)C(C)(F)F)cc1 ZINC000696616677 1123245479 /nfs/dbraw/zinc/24/54/79/1123245479.db2.gz PKZFGPSJEMVLNA-UHFFFAOYSA-N 1 0 270.367 3.524 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]C2(CC(C)C)CC2)c1 ZINC000850567090 1123293694 /nfs/dbraw/zinc/29/36/94/1123293694.db2.gz XJLPTOIMBPUOON-LBPRGKRZSA-N 1 0 263.381 3.630 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]CC(C)(C)C(C)(F)F)c1 ZINC000865789621 1124015736 /nfs/dbraw/zinc/01/57/36/1124015736.db2.gz KSHPJMOWWQYXJV-UHFFFAOYSA-N 1 0 287.350 3.562 20 10 CHCDRO C[C@@]1(CC[NH2+]Cc2cc(F)ccc2O)CC1(Cl)Cl ZINC000824969117 1131492303 /nfs/dbraw/zinc/49/23/03/1131492303.db2.gz FBYYWJPIFQRGRK-GFCCVEGCSA-N 1 0 292.181 3.595 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCC[C@H](C(F)(F)F)C2)c1O ZINC001140180131 1131673379 /nfs/dbraw/zinc/67/33/79/1131673379.db2.gz SSYXEWSHOQNZCB-LBPRGKRZSA-N 1 0 287.325 3.783 20 10 CHCDRO CCC[C@@H](CC)[NH2+][C@H](C)c1cccc(OC)c1O ZINC000846149447 1131691416 /nfs/dbraw/zinc/69/14/16/1131691416.db2.gz NEEIZIUINBCMBE-VXGBXAGGSA-N 1 0 251.370 3.630 20 10 CHCDRO CCCCC[C@H](C)[NH2+]Cc1cccc(OCC)c1O ZINC000036792353 1131977059 /nfs/dbraw/zinc/97/70/59/1131977059.db2.gz SLLDCBMQHKRXPB-ZDUSSCGKSA-N 1 0 265.397 3.849 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CS[C@@H](C)C1)c1cc(Cl)ccc1O ZINC000840860941 1132297871 /nfs/dbraw/zinc/29/78/71/1132297871.db2.gz YBWJTPYOXQGFTQ-GAFUQQFSSA-N 1 0 285.840 3.980 20 10 CHCDRO CCC[N@H+](C/C=C\c1ccc(N(C)C)cc1)C(C)C ZINC001206464714 1133705408 /nfs/dbraw/zinc/70/54/08/1133705408.db2.gz VGNBGRYHCVEBOV-FPLPWBNLSA-N 1 0 260.425 3.886 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CCOC(C)(C)C1)c1ccc(N(C)C)cc1 ZINC000119314832 1125532864 /nfs/dbraw/zinc/53/28/64/1125532864.db2.gz BGVVATZJULIKMS-NVXWUHKLSA-N 1 0 290.451 3.751 20 10 CHCDRO Oc1ccccc1C[NH2+]Cc1ccc(OC(F)(F)F)cc1 ZINC000134225899 1125544118 /nfs/dbraw/zinc/54/41/18/1125544118.db2.gz GPAOPAVVYUVHQH-UHFFFAOYSA-N 1 0 297.276 3.581 20 10 CHCDRO C[C@H]([NH2+]Cc1ccccc1O)c1nc2ccccc2s1 ZINC000134674418 1125565822 /nfs/dbraw/zinc/56/58/22/1125565822.db2.gz YYEIYKCTGGLSDI-NSHDSACASA-N 1 0 284.384 3.853 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CC[C@H]([C@H]2CCCO2)C1 ZINC000884482665 1125567654 /nfs/dbraw/zinc/56/76/54/1125567654.db2.gz GEDKAKKDTFRYBR-HNAYVOBHSA-N 1 0 297.398 3.546 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H](C)CCSC)cc1 ZINC000134874493 1125569811 /nfs/dbraw/zinc/56/98/11/1125569811.db2.gz GFQKBMOAQULSOE-CQSZACIVSA-N 1 0 280.481 3.764 20 10 CHCDRO CC[C@H]1CC[N@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000134978274 1125572654 /nfs/dbraw/zinc/57/26/54/1125572654.db2.gz ADWULJAFIUERPW-ZDUSSCGKSA-N 1 0 255.361 3.777 20 10 CHCDRO c1cc(N2CCCCC2)ccc1C[NH2+][C@H]1CCCSC1 ZINC000135704113 1125595981 /nfs/dbraw/zinc/59/59/81/1125595981.db2.gz WASYMSHCNFDSBP-INIZCTEOSA-N 1 0 290.476 3.662 20 10 CHCDRO Cc1ccncc1C[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841759369 1125599652 /nfs/dbraw/zinc/59/96/52/1125599652.db2.gz YYSXYALGDJURND-LLVKDONJSA-N 1 0 276.767 3.600 20 10 CHCDRO CCOc1cccc(C[N@@H+]2[C@@H](C)CC[C@@H]2CC)c1O ZINC000136821611 1125648076 /nfs/dbraw/zinc/64/80/76/1125648076.db2.gz QXRZNKQAVXPVON-JSGCOSHPSA-N 1 0 263.381 3.554 20 10 CHCDRO C[N@H+](C/C=C\c1ccccc1)Cc1ccccc1O ZINC000220114815 1125699194 /nfs/dbraw/zinc/69/91/94/1125699194.db2.gz SAIXOUIWFJLWOV-YFHOEESVSA-N 1 0 253.345 3.537 20 10 CHCDRO CCOC1(C)CC[NH+](Cc2c(O)ccc3ccccc32)CC1 ZINC000292093477 1125718012 /nfs/dbraw/zinc/71/80/12/1125718012.db2.gz NXIZMBNVMNYDRE-UHFFFAOYSA-N 1 0 299.414 3.936 20 10 CHCDRO CC[C@H]([NH2+]CCCCCOC)c1ccc(N(C)C)cc1 ZINC000122714381 1125789475 /nfs/dbraw/zinc/78/94/75/1125789475.db2.gz YDZMALBLHBNTJR-KRWDZBQOSA-N 1 0 278.440 3.610 20 10 CHCDRO C[C@H]([NH2+]Cc1cccnc1)c1ccc(N2CCCCC2)cc1 ZINC000151099386 1126750947 /nfs/dbraw/zinc/75/09/47/1126750947.db2.gz GQRWYARACBTFJC-INIZCTEOSA-N 1 0 295.430 3.923 20 10 CHCDRO CCC[N@H+](Cc1cccc(Cl)n1)Cc1ccccc1O ZINC000174373336 1126769412 /nfs/dbraw/zinc/76/94/12/1126769412.db2.gz DMOLVFQCHVXIFU-UHFFFAOYSA-N 1 0 290.794 3.853 20 10 CHCDRO CCC(CC)[NH2+][C@H](C)c1ccc(N2CCOCC2)c(F)c1 ZINC000178091299 1126808888 /nfs/dbraw/zinc/80/88/88/1126808888.db2.gz SHUAXNHTYQCHND-CYBMUJFWSA-N 1 0 294.414 3.502 20 10 CHCDRO Cc1cnc([C@H](C)C[NH2+][C@@H](C)c2cc(F)ccc2O)s1 ZINC000183198749 1126882874 /nfs/dbraw/zinc/88/28/74/1126882874.db2.gz TUTJPWQMBPHLHA-KOLCDFICSA-N 1 0 294.395 3.751 20 10 CHCDRO CCOCc1ccc(C[NH2+][C@@H](C)c2ccccc2O)cc1 ZINC000183410241 1126886536 /nfs/dbraw/zinc/88/65/36/1126886536.db2.gz NDPGFEBKXIHRKA-AWEZNQCLSA-N 1 0 285.387 3.780 20 10 CHCDRO C[C@H]([NH2+][C@H](c1ccccc1)[C@@H]1CCCO1)c1ccccc1O ZINC000183467326 1126887403 /nfs/dbraw/zinc/88/74/03/1126887403.db2.gz WAWHYULJGQOWFP-ZOCIIQOWSA-N 1 0 297.398 3.963 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCOC2(CCCC2)C1)c1ccccc1O ZINC000183621166 1126889479 /nfs/dbraw/zinc/88/94/79/1126889479.db2.gz FRKSHEDUNGVQRC-KBPBESRZSA-N 1 0 275.392 3.535 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCOC2(CCCC2)C1)c1ccccc1O ZINC000183621147 1126889490 /nfs/dbraw/zinc/88/94/90/1126889490.db2.gz FRKSHEDUNGVQRC-ZIAGYGMSSA-N 1 0 275.392 3.535 20 10 CHCDRO C[C@H](C[C@H](O)c1ccccc1)[NH2+][C@@H](C)c1ccccc1O ZINC000183587318 1126890135 /nfs/dbraw/zinc/89/01/35/1126890135.db2.gz FQERAZBIWBLTRS-GLJUWKHASA-N 1 0 285.387 3.555 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](C)[C@@H](C)c2cccnc2)cc1C ZINC000183718262 1126890746 /nfs/dbraw/zinc/89/07/46/1126890746.db2.gz XZCNTVCGXXUZGQ-AWEZNQCLSA-N 1 0 270.376 3.597 20 10 CHCDRO CCO[C@H](CC[NH2+][C@@H](C)c1cc(OC)ccc1O)C(C)C ZINC000185625604 1126901616 /nfs/dbraw/zinc/90/16/16/1126901616.db2.gz UNZSPFYEXPPCQQ-SUMWQHHRSA-N 1 0 295.423 3.503 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCC[C@@H]1CCO)c1ccc2ccccc2c1O ZINC000187975089 1126917715 /nfs/dbraw/zinc/91/77/15/1126917715.db2.gz QPRHFEQVTDMZFN-SIIHOXLZSA-N 1 0 299.414 3.747 20 10 CHCDRO C[C@H]([NH2+][C@@H]1C[C@@H]1c1cccc(F)c1)c1ccccc1O ZINC000906594268 1126960956 /nfs/dbraw/zinc/96/09/56/1126960956.db2.gz CTSXMOLYWGBIOE-IUIKQTSFSA-N 1 0 271.335 3.738 20 10 CHCDRO CCO[C@H](C[NH2+][C@@H](C)c1ccccc1O)c1ccccc1 ZINC000193434385 1126969288 /nfs/dbraw/zinc/96/92/88/1126969288.db2.gz NEJCPWXKBJRSHE-KBXCAEBGSA-N 1 0 285.387 3.821 20 10 CHCDRO COc1cccc(C[NH2+][C@@H]2CC(C)(C)CC[C@H]2C)c1O ZINC000717522531 1126989305 /nfs/dbraw/zinc/98/93/05/1126989305.db2.gz BJVYOLXFXXXBFQ-TZMCWYRMSA-N 1 0 277.408 3.705 20 10 CHCDRO CC(C)[N@H+](Cc1cncs1)Cc1ccc(N(C)C)cc1 ZINC000271058236 1127067123 /nfs/dbraw/zinc/06/71/23/1127067123.db2.gz FBZOKARZFZOMGV-UHFFFAOYSA-N 1 0 289.448 3.620 20 10 CHCDRO CC[C@H]([NH2+]CC[C@H](C)F)c1ccc(N(C)C)cc1 ZINC000815645536 1131014627 /nfs/dbraw/zinc/01/46/27/1131014627.db2.gz IXAPVWXQNNAZHT-WFASDCNBSA-N 1 0 252.377 3.541 20 10 CHCDRO Cc1ccncc1[C@@H](C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000271561299 1127091593 /nfs/dbraw/zinc/09/15/93/1127091593.db2.gz VZOFCLVONFQRLV-MRXNPFEDSA-N 1 0 295.430 3.841 20 10 CHCDRO CC(C)[C@@H]1C[C@H]([NH2+][C@@H](C)c2ccc(N(C)C)cc2)CCO1 ZINC000271588993 1127094089 /nfs/dbraw/zinc/09/40/89/1127094089.db2.gz SSBGSMOUJBLFPP-LESCRADOSA-N 1 0 290.451 3.607 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N2CCSCC2)cc1)C(C)(C)C ZINC000163623238 1127115233 /nfs/dbraw/zinc/11/52/33/1127115233.db2.gz MMEWJUXCFRWWTR-CQSZACIVSA-N 1 0 292.492 3.764 20 10 CHCDRO CCCN(Cc1ccc(OC)cc1)c1ccc(C[NH3+])cc1 ZINC000034654593 1127117579 /nfs/dbraw/zinc/11/75/79/1127117579.db2.gz QHLQJHFFGGBSCN-UHFFFAOYSA-N 1 0 284.403 3.571 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)CSC)c1ccc(N(C)C)cc1 ZINC000151002534 1127117717 /nfs/dbraw/zinc/11/77/17/1127117717.db2.gz FEZHVYWQFLTJBU-WFASDCNBSA-N 1 0 266.454 3.545 20 10 CHCDRO CC[C@H]([NH2+]CCCc1c(C)noc1C)c1ccccc1O ZINC000156293641 1127137058 /nfs/dbraw/zinc/13/70/58/1127137058.db2.gz OJCGFCKXGGTRIE-INIZCTEOSA-N 1 0 288.391 3.671 20 10 CHCDRO CC[C@H](CC(F)(F)F)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000760652581 1127143954 /nfs/dbraw/zinc/14/39/54/1127143954.db2.gz PUYDWGRRBGKQSL-LLVKDONJSA-N 1 0 292.320 3.712 20 10 CHCDRO Cc1cc(C[NH2+][C@H](C)c2ccc3ccccc3c2O)on1 ZINC000044985723 1127164347 /nfs/dbraw/zinc/16/43/47/1127164347.db2.gz CJNNYAONFGXTLM-GFCCVEGCSA-N 1 0 282.343 3.693 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccc3c(c2)OCO3)c(O)c1 ZINC000284130997 1127174958 /nfs/dbraw/zinc/17/49/58/1127174958.db2.gz OHFUREDLYVRJHJ-CYBMUJFWSA-N 1 0 299.370 3.589 20 10 CHCDRO COc1ccc(O)c(C[NH2+]Cc2ccc(C(C)C)cc2)c1 ZINC000045040408 1127178327 /nfs/dbraw/zinc/17/83/27/1127178327.db2.gz QSQBVAZBPLPIQB-UHFFFAOYSA-N 1 0 285.387 3.814 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2)c(O)c1 ZINC000284257928 1127179497 /nfs/dbraw/zinc/17/94/97/1127179497.db2.gz WCEBXFCJXXPGHO-HNNXBMFYSA-N 1 0 298.430 3.926 20 10 CHCDRO C[C@@]1(F)CCC[N@H+](Cc2cc(F)cc(Cl)c2[O-])CC1 ZINC001237808621 1131142659 /nfs/dbraw/zinc/14/26/59/1131142659.db2.gz UYYMUMJHUCTDDX-CQSZACIVSA-N 1 0 289.753 3.899 20 10 CHCDRO CSc1cccc(F)c1C[NH2+]Cc1cc(C)ccc1O ZINC000285355292 1127223270 /nfs/dbraw/zinc/22/32/70/1127223270.db2.gz ACJIRJRQBQTXFH-UHFFFAOYSA-N 1 0 291.391 3.851 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2c(F)cncc2F)c1 ZINC000285731449 1127241644 /nfs/dbraw/zinc/24/16/44/1127241644.db2.gz QTYWWSGWYCKREH-QWRGUYRKSA-N 1 0 292.329 3.786 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000817412564 1131159911 /nfs/dbraw/zinc/15/99/11/1131159911.db2.gz MTFNBGUNXVSTKJ-LLVKDONJSA-N 1 0 273.298 3.557 20 10 CHCDRO CCC[N@H+](Cc1cc(F)cc(C)c1O)[C@@H](C)CC ZINC001238056219 1131165008 /nfs/dbraw/zinc/16/50/08/1131165008.db2.gz FUEJGUPMEQNRRJ-LBPRGKRZSA-N 1 0 253.361 3.850 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCCSC2)c(O)c1C ZINC000286999291 1127280724 /nfs/dbraw/zinc/28/07/24/1127280724.db2.gz KAAXZPRIPOGDMW-UONOGXRCSA-N 1 0 279.449 3.803 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CCc2ccc(O)cc2)cc1 ZINC000075423915 1127396091 /nfs/dbraw/zinc/39/60/91/1127396091.db2.gz YGRHBXNIYNQKLF-UHFFFAOYSA-N 1 0 298.430 3.571 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CCC[C@H]1C1CCCC1 ZINC000226563152 1127411004 /nfs/dbraw/zinc/41/10/04/1127411004.db2.gz OSZUWEZZXMIBPE-HNNXBMFYSA-N 1 0 263.356 3.686 20 10 CHCDRO Cc1ccccc1C[C@H](C)[NH2+]Cc1cc(F)ccc1O ZINC000226585345 1127412397 /nfs/dbraw/zinc/41/23/97/1127412397.db2.gz ZDEOERZXCVYJRK-ZDUSSCGKSA-N 1 0 273.351 3.561 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCCS1)c1ccc(N(C)C)cc1 ZINC000168687920 1127461521 /nfs/dbraw/zinc/46/15/21/1127461521.db2.gz OYYFVNJUCJNOAX-HOTGVXAUSA-N 1 0 278.465 3.689 20 10 CHCDRO CCOc1cccc(C[NH2+]C[C@@H]2CCC[C@@H](C)C2)c1O ZINC000227439776 1127478077 /nfs/dbraw/zinc/47/80/77/1127478077.db2.gz LAXUEEANEQXDLN-ZIAGYGMSSA-N 1 0 277.408 3.707 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2cccc(N(C)C)c2)c(O)c1 ZINC000293579599 1127507000 /nfs/dbraw/zinc/50/70/00/1127507000.db2.gz DVKJJMOTLOUQBL-OAHLLOKOSA-N 1 0 298.430 3.926 20 10 CHCDRO COCC1(CC[NH2+][C@@H](C)c2c(C)cc(C)cc2O)CCC1 ZINC000293731933 1127516360 /nfs/dbraw/zinc/51/63/60/1127516360.db2.gz OLYZJPGLFIIRCI-HNNXBMFYSA-N 1 0 291.435 3.866 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC(C)(C)[C@H]2c2ccncc2)c1 ZINC000294073745 1127547053 /nfs/dbraw/zinc/54/70/53/1127547053.db2.gz YOAGFSHQZAFEDW-QGZVFWFLSA-N 1 0 282.387 3.679 20 10 CHCDRO Cc1cnccc1C[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000294529722 1127581089 /nfs/dbraw/zinc/58/10/89/1127581089.db2.gz GWNGAHGZDHCNQI-UHFFFAOYSA-N 1 0 295.430 3.621 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@H]2CSCCS2)c(O)c1 ZINC000294566259 1127582675 /nfs/dbraw/zinc/58/26/75/1127582675.db2.gz BSCNKLMHQVDAEX-STQMWFEESA-N 1 0 297.489 3.508 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H]2CSCCS2)c(O)c1 ZINC000294566245 1127582826 /nfs/dbraw/zinc/58/28/26/1127582826.db2.gz BSCNKLMHQVDAEX-CHWSQXEVSA-N 1 0 297.489 3.508 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2CCc3cc(F)ccc3C2)cc1 ZINC001168412781 1127592291 /nfs/dbraw/zinc/59/22/91/1127592291.db2.gz TZXNMKHEWMTGNB-GOSISDBHSA-N 1 0 298.405 3.539 20 10 CHCDRO Oc1ccccc1C[NH2+][C@H]1CCCC[C@H]1CC(F)(F)F ZINC000295102612 1127620498 /nfs/dbraw/zinc/62/04/98/1127620498.db2.gz SZOAOEDEDHUDOI-AAEUAGOBSA-N 1 0 287.325 3.993 20 10 CHCDRO CCn1cc([C@@H](C)[NH2+][C@H](C)c2ccc(C)c(C)c2O)cn1 ZINC000295990681 1127659474 /nfs/dbraw/zinc/65/94/74/1127659474.db2.gz PMRJKAIDOGCRMI-ZIAGYGMSSA-N 1 0 287.407 3.637 20 10 CHCDRO Cc1cnc([C@H](C)C[NH2+][C@@H]2CCc3cccc(O)c32)s1 ZINC000296275619 1127667169 /nfs/dbraw/zinc/66/71/69/1127667169.db2.gz CKIFILYDWWRDMR-ZWNOBZJWSA-N 1 0 288.416 3.538 20 10 CHCDRO Cc1ncsc1CC[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000296367558 1127670343 /nfs/dbraw/zinc/67/03/43/1127670343.db2.gz JBUDKZSYBFKSMD-GFCCVEGCSA-N 1 0 290.432 3.667 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]C1(c3ccccc3F)CC1)CC2 ZINC000296662654 1127680711 /nfs/dbraw/zinc/68/07/11/1127680711.db2.gz FKCZYESQCDITLF-OAHLLOKOSA-N 1 0 283.346 3.798 20 10 CHCDRO COc1cccc(C2([NH2+][C@H]3CCc4cccc(O)c43)CC2)c1 ZINC000297118454 1127689366 /nfs/dbraw/zinc/68/93/66/1127689366.db2.gz YKZSYICCMSOVEM-INIZCTEOSA-N 1 0 295.382 3.667 20 10 CHCDRO C[C@@H]([NH2+]CCC(C)(F)F)c1cc(Cl)ccc1O ZINC000297477471 1127697897 /nfs/dbraw/zinc/69/78/97/1127697897.db2.gz YYSXCSGDYADDNR-MRVPVSSYSA-N 1 0 263.715 3.742 20 10 CHCDRO C[N@H+](Cc1cccc(Cl)c1)Cc1ccccc1O ZINC000171926635 1127734811 /nfs/dbraw/zinc/73/48/11/1127734811.db2.gz NDEYOZXGTTXPDQ-UHFFFAOYSA-N 1 0 261.752 3.678 20 10 CHCDRO COc1cccc(C[NH2+][C@H]2C[C@H](c3ccccc3C)C2)c1O ZINC000367201648 1127751596 /nfs/dbraw/zinc/75/15/96/1127751596.db2.gz UJMNIZKXJWVSNQ-WKILWMFISA-N 1 0 297.398 3.745 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]C[C@H]2CC[C@H](C)C2)c1O ZINC000230407288 1127752009 /nfs/dbraw/zinc/75/20/09/1127752009.db2.gz FTIURANCXNKSLK-QWRGUYRKSA-N 1 0 283.799 3.580 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H]2CC[C@H](SC)C2)cc1 ZINC000230697905 1127772615 /nfs/dbraw/zinc/77/26/15/1127772615.db2.gz ZCTPGVYSOIKTQC-RDJZCZTQSA-N 1 0 292.492 3.907 20 10 CHCDRO C[C@@H]1CCC[C@H]1C[NH2+]Cc1c(O)cccc1Cl ZINC000230667131 1127771073 /nfs/dbraw/zinc/77/10/73/1127771073.db2.gz NSKAFBHDCSXJPW-MNOVXSKESA-N 1 0 253.773 3.571 20 10 CHCDRO Cc1ccc(O)c(C[NH+]2CCC(c3ccc(C)nc3)CC2)c1 ZINC000371684325 1127775293 /nfs/dbraw/zinc/77/52/93/1127775293.db2.gz CXMNPGJSIRRCHB-UHFFFAOYSA-N 1 0 296.414 3.784 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H](C)CC(F)(F)F)c1 ZINC000231790774 1127854100 /nfs/dbraw/zinc/85/41/00/1127854100.db2.gz HGPXKSMSXYSZBR-NXEZZACHSA-N 1 0 261.287 3.692 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H](C)CC(F)(F)F)c(O)c1 ZINC000231791509 1127854377 /nfs/dbraw/zinc/85/43/77/1127854377.db2.gz PYVKAOSZCBJJSG-ZJUUUORDSA-N 1 0 261.287 3.692 20 10 CHCDRO CCOC1(C[NH2+][C@@H](C)c2ccc(C)cc2O)CCCC1 ZINC000312325501 1128023573 /nfs/dbraw/zinc/02/35/73/1128023573.db2.gz GTRALQHLPVLUBV-AWEZNQCLSA-N 1 0 277.408 3.701 20 10 CHCDRO CCCC[N@H+](Cc1ccccc1O)[C@@H](C)c1ncccn1 ZINC000930350969 1128072989 /nfs/dbraw/zinc/07/29/89/1128072989.db2.gz LDLKPRAKWGZLFD-AWEZNQCLSA-N 1 0 285.391 3.546 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)C1CC(F)(F)C1 ZINC000924648210 1128109176 /nfs/dbraw/zinc/10/91/76/1128109176.db2.gz KUUHICOQFNVNFF-ZDUSSCGKSA-N 1 0 294.389 3.810 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@]23CCC[C@H]2OCC3)c(O)c1 ZINC000926915058 1128202396 /nfs/dbraw/zinc/20/23/96/1128202396.db2.gz DMQHDCZNKMPHFU-QGPMSJSTSA-N 1 0 289.419 3.619 20 10 CHCDRO Cc1cnc(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)c(C)c1 ZINC000926960342 1128205957 /nfs/dbraw/zinc/20/59/57/1128205957.db2.gz OJYWYTDCLAKYKI-HNNXBMFYSA-N 1 0 284.403 3.872 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCCC2(CCC2)O1)c1cc(F)ccc1O ZINC000927011920 1128207936 /nfs/dbraw/zinc/20/79/36/1128207936.db2.gz SGZDHWSSNYCBMO-OCCSQVGLSA-N 1 0 293.382 3.674 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCS[C@H](C)C1)c1cc(Cl)ccc1O ZINC000927028456 1128208781 /nfs/dbraw/zinc/20/87/81/1128208781.db2.gz ADDHDUFTMDCXMQ-CKYFFXLPSA-N 1 0 285.840 3.980 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCS[C@@H](C)C2)c(O)c1C ZINC000927030370 1128209569 /nfs/dbraw/zinc/20/95/69/1128209569.db2.gz ICTRDBMQYNTQAK-UBHSHLNASA-N 1 0 279.449 3.944 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCS[C@H](C)C1)c1ccc(N(C)C)cc1 ZINC000927032450 1128209815 /nfs/dbraw/zinc/20/98/15/1128209815.db2.gz NLAZLYOFNDIQOI-NFAWXSAZSA-N 1 0 278.465 3.687 20 10 CHCDRO C[C@H]([N@H+](C)Cc1c(O)ccc2ccncc21)C(C)(C)C ZINC000914569540 1128211742 /nfs/dbraw/zinc/21/17/42/1128211742.db2.gz XMNNAIPQNKABCT-LBPRGKRZSA-N 1 0 272.392 3.807 20 10 CHCDRO CC[C@H]([NH2+][C@H](C1CC1)[C@H]1CCCOC1)c1ccccc1O ZINC000927069899 1128215504 /nfs/dbraw/zinc/21/55/04/1128215504.db2.gz ODOTZMVWJSCACP-QILLFSRXSA-N 1 0 289.419 3.638 20 10 CHCDRO CCCC[N@H+](Cc1c(O)ccc2ccncc21)C1CC1 ZINC000914783770 1128242783 /nfs/dbraw/zinc/24/27/83/1128242783.db2.gz FIQSZQOCSFQMDL-UHFFFAOYSA-N 1 0 270.376 3.705 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)CCc2ccco2)c1 ZINC000035628882 1128319257 /nfs/dbraw/zinc/31/92/57/1128319257.db2.gz KSMBQZCDSPYQIZ-KBPBESRZSA-N 1 0 273.376 3.966 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H](C)CCc2ccco2)c1 ZINC000035628883 1128319409 /nfs/dbraw/zinc/31/94/09/1128319409.db2.gz KSMBQZCDSPYQIZ-ZIAGYGMSSA-N 1 0 273.376 3.966 20 10 CHCDRO CN(Cc1cccs1)c1ccc(C[NH2+]C2CC2)cc1 ZINC000035718038 1128331330 /nfs/dbraw/zinc/33/13/30/1128331330.db2.gz KZSNHEOPACLOOK-UHFFFAOYSA-N 1 0 272.417 3.637 20 10 CHCDRO C[C@H]1CCC[N@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C1 ZINC000915790581 1128338571 /nfs/dbraw/zinc/33/85/71/1128338571.db2.gz WCLQOXGISXLBSS-LBPRGKRZSA-N 1 0 277.408 3.627 20 10 CHCDRO CC[NH+](CC)Cc1cc(OC)cc(C(C)(C)C)c1O ZINC000915790563 1128338605 /nfs/dbraw/zinc/33/86/05/1128338605.db2.gz SXEWUUTYKLBPOB-UHFFFAOYSA-N 1 0 265.397 3.540 20 10 CHCDRO CC[N@H+](Cc1ccccc1)Cc1cc2c(cc1O)CCC2 ZINC000915794086 1128338972 /nfs/dbraw/zinc/33/89/72/1128338972.db2.gz DPQQYWSKPSIOPD-UHFFFAOYSA-N 1 0 281.399 3.903 20 10 CHCDRO CCOCc1cc(C[NH2+]CC2CC(C)(C)C2)ccc1OC ZINC000780590641 1128347840 /nfs/dbraw/zinc/34/78/40/1128347840.db2.gz OORABXSIWYFNMM-UHFFFAOYSA-N 1 0 291.435 3.758 20 10 CHCDRO COc1ccc(N2CCC[N@H+](CCC(C)(C)C)CC2)cc1 ZINC000732982655 1128389825 /nfs/dbraw/zinc/38/98/25/1128389825.db2.gz RMSKOQVPPOUWCJ-UHFFFAOYSA-N 1 0 290.451 3.644 20 10 CHCDRO CC(C)(C)c1cc(O)c(O)c(C[N@@H+]2CC[C@@H](C3CC3)C2)c1 ZINC000763330892 1128391843 /nfs/dbraw/zinc/39/18/43/1128391843.db2.gz FXKWBAGAOUREDF-CYBMUJFWSA-N 1 0 289.419 3.627 20 10 CHCDRO CCCCC[N@H+](CCCOC)Cc1cccc(C)c1O ZINC000780793513 1128450808 /nfs/dbraw/zinc/45/08/08/1128450808.db2.gz PIMTVLFTVKXNFY-UHFFFAOYSA-N 1 0 279.424 3.729 20 10 CHCDRO CSCC[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000154806309 1128571126 /nfs/dbraw/zinc/57/11/26/1128571126.db2.gz KVZPUAHJBHEBCO-AWEZNQCLSA-N 1 0 278.465 3.691 20 10 CHCDRO Cc1cccc(OCC[NH2+]Cc2cc(Cl)ccc2O)c1 ZINC000042896023 1128588949 /nfs/dbraw/zinc/58/89/49/1128588949.db2.gz YRRSWSQIUTTYKX-UHFFFAOYSA-N 1 0 291.778 3.523 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH+]1CCC(C(F)(F)F)CC1 ZINC000156053217 1128624106 /nfs/dbraw/zinc/62/41/06/1128624106.db2.gz SIMKLQHHCDIBCO-UHFFFAOYSA-N 1 0 293.716 3.820 20 10 CHCDRO CC(C)[N@H+](Cc1ccccc1)Cc1cc(F)ccc1O ZINC000778984582 1128673593 /nfs/dbraw/zinc/67/35/93/1128673593.db2.gz GLPZGPACFUWWIW-UHFFFAOYSA-N 1 0 273.351 3.942 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)[C@@H]2CCc3ccccc32)cc1 ZINC000920258687 1128675119 /nfs/dbraw/zinc/67/51/19/1128675119.db2.gz VRMCTBUSPGCPMP-LJQANCHMSA-N 1 0 280.415 3.872 20 10 CHCDRO Oc1ccc(F)cc1C[N@H+](C1CC1)C1CCCCC1 ZINC000778997010 1128675283 /nfs/dbraw/zinc/67/52/83/1128675283.db2.gz YVJVYYVRIIHLDP-UHFFFAOYSA-N 1 0 263.356 3.828 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CC[C@@H](c2ccccc2F)C1 ZINC000779017797 1128680299 /nfs/dbraw/zinc/68/02/99/1128680299.db2.gz XRPZIUQFVIMCCS-GFCCVEGCSA-N 1 0 289.325 3.660 20 10 CHCDRO C[C@@H]1C[C@@H](c2ccccc2)C[N@@H+]1Cc1cc(F)ccc1O ZINC000779020260 1128683228 /nfs/dbraw/zinc/68/32/28/1128683228.db2.gz LBGSTMVPFPJIGN-UKRRQHHQSA-N 1 0 285.362 3.909 20 10 CHCDRO C[C@@H]1CCC[C@H](C)[N@H+](Cc2cc(F)ccc2O)C1 ZINC000779019095 1128683524 /nfs/dbraw/zinc/68/35/24/1128683524.db2.gz DSLXUECPAYBSNP-NEPJUHHUSA-N 1 0 251.345 3.542 20 10 CHCDRO C[C@@]1(c2ccccc2)CC[N@H+](Cc2ccccc2O)C1 ZINC000779022976 1128686961 /nfs/dbraw/zinc/68/69/61/1128686961.db2.gz MZWXBEISTRFVAZ-GOSISDBHSA-N 1 0 267.372 3.556 20 10 CHCDRO C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]Cc1ccc2c(c1)CCO2 ZINC000921066031 1128699579 /nfs/dbraw/zinc/69/95/79/1128699579.db2.gz HLYIJSULDGNYDK-LAQFHYBYSA-N 1 0 259.393 3.536 20 10 CHCDRO c1ccc2c(c1)OCC[C@@H]2[NH2+]Cc1ccc2c(c1)CCCO2 ZINC000921487146 1128709437 /nfs/dbraw/zinc/70/94/37/1128709437.db2.gz CERBYFRINNUTNT-KRWDZBQOSA-N 1 0 295.382 3.625 20 10 CHCDRO COc1ccccc1[C@H](C)[NH2+]Cc1ccc2c(c1)CCCO2 ZINC000921487882 1128710730 /nfs/dbraw/zinc/71/07/30/1128710730.db2.gz ZWUZJWUNPXDXLH-AWEZNQCLSA-N 1 0 297.398 3.871 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCOc2cccc(F)c2)c1 ZINC000185106224 1117764527 /nfs/dbraw/zinc/76/45/27/1117764527.db2.gz JSGVPCAGQQGKLS-CYBMUJFWSA-N 1 0 289.350 3.569 20 10 CHCDRO CCc1nc(C[NH2+][C@@H](C)c2ccc(C)cc2O)cs1 ZINC000185397293 1117820282 /nfs/dbraw/zinc/82/02/82/1117820282.db2.gz KWQAPNXWEDWYRY-NSHDSACASA-N 1 0 276.405 3.570 20 10 CHCDRO CC[C@H](C)[NH2+]Cc1ccc(N2CCC(C)CC2)cc1 ZINC000075824283 1128738556 /nfs/dbraw/zinc/73/85/56/1128738556.db2.gz SHXIVEYMFYQRKT-HNNXBMFYSA-N 1 0 260.425 3.811 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC[C@H]2C2CCC2)cc1C ZINC000728199985 1117869459 /nfs/dbraw/zinc/86/94/59/1117869459.db2.gz OUZUVQLZWMWYBG-INIZCTEOSA-N 1 0 259.393 3.774 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H](CCO)C2CCCCC2)c(O)c1 ZINC000185829255 1117914055 /nfs/dbraw/zinc/91/40/55/1117914055.db2.gz ADJGUEVBYKQSQR-RHSMWYFYSA-N 1 0 291.435 3.683 20 10 CHCDRO CO[C@H](C[NH2+][C@@H](C)c1cc(C)ccc1O)C1CCCC1 ZINC000692973479 1117938213 /nfs/dbraw/zinc/93/82/13/1117938213.db2.gz CAGUHXWXGDAEGL-SUMWQHHRSA-N 1 0 277.408 3.556 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H](C)Cc2ccsc2)c1O ZINC000049154596 1128745618 /nfs/dbraw/zinc/74/56/18/1128745618.db2.gz LOERPIGSEJZCTE-LBPRGKRZSA-N 1 0 291.416 3.573 20 10 CHCDRO CC[N@H+](Cc1cnc(Cl)s1)Cc1ccccc1O ZINC001209472047 1118068981 /nfs/dbraw/zinc/06/89/81/1118068981.db2.gz CHLQWGBXAFCAJX-UHFFFAOYSA-N 1 0 282.796 3.524 20 10 CHCDRO Oc1ccc(-c2ccccc2)cc1C[N@H+]1CC=CCC1 ZINC000779159668 1128760253 /nfs/dbraw/zinc/76/02/53/1128760253.db2.gz PSWVUDMWEFBHMX-UHFFFAOYSA-N 1 0 265.356 3.821 20 10 CHCDRO CC[C@H]([NH2+]C(C1CC1)C1CC1)c1ccc(N(C)C)cc1 ZINC000765350875 1118146961 /nfs/dbraw/zinc/14/69/61/1118146961.db2.gz OTJCAPYCAKHTAL-KRWDZBQOSA-N 1 0 272.436 3.982 20 10 CHCDRO C[C@@H]([NH2+]Cc1cc(O)cc(Cl)c1)c1ccccc1O ZINC001203536436 1118147794 /nfs/dbraw/zinc/14/77/94/1118147794.db2.gz SXHGBLUGKSXXRW-SNVBAGLBSA-N 1 0 277.751 3.602 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CCOC2CCCC2)cc1 ZINC000765417325 1118150046 /nfs/dbraw/zinc/15/00/46/1118150046.db2.gz QDGGAUCVOFLHAL-HNNXBMFYSA-N 1 0 290.451 3.753 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCS[C@@H]1C)c1cc(Cl)ccc1O ZINC000842927038 1118170127 /nfs/dbraw/zinc/17/01/27/1118170127.db2.gz CHVPWNPJFPNAIE-JIMOISOXSA-N 1 0 285.840 3.980 20 10 CHCDRO CC(C)=CCC[C@H](C)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000765607348 1118181436 /nfs/dbraw/zinc/18/14/36/1118181436.db2.gz BKDJBUWPPVUGOC-AWEZNQCLSA-N 1 0 259.393 3.846 20 10 CHCDRO CC(C)=CC[NH2+][C@H](C)c1cc(Br)ccc1O ZINC000188447007 1128762324 /nfs/dbraw/zinc/76/23/24/1128762324.db2.gz OFTVBKBGVZQVKI-SNVBAGLBSA-N 1 0 284.197 3.772 20 10 CHCDRO CCOC(C)(C)C[NH2+][C@@H](CC)c1ccc(N(C)C)cc1 ZINC000188684792 1128764534 /nfs/dbraw/zinc/76/45/34/1128764534.db2.gz VGNOQMAYRIRGIG-INIZCTEOSA-N 1 0 278.440 3.608 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CC[C@H]3CCC[C@@H]3C2)c1O ZINC001140181946 1118246364 /nfs/dbraw/zinc/24/63/64/1118246364.db2.gz XXUSRHARAXGKIM-HUUCEWRRSA-N 1 0 259.393 3.631 20 10 CHCDRO COc1cnccc1[C@H](C)[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000188797716 1128765114 /nfs/dbraw/zinc/76/51/14/1128765114.db2.gz DWIITAXKAZDMQU-STQMWFEESA-N 1 0 286.375 3.516 20 10 CHCDRO COc1cnccc1[C@H](C)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000188784397 1128765180 /nfs/dbraw/zinc/76/51/80/1128765180.db2.gz FZOPBZKCVNAPFZ-KBPBESRZSA-N 1 0 299.418 3.568 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCC[C@@H]2c2nccs2)c1O ZINC001140182746 1118250522 /nfs/dbraw/zinc/25/05/22/1118250522.db2.gz YTFOSIMJNIYQLO-CQSZACIVSA-N 1 0 288.416 3.803 20 10 CHCDRO COc1cccc2c1CC[N@H+](Cc1c(C)ccc(C)c1O)C2 ZINC001140184644 1118255132 /nfs/dbraw/zinc/25/51/32/1118255132.db2.gz CNNMQFGLWOTRCX-UHFFFAOYSA-N 1 0 297.398 3.576 20 10 CHCDRO CC(C)c1ccc(O)c(C[NH2+][C@@H](C)c2ccns2)c1 ZINC001207025454 1118312761 /nfs/dbraw/zinc/31/27/61/1118312761.db2.gz GRWHJSYHNWAAEB-NSHDSACASA-N 1 0 276.405 3.823 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cc(F)ccc2C)c1 ZINC000189332211 1128770842 /nfs/dbraw/zinc/77/08/42/1128770842.db2.gz FINHVKNGVPILRL-LBPRGKRZSA-N 1 0 289.350 3.699 20 10 CHCDRO CCOCc1cc(C[NH2+]C2(CC)CCC2)ccc1OC ZINC000177712887 1118381876 /nfs/dbraw/zinc/38/18/76/1118381876.db2.gz KRNDBVWCNPHNLX-UHFFFAOYSA-N 1 0 277.408 3.654 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)CCC(C)(C)C)c(O)c1 ZINC000237246355 1118492299 /nfs/dbraw/zinc/49/22/99/1118492299.db2.gz XJRSWDORYTWZOM-GFCCVEGCSA-N 1 0 265.397 3.705 20 10 CHCDRO CC[C@H](C)C[C@@H](C)[NH2+][C@@H](C)c1cc(OC)ccc1O ZINC000088293785 1118516129 /nfs/dbraw/zinc/51/61/29/1118516129.db2.gz VXJAGCRRFLBDPC-XQQFMLRXSA-N 1 0 265.397 3.876 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CCc1cscn1 ZINC000111627240 1118522030 /nfs/dbraw/zinc/52/20/30/1118522030.db2.gz UMVBSBDZBDWEIG-YPMHNXCESA-N 1 0 288.416 3.538 20 10 CHCDRO CC1(C)CC[C@@H]([NH2+]Cc2c(O)cccc2Br)C1 ZINC000706834291 1118549083 /nfs/dbraw/zinc/54/90/83/1118549083.db2.gz UCDORHFGLIQWLZ-SNVBAGLBSA-N 1 0 298.224 3.823 20 10 CHCDRO Oc1cccc(Br)c1C[NH2+]CC1CCCCC1 ZINC000706843032 1118552857 /nfs/dbraw/zinc/55/28/57/1118552857.db2.gz LTSVPYPPAZMFST-UHFFFAOYSA-N 1 0 298.224 3.825 20 10 CHCDRO CC[C@H]1CCCCC[N@@H+]1Cc1cc(OC)c(OC)cc1O ZINC000180330608 1128788099 /nfs/dbraw/zinc/78/80/99/1128788099.db2.gz QOTAWQBBRRIBGD-AWEZNQCLSA-N 1 0 293.407 3.564 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCCC(C)(F)F)c(O)c1 ZINC000297307273 1118620561 /nfs/dbraw/zinc/62/05/61/1118620561.db2.gz MRADEFNUNJTONB-NSHDSACASA-N 1 0 257.324 3.787 20 10 CHCDRO C[C@@H]1C[C@H](C)C[N@@H+](Cc2c(O)cccc2Br)C1 ZINC000707145859 1118648307 /nfs/dbraw/zinc/64/83/07/1118648307.db2.gz JJWUYTCHYYMASP-PHIMTYICSA-N 1 0 298.224 3.633 20 10 CHCDRO Oc1cc(Cl)ccc1C[N@@H+]1CCC[C@@H]1c1ccncc1 ZINC001140466224 1118751682 /nfs/dbraw/zinc/75/16/82/1118751682.db2.gz BUAZNMGEZAUUKW-OAHLLOKOSA-N 1 0 288.778 3.778 20 10 CHCDRO C[N@H+](Cc1cc2cc(F)ccc2o1)Cc1ccccc1O ZINC000091956500 1118837576 /nfs/dbraw/zinc/83/75/76/1118837576.db2.gz BCXSOIJGFCVLKB-UHFFFAOYSA-N 1 0 285.318 3.910 20 10 CHCDRO Cc1cc(O)c(C[NH+]2CCC(OCC(C)C)CC2)cc1C ZINC000077459308 1128811395 /nfs/dbraw/zinc/81/13/95/1128811395.db2.gz PFOWSCKKCFUSQP-UHFFFAOYSA-N 1 0 291.435 3.646 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCc3ccccc3C2)c1 ZINC000051630821 1119061599 /nfs/dbraw/zinc/06/15/99/1119061599.db2.gz DJDXTTSHSDXZLI-YOEHRIQHSA-N 1 0 281.399 3.909 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000176673560 1119091913 /nfs/dbraw/zinc/09/19/13/1119091913.db2.gz KKDDLCSGDOSSES-CQSZACIVSA-N 1 0 255.361 3.975 20 10 CHCDRO CC[C@H](C)[C@H](C)[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1 ZINC000178604741 1119121236 /nfs/dbraw/zinc/12/12/36/1119121236.db2.gz YZYVBURMFKCHCN-JYJNAYRXSA-N 1 0 290.451 3.608 20 10 CHCDRO C[C@@H]1CC[C@H]([NH2+]Cc2ccc(N(C)C)cc2)[C@@H](C)C1 ZINC000226172780 1119247842 /nfs/dbraw/zinc/24/78/42/1119247842.db2.gz KGNNCCMNPVHWAT-KEYYUXOJSA-N 1 0 260.425 3.667 20 10 CHCDRO CCC(CC)(C[NH2+]Cc1cccc(C)c1O)SC ZINC000224890311 1119336611 /nfs/dbraw/zinc/33/66/11/1119336611.db2.gz RPAYLPFIMSJWRF-UHFFFAOYSA-N 1 0 267.438 3.712 20 10 CHCDRO CCOCC[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000161940689 1119431547 /nfs/dbraw/zinc/43/15/47/1119431547.db2.gz MDIJHXJEQLJROP-INIZCTEOSA-N 1 0 290.451 3.754 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccc2ccccc2c1O)[C@@H]1CCOC1 ZINC000168800994 1119478795 /nfs/dbraw/zinc/47/87/95/1119478795.db2.gz SJFWPODATBDRFA-VNHYZAJKSA-N 1 0 285.387 3.621 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCC(C)(C)C2)c1 ZINC000168861381 1119481645 /nfs/dbraw/zinc/48/16/45/1119481645.db2.gz NZVYJAIOFIVFDC-NEPJUHHUSA-N 1 0 263.381 3.630 20 10 CHCDRO Cc1ccc([C@@H](C)[N@H+](C)Cc2ccccc2O)cc1 ZINC000179557069 1119751685 /nfs/dbraw/zinc/75/16/85/1119751685.db2.gz BUSWAMKOELKSDA-CQSZACIVSA-N 1 0 255.361 3.894 20 10 CHCDRO Cc1c(O)ccc(C[N@H+](Cc2ccccc2)C2CC2)c1O ZINC001140747545 1119794239 /nfs/dbraw/zinc/79/42/39/1119794239.db2.gz FHMCAPSWWKEDSP-UHFFFAOYSA-N 1 0 283.371 3.571 20 10 CHCDRO COc1ccc(C[NH2+]C(C)(C)CC(C)(C)C)c(O)c1OC ZINC000892527542 1119874344 /nfs/dbraw/zinc/87/43/44/1119874344.db2.gz GXYVZHSYNNAKLO-UHFFFAOYSA-N 1 0 295.423 3.714 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[NH2+][C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000694346714 1119874887 /nfs/dbraw/zinc/87/48/87/1119874887.db2.gz QTHDXNXEHCGGTE-BPQIPLTHSA-N 1 0 270.420 3.565 20 10 CHCDRO CC[C@H]1CC[N@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C1 ZINC000755922158 1119921224 /nfs/dbraw/zinc/92/12/24/1119921224.db2.gz DXJYYSALNAXWBZ-LBPRGKRZSA-N 1 0 277.408 3.627 20 10 CHCDRO CCC(CC)C[NH2+]Cc1cc(Br)ccc1O ZINC000163933930 1120024231 /nfs/dbraw/zinc/02/42/31/1120024231.db2.gz NOYANXBHCVSGEE-UHFFFAOYSA-N 1 0 286.213 3.681 20 10 CHCDRO CC(C)[C@H](C)C[NH2+]Cc1cc(Br)ccc1O ZINC000164309378 1120031023 /nfs/dbraw/zinc/03/10/23/1120031023.db2.gz ADBIBOKVRUANIG-SNVBAGLBSA-N 1 0 286.213 3.536 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H]1CCC[C@@H](C)C1 ZINC000226966361 1120107150 /nfs/dbraw/zinc/10/71/50/1120107150.db2.gz DBXXBIKLSKBWAM-RHSMWYFYSA-N 1 0 260.425 3.940 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@H]1CCCC(F)(F)C1)CC2 ZINC000695117520 1120109049 /nfs/dbraw/zinc/10/90/49/1120109049.db2.gz ANERKMCNSUYCJC-RYUDHWBXSA-N 1 0 267.319 3.547 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]CCC1=CCCCC1)CC2 ZINC000311903461 1120117027 /nfs/dbraw/zinc/11/70/27/1120117027.db2.gz QDPIPFLSKXVZSW-OAHLLOKOSA-N 1 0 257.377 3.860 20 10 CHCDRO COCCCCC[N@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000728688790 1120141123 /nfs/dbraw/zinc/14/11/23/1120141123.db2.gz WRNCICCBHLPAJK-UHFFFAOYSA-N 1 0 292.467 3.780 20 10 CHCDRO CCC(CC)[C@H](O)C[NH2+][C@H](CC)c1ccc(N(C)C)cc1 ZINC000765929606 1120213959 /nfs/dbraw/zinc/21/39/59/1120213959.db2.gz WHLOSUCXYONRHG-QZTJIDSGSA-N 1 0 292.467 3.590 20 10 CHCDRO C[C@H]([NH2+][C@H]1CC[C@H]1C)c1ccc2ccccc2c1O ZINC000312026337 1120255424 /nfs/dbraw/zinc/25/54/24/1120255424.db2.gz XMGBFAVMFDTXIU-WQGACYEGSA-N 1 0 255.361 3.995 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCOc2ccccc2)c(O)c1C ZINC000756370402 1120271519 /nfs/dbraw/zinc/27/15/19/1120271519.db2.gz GXXWMDLUBDFQEP-OAHLLOKOSA-N 1 0 285.387 3.739 20 10 CHCDRO Oc1cc2ccccc2cc1C[NH+]1CCC(F)(F)CC1 ZINC001236841397 1128904189 /nfs/dbraw/zinc/90/41/89/1128904189.db2.gz YZSUARSZHWCJSS-UHFFFAOYSA-N 1 0 277.314 3.777 20 10 CHCDRO CC[N@@H+](Cc1c(O)ccc2ccc(OC)cc21)CC1CC1 ZINC000069797434 1128908115 /nfs/dbraw/zinc/90/81/15/1128908115.db2.gz ZIZFXQLBFOUUTP-UHFFFAOYSA-N 1 0 285.387 3.786 20 10 CHCDRO Cc1cc(C[NH2+][C@H](C)c2cccc(O)c2)ccc1N(C)C ZINC000282325400 1120346529 /nfs/dbraw/zinc/34/65/29/1120346529.db2.gz NUCMZPKTGIXDAV-CQSZACIVSA-N 1 0 284.403 3.617 20 10 CHCDRO CCCC(O)(CCC)C[NH2+][C@H](C)c1cc(F)ccc1O ZINC000185500992 1120377850 /nfs/dbraw/zinc/37/78/50/1120377850.db2.gz STTMIQMIOINKBN-GFCCVEGCSA-N 1 0 283.387 3.513 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]C1CCC3(CC3)CC1)CC2 ZINC000695716606 1120404889 /nfs/dbraw/zinc/40/48/89/1120404889.db2.gz LFEZIKUZFBANFE-CQSZACIVSA-N 1 0 257.377 3.692 20 10 CHCDRO CCCC[N@H+](CCc1cccnc1)Cc1ccccc1O ZINC000282334735 1120416958 /nfs/dbraw/zinc/41/69/58/1120416958.db2.gz BGDQSFPJKXHIKH-UHFFFAOYSA-N 1 0 284.403 3.632 20 10 CHCDRO CC[C@](C)(O)C[N@H+](Cc1ccccc1)Cc1ccccc1O ZINC000188579821 1120459238 /nfs/dbraw/zinc/45/92/38/1120459238.db2.gz KDVTUMLJKOGUIC-IBGZPJMESA-N 1 0 299.414 3.555 20 10 CHCDRO CC1(C)CC[C@@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC000162710047 1120585866 /nfs/dbraw/zinc/58/58/66/1120585866.db2.gz TVDKHXMRNBYGOV-MRXNPFEDSA-N 1 0 272.436 3.955 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccsc2Cl)c1 ZINC000312763274 1120615559 /nfs/dbraw/zinc/61/55/59/1120615559.db2.gz PBDGDDMOVKVGEX-VIFPVBQESA-N 1 0 297.807 3.967 20 10 CHCDRO CCCC[N@H+](CCc1ccccn1)Cc1ccccc1O ZINC000282469144 1120697536 /nfs/dbraw/zinc/69/75/36/1120697536.db2.gz NPVKFJFFDMQLII-UHFFFAOYSA-N 1 0 284.403 3.632 20 10 CHCDRO Cc1cccc(C[NH2+]C(C)(C)c2ccc(F)cc2)c1O ZINC000182154156 1128937100 /nfs/dbraw/zinc/93/71/00/1128937100.db2.gz ZGSSDYATHOALDI-UHFFFAOYSA-N 1 0 273.351 3.865 20 10 CHCDRO C[C@H](C[NH2+][C@H]1CCc2cccc(O)c21)c1ccccc1 ZINC000313529980 1120748120 /nfs/dbraw/zinc/74/81/20/1120748120.db2.gz MUEQEGMRLKXXDB-CJNGLKHVSA-N 1 0 267.372 3.773 20 10 CHCDRO CC(C)(C)C(C)(C)[NH2+]Cc1cc(Cl)ccc1O ZINC000310109586 1120793992 /nfs/dbraw/zinc/79/39/92/1120793992.db2.gz DXYMYXMPMHIITI-UHFFFAOYSA-N 1 0 255.789 3.960 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCc2ccc(F)c(F)c2)c1 ZINC000191518954 1128942138 /nfs/dbraw/zinc/94/21/38/1128942138.db2.gz DENANAICNZAMMJ-GFCCVEGCSA-N 1 0 291.341 3.872 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2cncc(C)c2)cc1 ZINC000181843597 1120903964 /nfs/dbraw/zinc/90/39/64/1120903964.db2.gz PMGMXGDQKJVJDO-HNNXBMFYSA-N 1 0 283.419 3.697 20 10 CHCDRO Cc1cccc(OCC[NH2+][C@H](C)c2ccc(N(C)C)cc2)c1 ZINC000314905404 1120979341 /nfs/dbraw/zinc/97/93/41/1120979341.db2.gz CUAOWXYFFLSDJU-MRXNPFEDSA-N 1 0 298.430 3.791 20 10 CHCDRO CO[C@H](C)C[N@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000182382081 1128964083 /nfs/dbraw/zinc/96/40/83/1128964083.db2.gz DLCOCQXCHGSMHW-CVEARBPZSA-N 1 0 299.414 3.990 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)C2CCCC2)c1 ZINC000070305437 1128966046 /nfs/dbraw/zinc/96/60/46/1128966046.db2.gz GNVKTZMWQSMXCT-RYUDHWBXSA-N 1 0 263.381 3.630 20 10 CHCDRO CCC[N@H+](Cc1cc(C(C)(C)C)cc(O)c1O)C1CC1 ZINC000728903282 1121175332 /nfs/dbraw/zinc/17/53/32/1121175332.db2.gz XCVLVMRRFOFMHC-UHFFFAOYSA-N 1 0 277.408 3.770 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H](C)CCSC)cc1 ZINC000766082869 1121193924 /nfs/dbraw/zinc/19/39/24/1121193924.db2.gz HPYDOBDUKPMWQQ-ZIAGYGMSSA-N 1 0 280.481 3.935 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)c2cc3ccccc3o2)c(O)c1 ZINC000064621108 1121201071 /nfs/dbraw/zinc/20/10/71/1121201071.db2.gz PYZWARSKUANIED-GFCCVEGCSA-N 1 0 297.354 3.998 20 10 CHCDRO CC(C)[C@H]([NH2+]Cc1cc2c(cc1O)OCO2)c1ccccc1 ZINC000063255958 1121203101 /nfs/dbraw/zinc/20/31/01/1121203101.db2.gz VTXCBPHDLUULTE-SFHVURJKSA-N 1 0 299.370 3.608 20 10 CHCDRO Cc1cc(C[NH2+][C@H]2CCOC[C@H]2C)c(C)n1-c1ccccc1 ZINC000319022499 1121224555 /nfs/dbraw/zinc/22/45/55/1121224555.db2.gz IDEDYTDXHDUVDE-KUHUBIRLSA-N 1 0 298.430 3.609 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CCCOC(C)C ZINC000020198225 1121231982 /nfs/dbraw/zinc/23/19/82/1121231982.db2.gz IMSSTSORPFRVAI-KGLIPLIRSA-N 1 0 277.408 3.654 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cscc2C)c1 ZINC000094877437 1121238418 /nfs/dbraw/zinc/23/84/18/1121238418.db2.gz XNXBJYYUYDMDRB-NSHDSACASA-N 1 0 277.389 3.622 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+]C(C)(C)COC(C)C)c1O ZINC000840973286 1121319890 /nfs/dbraw/zinc/31/98/90/1121319890.db2.gz HYSLCBCLRUFSTN-UHFFFAOYSA-N 1 0 285.815 3.647 20 10 CHCDRO C[C@H]1CCC[N@H+](Cc2c(O)cccc2OC(F)(F)F)C1 ZINC001237120790 1128980558 /nfs/dbraw/zinc/98/05/58/1128980558.db2.gz SCJKSMPALLGNKS-JTQLQIEISA-N 1 0 289.297 3.523 20 10 CHCDRO CC[N@H+](Cc1cc(F)cc(C(C)=O)c1[O-])[C@H](C)C(C)C ZINC000706462930 1121429648 /nfs/dbraw/zinc/42/96/48/1121429648.db2.gz ZRFMYNKJUYBLDT-LLVKDONJSA-N 1 0 281.371 3.600 20 10 CHCDRO CCc1cccc(C[NH2+]Cc2ccc(Cl)s2)c1O ZINC000709454205 1121470850 /nfs/dbraw/zinc/47/08/50/1121470850.db2.gz IQKAWSMPGRJBRM-UHFFFAOYSA-N 1 0 281.808 3.959 20 10 CHCDRO CCC[N@@H+](Cc1ccccc1O)Cc1ccc(C)nc1C ZINC000187100342 1121530545 /nfs/dbraw/zinc/53/05/45/1121530545.db2.gz AHBMKPPRGBPYGS-UHFFFAOYSA-N 1 0 284.403 3.816 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@H]2CCC[C@@H](F)C2)c(O)c1 ZINC001118177626 1121561498 /nfs/dbraw/zinc/56/14/98/1121561498.db2.gz VFQFPQKWGQIURP-MJBXVCDLSA-N 1 0 265.372 3.940 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCCO[C@H]2C(C)C)c(O)c1 ZINC000248517239 1121573025 /nfs/dbraw/zinc/57/30/25/1121573025.db2.gz PGJLGILSQLLRBW-DAYGRLMNSA-N 1 0 291.435 3.802 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]CCC2CC=CC2)c1O ZINC000724195709 1121648088 /nfs/dbraw/zinc/64/80/88/1121648088.db2.gz XPMUUAHPLQLAPX-UHFFFAOYSA-N 1 0 281.783 3.500 20 10 CHCDRO CCC[N@H+](Cc1cccc(F)c1)Cc1ccccc1O ZINC000727831126 1121750936 /nfs/dbraw/zinc/75/09/36/1121750936.db2.gz JGTZWGOERSAZRU-UHFFFAOYSA-N 1 0 273.351 3.944 20 10 CHCDRO CO[C@H]1CCC[N@H+](Cc2cc(C)cc(C(C)(C)C)c2O)C1 ZINC000728049601 1121760088 /nfs/dbraw/zinc/76/00/88/1121760088.db2.gz HXVWGDUZJRXARF-HNNXBMFYSA-N 1 0 291.435 3.609 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@]2(C)CCCS2)c(Cl)c1 ZINC001178161605 1121768293 /nfs/dbraw/zinc/76/82/93/1121768293.db2.gz PKGWWPGWWBVXBT-AWEZNQCLSA-N 1 0 285.840 3.729 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+][C@@H]2CCc3ccccc32)c1 ZINC000237089210 1121780076 /nfs/dbraw/zinc/78/00/76/1121780076.db2.gz LYSMODQNIFMBBF-QGZVFWFLSA-N 1 0 283.371 3.568 20 10 CHCDRO CN(C)c1cc(F)c(C[NH2+]CC2C(C)(C)C2(C)C)cc1F ZINC001178546028 1121795258 /nfs/dbraw/zinc/79/52/58/1121795258.db2.gz IKYXRQXVHWEUHO-UHFFFAOYSA-N 1 0 296.405 3.803 20 10 CHCDRO Cc1cscc1C[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC001178615198 1121799992 /nfs/dbraw/zinc/79/99/92/1121799992.db2.gz SZFIWGQCSIEJJQ-SNAWJCMRSA-N 1 0 286.444 3.926 20 10 CHCDRO CCC[N@@H+](Cc1cc(C)c(C)cc1O)C[C@@H]1CCCCO1 ZINC000730255736 1121800564 /nfs/dbraw/zinc/80/05/64/1121800564.db2.gz JKJFTMPVLYSPRR-KRWDZBQOSA-N 1 0 291.435 3.790 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C2CC(c3ccccc3)C2)cc1F ZINC000237122361 1121817188 /nfs/dbraw/zinc/81/71/88/1121817188.db2.gz DZHGWHLALZTHFR-UHFFFAOYSA-N 1 0 298.405 3.928 20 10 CHCDRO C[C@@]1([NH2+]Cc2ccc3c(c2)CCCO3)CC=CCC1 ZINC001178930806 1121828139 /nfs/dbraw/zinc/82/81/39/1121828139.db2.gz HOADPJHNKKLRCT-QGZVFWFLSA-N 1 0 257.377 3.600 20 10 CHCDRO CC[NH+](CC)Cc1ccc(N(C)C)c2ccccc12 ZINC001204232703 1121829437 /nfs/dbraw/zinc/82/94/37/1121829437.db2.gz ITWVIDYTBRLXKD-UHFFFAOYSA-N 1 0 256.393 3.748 20 10 CHCDRO CCC(O)(CC)C(C)(C)C[NH2+]Cc1ccc(OC)c(C)c1 ZINC001179135636 1121851499 /nfs/dbraw/zinc/85/14/99/1121851499.db2.gz YZESKENDQQOLGI-UHFFFAOYSA-N 1 0 293.451 3.671 20 10 CHCDRO CC[C@@](C)([NH2+]Cc1ccc(N(C)C)c(F)c1)C1CC1 ZINC001179184314 1121854511 /nfs/dbraw/zinc/85/45/11/1121854511.db2.gz YBVQDTLPLCHXDE-MRXNPFEDSA-N 1 0 264.388 3.560 20 10 CHCDRO CCN(C)c1ccc(C[N@H+](C)[C@H](C)c2cccnc2)cc1 ZINC000773808357 1121862902 /nfs/dbraw/zinc/86/29/02/1121862902.db2.gz KVACVQOXAOSNHO-OAHLLOKOSA-N 1 0 283.419 3.731 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+]Cc2ccc3c(c2)CCO3)c2ccccc21 ZINC000731451110 1121867508 /nfs/dbraw/zinc/86/75/08/1121867508.db2.gz QVAOMCIZSSBAMG-ACJLOTCBSA-N 1 0 279.383 3.960 20 10 CHCDRO CCN(C)c1ccc(C[NH2+][C@H](C)c2cccc(O)c2)cc1 ZINC000773810000 1121867790 /nfs/dbraw/zinc/86/77/90/1121867790.db2.gz HCMHLFUZKANZKD-CQSZACIVSA-N 1 0 284.403 3.699 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@H+]1CCC[C@@H](C)[C@@H]1C ZINC001179858351 1121917302 /nfs/dbraw/zinc/91/73/02/1121917302.db2.gz DBJLRRYTVWTFNH-HIFRSBDPSA-N 1 0 260.425 3.681 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2C[C@H](C)C[C@H]2C)c(Cl)c1 ZINC001179898774 1121919453 /nfs/dbraw/zinc/91/94/53/1121919453.db2.gz UIQUZOGPDXCUSL-GHMZBOCLSA-N 1 0 253.773 3.584 20 10 CHCDRO CC[C@@H]1CCC[N@@H+]1C/C=C\c1ccc(N(C)C)cc1 ZINC001179863577 1121921317 /nfs/dbraw/zinc/92/13/17/1121921317.db2.gz PMPSOVFHVQGDGL-GMNBZTITSA-N 1 0 258.409 3.640 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)c2cnn(C(C)C)c2)cc1C ZINC000732820734 1121941266 /nfs/dbraw/zinc/94/12/66/1121941266.db2.gz NQKCPAHJKQSUFP-CQSZACIVSA-N 1 0 287.407 3.632 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)cc1C)[C@H](C)C(C)C ZINC001180042769 1121941320 /nfs/dbraw/zinc/94/13/20/1121941320.db2.gz JDACAKCUGZWQJN-OAHLLOKOSA-N 1 0 262.441 3.927 20 10 CHCDRO CCOC[C@H]1CCC[N@H+](Cc2cc(C(C)C)ccc2O)C1 ZINC001180235071 1121967656 /nfs/dbraw/zinc/96/76/56/1121967656.db2.gz VALCMSUQWNKIJK-HNNXBMFYSA-N 1 0 291.435 3.764 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2cc(F)ccc2O)[C@@H]2CCCC[C@@H]12 ZINC001180271336 1121972053 /nfs/dbraw/zinc/97/20/53/1121972053.db2.gz ISFPEDDZHKSMQO-UHOFOFEASA-N 1 0 277.383 3.932 20 10 CHCDRO C[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000733322121 1121975656 /nfs/dbraw/zinc/97/56/56/1121975656.db2.gz MYEITAKOGLJVQL-IUODEOHRSA-N 1 0 264.388 3.560 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2CCc3ccccc3C2)cc1F ZINC000733323237 1121975814 /nfs/dbraw/zinc/97/58/14/1121975814.db2.gz RVAKUSHOQCWXGY-QGZVFWFLSA-N 1 0 298.405 3.539 20 10 CHCDRO CCCCCC[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000733322800 1121976034 /nfs/dbraw/zinc/97/60/34/1121976034.db2.gz DSVVJOFFAZJNKW-UHFFFAOYSA-N 1 0 252.377 3.562 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2CCCC[C@H]2C)cc1Cl ZINC001180438277 1121987698 /nfs/dbraw/zinc/98/76/98/1121987698.db2.gz XGUHBEVUSHAGPB-LLVKDONJSA-N 1 0 253.773 3.728 20 10 CHCDRO Cc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(O)cc2O)cc1 ZINC001204275663 1122000133 /nfs/dbraw/zinc/00/01/33/1122000133.db2.gz XWBQHJLPQFFNKY-QGZVFWFLSA-N 1 0 283.371 3.743 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C2Cc3ccccc3C2)cc1Cl ZINC001180624304 1122000297 /nfs/dbraw/zinc/00/02/97/1122000297.db2.gz UZMXJXFOQPXJCR-UHFFFAOYSA-N 1 0 287.790 3.611 20 10 CHCDRO CCCC[N@H+](Cc1ccco1)Cc1ccccc1O ZINC000070975112 1129024545 /nfs/dbraw/zinc/02/45/45/1129024545.db2.gz UQLHMTMMDZESOA-UHFFFAOYSA-N 1 0 259.349 3.788 20 10 CHCDRO C[C@@H](c1ccc(Cl)cc1)[N@H+](C)Cc1ccc(O)cc1O ZINC001204278721 1122010821 /nfs/dbraw/zinc/01/08/21/1122010821.db2.gz JBQSHTKHCLOVSN-NSHDSACASA-N 1 0 291.778 3.944 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CC[C@H](C)C3(CCC3)C2)c1O ZINC000779604352 1129032171 /nfs/dbraw/zinc/03/21/71/1129032171.db2.gz JTSQGFWSNQUBND-AWEZNQCLSA-N 1 0 289.419 3.803 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CC(C)(C)[C@@H]1C1CC1 ZINC001182184596 1122117426 /nfs/dbraw/zinc/11/74/26/1122117426.db2.gz PFSIFHRUXGIXHC-KRWDZBQOSA-N 1 0 272.436 3.681 20 10 CHCDRO c1cc2c(s1)C[N@H+](Cc1ccc(N3CCCC3)cc1)CC2 ZINC001204326276 1122121304 /nfs/dbraw/zinc/12/13/04/1122121304.db2.gz DSLXHONZGMWZNF-UHFFFAOYSA-N 1 0 298.455 3.907 20 10 CHCDRO CO[C@@](C)([C@@H](C)[NH2+]Cc1cc(C(C)C)ccc1O)C1CC1 ZINC001182356440 1122148026 /nfs/dbraw/zinc/14/80/26/1122148026.db2.gz KJCTTXRKHKLLCB-ACJLOTCBSA-N 1 0 291.435 3.809 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)C(C)(C)O)c1cc(Cl)c(Cl)cc1[O-] ZINC000774284336 1122153697 /nfs/dbraw/zinc/15/36/97/1122153697.db2.gz FDUOHGNAMGTGBI-SFYZADRCSA-N 1 0 292.206 3.509 20 10 CHCDRO CC(C)c1ccc(O)c(C[N@@H+]2C[C@H](C)[C@@H](C)[C@@H]2C)c1 ZINC001182450841 1122160312 /nfs/dbraw/zinc/16/03/12/1122160312.db2.gz AFRZTEZZALITFH-MJBXVCDLSA-N 1 0 261.409 3.992 20 10 CHCDRO CC[N@H+](CCSC)Cc1c(O)cc(C)cc1Cl ZINC001182742656 1122186725 /nfs/dbraw/zinc/18/67/25/1122186725.db2.gz GBNCJXCMAZDDGO-UHFFFAOYSA-N 1 0 273.829 3.539 20 10 CHCDRO CC(C)c1ccc(O)c(C[N@@H+]2CC[C@]3(C2)CCCOC3)c1 ZINC001182872882 1122192347 /nfs/dbraw/zinc/19/23/47/1122192347.db2.gz HDXIJBIUUJLREI-SFHVURJKSA-N 1 0 289.419 3.518 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc(Br)cc(C)c1O)C1CC1 ZINC001182929923 1122198601 /nfs/dbraw/zinc/19/86/01/1122198601.db2.gz PMKXXHFWVOEVRB-CYBMUJFWSA-N 1 0 298.224 3.741 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CC[C@@H]3C[C@@H]3C2)c(C(F)(F)F)c1 ZINC001183012386 1122199714 /nfs/dbraw/zinc/19/97/14/1122199714.db2.gz RQGIJGXGOQITGY-DGCLKSJQSA-N 1 0 298.352 3.613 20 10 CHCDRO Cc1csc(C2([NH2+][C@H](C)c3ccccc3O)CCC2)n1 ZINC000272793862 1122212921 /nfs/dbraw/zinc/21/29/21/1122212921.db2.gz AEVIZUYHDUTZFZ-GFCCVEGCSA-N 1 0 288.416 3.887 20 10 CHCDRO C[C@@H]([NH2+]C1CC(c2ccccc2)C1)c1ccccc1O ZINC000272805549 1122213392 /nfs/dbraw/zinc/21/33/92/1122213392.db2.gz CCRZKXUMJNLOMT-IUDNXUCKSA-N 1 0 267.372 3.989 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCO[C@H](C(C)(C)C)C1)c1ccccc1O ZINC000272803932 1122213792 /nfs/dbraw/zinc/21/37/92/1122213792.db2.gz BVOAYNYNDAAAAI-ZENOOKHLSA-N 1 0 277.408 3.637 20 10 CHCDRO COc1ccc(O)c(C[NH+]2CC([C@H]3CCC[C@@H](C)C3)C2)c1 ZINC001183442192 1122223442 /nfs/dbraw/zinc/22/34/42/1122223442.db2.gz CTDPVKTWHYGMID-KGLIPLIRSA-N 1 0 289.419 3.659 20 10 CHCDRO C[C@H]([NH2+]CC[C@H]1CCO[C@H](C)C1)c1ccc(N(C)C)cc1 ZINC000273294382 1122226699 /nfs/dbraw/zinc/22/66/99/1122226699.db2.gz SSKCERQIVACCIY-PMPSAXMXSA-N 1 0 290.451 3.608 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCO[C@H](C)C1)c1cc(Cl)ccc1O ZINC000273347906 1122229478 /nfs/dbraw/zinc/22/94/78/1122229478.db2.gz BBCFRRYUCUGDAT-WOPDTQHZSA-N 1 0 283.799 3.511 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)c2cc(Cl)ccc2O)cn1 ZINC000273363690 1122229816 /nfs/dbraw/zinc/22/98/16/1122229816.db2.gz DLSYWIMSZIQFAY-LLVKDONJSA-N 1 0 276.767 3.600 20 10 CHCDRO Cc1ccn2cc(C[NH2+][C@H](C)c3cc(C)ccc3O)nc2c1 ZINC000273366826 1122229901 /nfs/dbraw/zinc/22/99/01/1122229901.db2.gz BRJQXQNQICYWSW-CQSZACIVSA-N 1 0 295.386 3.508 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(Cl)nc2)c(O)c1C ZINC000273387106 1122230728 /nfs/dbraw/zinc/23/07/28/1122230728.db2.gz JUWJWPOMUCSLCA-LBPRGKRZSA-N 1 0 290.794 3.908 20 10 CHCDRO COCC[C@H]([NH2+][C@@H](C)c1cc(F)ccc1O)c1ccco1 ZINC000273391113 1122232020 /nfs/dbraw/zinc/23/20/20/1122232020.db2.gz DNDKQVORCMZDNW-FZMZJTMJSA-N 1 0 293.338 3.553 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCO[C@H](CC(C)C)C2)c(O)c1 ZINC000273451659 1122233912 /nfs/dbraw/zinc/23/39/12/1122233912.db2.gz GCMYUMHOZRULDP-ARFHVFGLSA-N 1 0 291.435 3.945 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCCc2nccs2)c(O)c1C ZINC000273503511 1122236497 /nfs/dbraw/zinc/23/64/97/1122236497.db2.gz QOENEIMWJRDCLK-CYBMUJFWSA-N 1 0 290.432 3.749 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)[C@H]1CCCCO1)c1cc(Cl)ccc1O ZINC000273505208 1122236779 /nfs/dbraw/zinc/23/67/79/1122236779.db2.gz QXAUBPBFKMCWEL-ZIBATOQPSA-N 1 0 283.799 3.654 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCc3c2cccc3O)c(O)c1 ZINC000273606063 1122239985 /nfs/dbraw/zinc/23/99/85/1122239985.db2.gz UEQZSGKFPWCZSL-WBMJQRKESA-N 1 0 283.371 3.744 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](c2ccccc2)N(C)C)c(O)c1 ZINC000192907546 1129046858 /nfs/dbraw/zinc/04/68/58/1129046858.db2.gz UIRNPGWWSRBRFJ-YJBOKZPZSA-N 1 0 298.430 3.654 20 10 CHCDRO C[C@@]1(F)CCCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC001203650877 1122415230 /nfs/dbraw/zinc/41/52/30/1122415230.db2.gz FMJDSDNEUMFEPV-CQSZACIVSA-N 1 0 271.763 3.760 20 10 CHCDRO Cc1cccc(OC[C@@H](C)[NH2+][C@@H](C)c2ccccc2O)c1 ZINC000183438537 1129055149 /nfs/dbraw/zinc/05/51/49/1129055149.db2.gz MODUMOCBDHBDEB-CABCVRRESA-N 1 0 285.387 3.819 20 10 CHCDRO Cc1ccc([C@@H](C[NH2+][C@H](C)c2ccccc2O)N(C)C)cc1 ZINC000183468016 1129056989 /nfs/dbraw/zinc/05/69/89/1129056989.db2.gz AVRFXKXFWHGBBT-CRAIPNDOSA-N 1 0 298.430 3.654 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C2(Cc3ccccc3)CC2)cc1F ZINC000775328109 1122518125 /nfs/dbraw/zinc/51/81/25/1122518125.db2.gz XIXGCNIIEHERFM-UHFFFAOYSA-N 1 0 298.405 3.757 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C23CC4CC(CC(C4)C2)C3)c1 ZINC000071403620 1129060386 /nfs/dbraw/zinc/06/03/86/1129060386.db2.gz BAVJRVQIACUTTB-UHFFFAOYSA-N 1 0 271.404 3.759 20 10 CHCDRO COc1ccsc1C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000775363302 1122528435 /nfs/dbraw/zinc/52/84/35/1122528435.db2.gz MLNTZQPZSBZILO-GFCCVEGCSA-N 1 0 290.432 3.674 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CCCO[C@@H]2CC(C)C)cc1C ZINC000775367613 1122530329 /nfs/dbraw/zinc/53/03/29/1122530329.db2.gz ALYMGDVCLPANHC-SJLPKXTDSA-N 1 0 291.435 3.687 20 10 CHCDRO C[C@@H](C[NH2+][C@@H](C)c1ccccc1O)Oc1ccc(F)cc1 ZINC000183534784 1129060644 /nfs/dbraw/zinc/06/06/44/1129060644.db2.gz NCXUOPGUMLUTJM-STQMWFEESA-N 1 0 289.350 3.649 20 10 CHCDRO COc1cccc(F)c1[C@@H](C)[NH2+][C@H](C)c1ccccc1O ZINC000183533460 1129060807 /nfs/dbraw/zinc/06/08/07/1129060807.db2.gz PSCRNVLYHKQOMX-VXGBXAGGSA-N 1 0 289.350 3.952 20 10 CHCDRO Cc1ccccc1O[C@H](C)C[NH2+][C@@H](C)c1ccccc1O ZINC000183534436 1129061078 /nfs/dbraw/zinc/06/10/78/1129061078.db2.gz QBFCCSWOBVMVHP-CABCVRRESA-N 1 0 285.387 3.819 20 10 CHCDRO CC[C@@H]([NH2+]Cc1c(C)nc2ccccn21)c1ccccc1O ZINC000775414947 1122557732 /nfs/dbraw/zinc/55/77/32/1122557732.db2.gz MDBXZSMGQARPTQ-OAHLLOKOSA-N 1 0 295.386 3.589 20 10 CHCDRO CCOc1cc(C)ccc1C[NH2+][C@H](C)c1ccccc1O ZINC000183554869 1129065196 /nfs/dbraw/zinc/06/51/96/1129065196.db2.gz WTGDBQZVHJEDDH-CQSZACIVSA-N 1 0 285.387 3.950 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cccnc1)c1cc(Cl)ccc1O ZINC000775482853 1122615280 /nfs/dbraw/zinc/61/52/80/1122615280.db2.gz DJPHNBVPMRHUKR-CQSZACIVSA-N 1 0 276.767 3.682 20 10 CHCDRO CC[C@@H]([NH2+]CCN(C)C1CCCCC1)c1ccccc1O ZINC000775489071 1122618250 /nfs/dbraw/zinc/61/82/50/1122618250.db2.gz MQVHPZBZBFNNGX-QGZVFWFLSA-N 1 0 290.451 3.697 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1C[C@H]1C)c1cc(Cl)ccc1O ZINC000775488562 1122620559 /nfs/dbraw/zinc/62/05/59/1122620559.db2.gz IZBFUZIMWYLEGE-NRUUGDAUSA-N 1 0 253.773 3.742 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](C)N1CCC(C)CC1)c1ccccc1O ZINC000775497159 1122626656 /nfs/dbraw/zinc/62/66/56/1122626656.db2.gz NQZHASXLBDVMOG-NVXWUHKLSA-N 1 0 290.451 3.553 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](C)N1CCC(C)CC1)c1ccccc1O ZINC000775497160 1122626781 /nfs/dbraw/zinc/62/67/81/1122626781.db2.gz NQZHASXLBDVMOG-RDJZCZTQSA-N 1 0 290.451 3.553 20 10 CHCDRO CC[C@H]([NH2+]Cc1cscn1)c1cc(Cl)ccc1O ZINC000775500087 1122627740 /nfs/dbraw/zinc/62/77/40/1122627740.db2.gz NVWRGGJMMJIFKR-LBPRGKRZSA-N 1 0 282.796 3.743 20 10 CHCDRO CC[C@@H]([NH2+]CCOCC1CC1)c1cc(Cl)ccc1O ZINC000775503208 1122628611 /nfs/dbraw/zinc/62/86/11/1122628611.db2.gz DJLIMMHOGAKBAI-CQSZACIVSA-N 1 0 283.799 3.513 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccc(Cl)cn1 ZINC000775501469 1122628827 /nfs/dbraw/zinc/62/88/27/1122628827.db2.gz RHUJUSSLFJIKSA-LLVKDONJSA-N 1 0 288.778 3.521 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CC)COC)c1cc(Cl)ccc1O ZINC000775510204 1122631379 /nfs/dbraw/zinc/63/13/79/1122631379.db2.gz WQRWWTBPWKCNHE-WCQYABFASA-N 1 0 271.788 3.511 20 10 CHCDRO CC[C@@H]([NH2+]CCN1CCC[C@H]1C)c1cc(Cl)ccc1O ZINC000775509466 1122633164 /nfs/dbraw/zinc/63/31/64/1122633164.db2.gz STDVXJOOFSFBTI-IUODEOHRSA-N 1 0 296.842 3.571 20 10 CHCDRO CC[C@H]([NH2+]CC1CCC(OC)CC1)c1ccccc1O ZINC000775510900 1122633730 /nfs/dbraw/zinc/63/37/30/1122633730.db2.gz AOHZXAOJXIRXEE-XUJLQICISA-N 1 0 277.408 3.638 20 10 CHCDRO CC[C@@H]([NH2+]C[C@]1(C)CCCO1)c1cc(Cl)ccc1O ZINC000775514139 1122634866 /nfs/dbraw/zinc/63/48/66/1122634866.db2.gz XEYAHOMBODMLNG-HIFRSBDPSA-N 1 0 283.799 3.655 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CO)CC(C)(C)C)c1cc(Cl)ccc1O ZINC000775522611 1122639709 /nfs/dbraw/zinc/63/97/09/1122639709.db2.gz VPWFPNUDJNTOBV-TZMCWYRMSA-N 1 0 299.842 3.883 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1C[C@@H]1c1ccccc1)c1ccccc1O ZINC000183600104 1129068705 /nfs/dbraw/zinc/06/87/05/1129068705.db2.gz UKWFVBPAEDYNPA-YSVLISHTSA-N 1 0 267.372 3.847 20 10 CHCDRO Cc1cc(C[NH2+][C@@H]2CCC[C@H](C)[C@@H]2C)ccc1N(C)C ZINC001193593151 1122699413 /nfs/dbraw/zinc/69/94/13/1122699413.db2.gz JGXREJXDLAEKFC-JLJPHGGASA-N 1 0 274.452 3.975 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCc2cc(F)ccc2C1)c1ccccc1O ZINC001168407197 1122733693 /nfs/dbraw/zinc/73/36/93/1122733693.db2.gz NAFJPCSGNKHPBN-MLGOLLRUSA-N 1 0 285.362 3.739 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+]2CCC[C@@H](C)C2)c1O ZINC000775638221 1122849064 /nfs/dbraw/zinc/84/90/64/1122849064.db2.gz CITFMYRCOGAKES-SNVBAGLBSA-N 1 0 253.773 3.586 20 10 CHCDRO C[N@H+](Cc1cccs1)Cc1cccc(Cl)c1[O-] ZINC000775641478 1122850167 /nfs/dbraw/zinc/85/01/67/1122850167.db2.gz AIXXFCQMXWTJMF-UHFFFAOYSA-N 1 0 267.781 3.739 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+](C(C)C)C2CC2)c1O ZINC000775653975 1122865895 /nfs/dbraw/zinc/86/58/95/1122865895.db2.gz PSEYSRYGROAPDF-UHFFFAOYSA-N 1 0 253.773 3.727 20 10 CHCDRO CC[C@H]1CCC[N@@H+]1Cc1cc(Cl)cc(C)c1O ZINC000775661789 1122875222 /nfs/dbraw/zinc/87/52/22/1122875222.db2.gz AUNQVWGENYGSDA-ZDUSSCGKSA-N 1 0 253.773 3.728 20 10 CHCDRO CC[C@@H]1CCC[N@@H+]1Cc1cc(Cl)cc(C)c1O ZINC000775661788 1122876111 /nfs/dbraw/zinc/87/61/11/1122876111.db2.gz AUNQVWGENYGSDA-CYBMUJFWSA-N 1 0 253.773 3.728 20 10 CHCDRO Cc1cccc(C[N@@H+]2CC[C@@](C)(c3ccccc3)C2)c1O ZINC000775724125 1122924518 /nfs/dbraw/zinc/92/45/18/1122924518.db2.gz CVNABQDTEHBYTF-LJQANCHMSA-N 1 0 281.399 3.864 20 10 CHCDRO CCC[C@H](C)[C@H]1CCC[N@@H+]1Cc1cc(OC)ccc1O ZINC000775732061 1122928726 /nfs/dbraw/zinc/92/87/26/1122928726.db2.gz LORGETNJVBQSEM-XJKSGUPXSA-N 1 0 277.408 3.801 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](OCC(C)C)C2)c1O ZINC000775737450 1122928837 /nfs/dbraw/zinc/92/88/37/1122928837.db2.gz HGFXAOBDWUZTNV-OAHLLOKOSA-N 1 0 297.826 3.601 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2C[C@@H]3CCCC[C@@]32C)cc1 ZINC001196667341 1122929977 /nfs/dbraw/zinc/92/99/77/1122929977.db2.gz QYERHAUJBFMVJK-WMZOPIPTSA-N 1 0 272.436 3.907 20 10 CHCDRO C[C@@H]([NH2+]Cc1cccc(Cl)n1)c1ccc(N(C)C)cc1 ZINC000775834952 1122985806 /nfs/dbraw/zinc/98/58/06/1122985806.db2.gz WWEKYGFLKCGENU-GFCCVEGCSA-N 1 0 289.810 3.652 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CC1(Cl)Cl)c1ccc(N(C)C)cc1 ZINC000775834055 1122986874 /nfs/dbraw/zinc/98/68/74/1122986874.db2.gz JPQGYNFYBFLFIX-ZYHUDNBSSA-N 1 0 287.234 3.597 20 10 CHCDRO C[C@H]1CC[C@H]([N@H+](C)Cc2ccc(N(C)C)cc2)CC1 ZINC001203936770 1123033140 /nfs/dbraw/zinc/03/31/40/1123033140.db2.gz NDECIFWMWLDQFQ-CZIWCDLHSA-N 1 0 260.425 3.763 20 10 CHCDRO CC(C)c1cccc(C[NH2+]Cc2cc(F)ccc2O)c1 ZINC000775998358 1123033838 /nfs/dbraw/zinc/03/38/38/1123033838.db2.gz UTJSGLCRMITEJC-UHFFFAOYSA-N 1 0 273.351 3.945 20 10 CHCDRO COc1ccc(O)c(C[NH2+]Cc2cccc(C(C)C)c2)c1 ZINC000775994139 1123033914 /nfs/dbraw/zinc/03/39/14/1123033914.db2.gz INGDWOCEUHWYAZ-UHFFFAOYSA-N 1 0 285.387 3.814 20 10 CHCDRO Cc1cccc(C[N@H+]2CCC[C@H](C(F)(F)F)[C@@H]2C)c1O ZINC000776013184 1123035248 /nfs/dbraw/zinc/03/52/48/1123035248.db2.gz LFDDVBTVWZOCBI-AAEUAGOBSA-N 1 0 287.325 3.863 20 10 CHCDRO C[C@@H]1CCC[C@H](C[NH2+]Cc2cc(F)c(N(C)C)cc2F)C1 ZINC001199759391 1123039347 /nfs/dbraw/zinc/03/93/47/1123039347.db2.gz JIGQJWLDJPERJS-OLZOCXBDSA-N 1 0 296.405 3.947 20 10 CHCDRO COc1cccc(C[NH2+]C[C@@H](C)C2CCCCC2)c1O ZINC000776076020 1123053053 /nfs/dbraw/zinc/05/30/53/1123053053.db2.gz AWQSUQSFJZWOIU-CYBMUJFWSA-N 1 0 277.408 3.707 20 10 CHCDRO Cc1ccc2c(c1)[C@H]([NH2+]Cc1cccc(C)c1O)CC2 ZINC000776175401 1123102651 /nfs/dbraw/zinc/10/26/51/1123102651.db2.gz YNDMXPSRPGJDTL-QGZVFWFLSA-N 1 0 267.372 3.786 20 10 CHCDRO CC[C@@H]1CCC[C@@H]1[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC001201449602 1123106848 /nfs/dbraw/zinc/10/68/48/1123106848.db2.gz IMOOAJWKJNVNMW-ANBQXBGZSA-N 1 0 272.436 3.934 20 10 CHCDRO CC[C@H](C)C[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001201511565 1123114003 /nfs/dbraw/zinc/11/40/03/1123114003.db2.gz OGEOOUSICNDMCB-HNNXBMFYSA-N 1 0 260.425 3.765 20 10 CHCDRO [O-]c1c(F)cc(Cl)cc1C[NH2+]CC1(C2CC2)CCC1 ZINC001201596197 1123122183 /nfs/dbraw/zinc/12/21/83/1123122183.db2.gz ZUGCLZRREGMCJB-UHFFFAOYSA-N 1 0 283.774 3.855 20 10 CHCDRO Cc1cccc(C[NH2+]C[C@H]2SCCc3ccccc32)c1O ZINC000776222188 1123156974 /nfs/dbraw/zinc/15/69/74/1123156974.db2.gz IAVWBBDRBYXBKH-QGZVFWFLSA-N 1 0 299.439 3.821 20 10 CHCDRO CCC1([NH2+]Cc2cc(Br)cc(C)c2O)CCC1 ZINC000776232660 1123170184 /nfs/dbraw/zinc/17/01/84/1123170184.db2.gz SVOLTDQUFCVRST-UHFFFAOYSA-N 1 0 298.224 3.885 20 10 CHCDRO CCC(CC)[C@H](CC[NH2+]Cc1cccc(C)c1O)OC ZINC000776253508 1123179671 /nfs/dbraw/zinc/17/96/71/1123179671.db2.gz RKGCZVDLALHWKV-INIZCTEOSA-N 1 0 279.424 3.632 20 10 CHCDRO Cc1cc(C[N@@H+]2CCCO[C@@H](C)C2)c(C)n1-c1ccccc1 ZINC001137854064 1123214096 /nfs/dbraw/zinc/21/40/96/1123214096.db2.gz HBRHKEAAIHVXIK-INIZCTEOSA-N 1 0 298.430 3.705 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H](C)[C@@H]2CCCOC2)cc1 ZINC000780747103 1123226806 /nfs/dbraw/zinc/22/68/06/1123226806.db2.gz WMUBQBRDJREOTA-ZMSDIMECSA-N 1 0 290.451 3.608 20 10 CHCDRO C[C@H]([NH2+]Cc1cscn1)c1ccc2ccccc2c1O ZINC000108941649 1123233971 /nfs/dbraw/zinc/23/39/71/1123233971.db2.gz JFPLWWUJAOKDIU-NSHDSACASA-N 1 0 284.384 3.853 20 10 CHCDRO COc1cc(C[NH2+][C@@H]2CC[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC000850296918 1123251997 /nfs/dbraw/zinc/25/19/97/1123251997.db2.gz ZWGHMPKKVZALLG-XHDPSFHLSA-N 1 0 277.408 3.586 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CCc2cnccc2C)cc1 ZINC000850355561 1123255587 /nfs/dbraw/zinc/25/55/87/1123255587.db2.gz IXSZYAQNFIYEEB-UHFFFAOYSA-N 1 0 297.446 3.569 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]CC[C@]2(C)CC2(F)F)cc1 ZINC000850380530 1123260155 /nfs/dbraw/zinc/26/01/55/1123260155.db2.gz IGRBPJHTVNKFLP-YIEVGGLXSA-N 1 0 294.389 3.791 20 10 CHCDRO CC(C)(C)O[C@@H]1C[C@@H]([NH2+]Cc2ccccc2O)C12CCC2 ZINC000850388242 1123261534 /nfs/dbraw/zinc/26/15/34/1123261534.db2.gz KDEZOSHSZHXXNP-HZPDHXFCSA-N 1 0 289.419 3.608 20 10 CHCDRO Oc1ccc(-c2ccccc2)cc1C[NH2+][C@@H]1[C@@H]2CCC[C@@H]21 ZINC000850393606 1123261893 /nfs/dbraw/zinc/26/18/93/1123261893.db2.gz VEISYUCXNUUKRZ-IZZQQSIFSA-N 1 0 279.383 3.947 20 10 CHCDRO CCOc1ccc(C[NH2+][C@H](C)C2CCC(F)CC2)c(O)c1 ZINC000850396156 1123262643 /nfs/dbraw/zinc/26/26/43/1123262643.db2.gz QMMLRDDCCVTIII-DNOWBOINSA-N 1 0 295.398 3.797 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C(C)(C2CC2)C2CC2)cc1C ZINC000850399508 1123262975 /nfs/dbraw/zinc/26/29/75/1123262975.db2.gz YDQZNVKLFINWTR-UHFFFAOYSA-N 1 0 259.393 3.677 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H]2[C@H]3Cc4cc(F)ccc4[C@@H]23)cc1C ZINC000850409151 1123264320 /nfs/dbraw/zinc/26/43/20/1123264320.db2.gz MJEDSIJZGOCTDT-QXAKKESOSA-N 1 0 297.373 3.576 20 10 CHCDRO COc1cccc(O)c1C[NH2+][C@@H]1CCCc2c(C)cccc21 ZINC000850411501 1123264540 /nfs/dbraw/zinc/26/45/40/1123264540.db2.gz CYIRTMNQIHEARQ-QGZVFWFLSA-N 1 0 297.398 3.876 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)C(C)(C)C(F)F ZINC000850431400 1123266040 /nfs/dbraw/zinc/26/60/40/1123266040.db2.gz WMMCCKLIAVTGNF-SNVBAGLBSA-N 1 0 288.357 3.661 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cc2cnccc2o1 ZINC000850431084 1123266274 /nfs/dbraw/zinc/26/62/74/1123266274.db2.gz YTXYDBWTSNQTKU-GFCCVEGCSA-N 1 0 294.354 3.614 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)C(C)(C)C(F)F ZINC000850431398 1123266575 /nfs/dbraw/zinc/26/65/75/1123266575.db2.gz WMMCCKLIAVTGNF-JTQLQIEISA-N 1 0 288.357 3.661 20 10 CHCDRO CC[C@@H](COCC1CC1)[NH2+][C@H](C)c1ccc(C)cc1O ZINC000850492287 1123274048 /nfs/dbraw/zinc/27/40/48/1123274048.db2.gz CRFGHLNVFOZGOG-HIFRSBDPSA-N 1 0 277.408 3.556 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CC)COCC1CC1)c1ccc(C)cc1O ZINC000850493130 1123274185 /nfs/dbraw/zinc/27/41/85/1123274185.db2.gz HKMUSJDGMZWZOX-DOTOQJQBSA-N 1 0 291.435 3.947 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1cscn1)c1ccc(C)cc1O ZINC000850511710 1123278077 /nfs/dbraw/zinc/27/80/77/1123278077.db2.gz LRDYUYQLOMRFSK-YPMHNXCESA-N 1 0 276.405 3.959 20 10 CHCDRO CCO[C@H]1C[C@H]([NH2+][C@@H](C)c2ccc3ccccc3c2O)C1 ZINC000850515576 1123278640 /nfs/dbraw/zinc/27/86/40/1123278640.db2.gz YYHHPDNHMSKDQC-QEJZJMRPSA-N 1 0 285.387 3.764 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2C[C@@H](O)c3ccccc32)c(O)c1C ZINC000850526987 1123281763 /nfs/dbraw/zinc/28/17/63/1123281763.db2.gz DNDQFCMKKLAZOI-DOPJRALCSA-N 1 0 297.398 3.838 20 10 CHCDRO CC[C@H]([NH2+][C@H]1C[C@@H](O)c2ccccc21)c1ccccc1O ZINC000850530244 1123284881 /nfs/dbraw/zinc/28/48/81/1123284881.db2.gz XTTKWQMIMRVCPM-XYJFISCASA-N 1 0 283.371 3.611 20 10 CHCDRO C[C@H]([NH2+]CC[C@]1(C)CC1(F)F)c1ccc(N(C)C)cc1 ZINC000850536200 1123286775 /nfs/dbraw/zinc/28/67/75/1123286775.db2.gz IHERMYBWGKMFNN-SWLSCSKDSA-N 1 0 282.378 3.839 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC[C@@]2(C)CC2(F)F)c(O)c1 ZINC000850537671 1123287758 /nfs/dbraw/zinc/28/77/58/1123287758.db2.gz WXTLHDDXDDVSSV-RISCZKNCSA-N 1 0 269.335 3.787 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCc3ccc(O)cc32)c(O)c1 ZINC000850543309 1123289171 /nfs/dbraw/zinc/28/91/71/1123289171.db2.gz HPEUNDOTHRSVMN-SJCJKPOMSA-N 1 0 283.371 3.744 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCc3ccc(O)cc32)c1 ZINC000850543199 1123289387 /nfs/dbraw/zinc/28/93/87/1123289387.db2.gz GJJXAEPDXCGSTH-YVEFUNNKSA-N 1 0 283.371 3.744 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H](C)C2CCC(F)CC2)c1O ZINC000850553725 1123290727 /nfs/dbraw/zinc/29/07/27/1123290727.db2.gz BPXPUNWMRHNXKW-FEPKRQSRSA-N 1 0 295.398 3.968 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1O)C1CCC(F)CC1 ZINC000850553987 1123290985 /nfs/dbraw/zinc/29/09/85/1123290985.db2.gz GBPFMNUOKWOELP-KBHBFKLGSA-N 1 0 265.372 3.960 20 10 CHCDRO C[C@H]([NH2+]CC1=CCCC1)c1ccc(Cl)cc1O ZINC000850556215 1123291015 /nfs/dbraw/zinc/29/10/15/1123291015.db2.gz DRTSBRULMCVKTF-JTQLQIEISA-N 1 0 251.757 3.807 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCc2cccc(O)c21)C1CCC(F)CC1 ZINC000850555767 1123291215 /nfs/dbraw/zinc/29/12/15/1123291215.db2.gz QDERRIUOCIIBSI-BNQIPGGESA-N 1 0 277.383 3.886 20 10 CHCDRO CC[C@@H]([NH2+]CCC1SCCS1)c1ccc(C)cc1O ZINC000850568841 1123293689 /nfs/dbraw/zinc/29/36/89/1123293689.db2.gz KUAMNEDISQONLS-CYBMUJFWSA-N 1 0 297.489 3.938 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1nccn1C)c1ccc2ccccc2c1O ZINC000850572940 1123295208 /nfs/dbraw/zinc/29/52/08/1123295208.db2.gz QTBFZWFSMINOIX-OLZOCXBDSA-N 1 0 295.386 3.691 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCC2SCCS2)c(O)c1C ZINC000850571104 1123295500 /nfs/dbraw/zinc/29/55/00/1123295500.db2.gz QIBMVDMDBPZHRS-LBPRGKRZSA-N 1 0 297.489 3.856 20 10 CHCDRO CCN(CC[NH2+][C@H](C)c1ccccc1O)c1ccccc1C ZINC000783504242 1123312219 /nfs/dbraw/zinc/31/22/19/1123312219.db2.gz WREKOILZSSVOCW-MRXNPFEDSA-N 1 0 298.430 3.878 20 10 CHCDRO C[C@H](C[NH2+][C@@H](C)c1ccccc1O)c1ccc(F)cc1 ZINC000783508737 1123398844 /nfs/dbraw/zinc/39/88/44/1123398844.db2.gz KQTZGACBWVIIDO-OLZOCXBDSA-N 1 0 273.351 3.986 20 10 CHCDRO C[C@@H]1CCC[C@H]([NH2+]Cc2ccc(N(C)C)cc2)[C@H]1C ZINC000252113854 1123406888 /nfs/dbraw/zinc/40/68/88/1123406888.db2.gz IEZVUZMFJTVTHC-KEYYUXOJSA-N 1 0 260.425 3.667 20 10 CHCDRO c1ccc([C@@H]2C[C@@H]2C[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC000111398673 1123442443 /nfs/dbraw/zinc/44/24/43/1123442443.db2.gz KIMHWAMCOSFRCN-MSOLQXFVSA-N 1 0 279.383 3.515 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCOC2CCCCC2)c(O)c1 ZINC000111635676 1123457157 /nfs/dbraw/zinc/45/71/57/1123457157.db2.gz CNVPQGRKJPGGBZ-AWEZNQCLSA-N 1 0 277.408 3.701 20 10 CHCDRO C[C@@H]([NH2+]Cc1cccc(N)c1)c1cc2c(cc1O)CCCC2 ZINC000854217007 1123478208 /nfs/dbraw/zinc/47/82/08/1123478208.db2.gz GZLQAHPYUZVONE-CYBMUJFWSA-N 1 0 296.414 3.704 20 10 CHCDRO COc1cccc(C[NH2+][C@H]2CCCC[C@H]2C(C)C)c1O ZINC000112675762 1123496017 /nfs/dbraw/zinc/49/60/17/1123496017.db2.gz RFCHLLPMTCHUHM-GJZGRUSLSA-N 1 0 277.408 3.705 20 10 CHCDRO Cc1cccc(C[NH2+][C@H]2c3ccccc3CC[C@@H]2F)c1O ZINC000895693154 1123505432 /nfs/dbraw/zinc/50/54/32/1123505432.db2.gz YZTRBBDJPMDXRJ-IRXDYDNUSA-N 1 0 285.362 3.816 20 10 CHCDRO Oc1c(C[N@@H+]2CC[C@H]([C@@H]3CCCO3)C2)ccc2ccccc21 ZINC000895848599 1123521524 /nfs/dbraw/zinc/52/15/24/1123521524.db2.gz SEKLUKUBRXQVRZ-YJBOKZPZSA-N 1 0 297.398 3.546 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C[C@H]2C[C@H]2c2ccccc2)c1 ZINC000113341236 1123522009 /nfs/dbraw/zinc/52/20/09/1123522009.db2.gz PJBMICLWAHVKGR-WBVHZDCISA-N 1 0 267.372 3.594 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H]2C[C@@H]3CC[C@@H](C3)C2)cc1F ZINC001648965837 1123550190 /nfs/dbraw/zinc/55/01/90/1123550190.db2.gz VFDOJOYZPZRIBV-NHAGDIPZSA-N 1 0 276.399 3.560 20 10 CHCDRO CCCc1ccc(C[NH2+]Cc2ccc3c(c2)CCO3)s1 ZINC000856768525 1123566785 /nfs/dbraw/zinc/56/67/85/1123566785.db2.gz XPIYAFQAUNFGOS-UHFFFAOYSA-N 1 0 287.428 3.925 20 10 CHCDRO Oc1c(C[NH2+]CC[C@H]2CC2(F)F)ccc2ccccc21 ZINC000857059713 1123583257 /nfs/dbraw/zinc/58/32/57/1123583257.db2.gz XIEHQYDPVFMEIX-ZDUSSCGKSA-N 1 0 277.314 3.680 20 10 CHCDRO C[C@@H]([NH2+]CC[C@H]1CC1(F)F)c1cc2c(cc1O)CCCC2 ZINC000857082832 1123585858 /nfs/dbraw/zinc/58/58/58/1123585858.db2.gz YKNKUTHXAOOHTM-RISCZKNCSA-N 1 0 295.373 3.967 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2ccc(N(C)C)cc2C)s1 ZINC000115629411 1123620371 /nfs/dbraw/zinc/62/03/71/1123620371.db2.gz JROWJQATOFWRQC-UHFFFAOYSA-N 1 0 274.433 3.721 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2ccc(N(C)C)cc2C)cc1F ZINC000115629453 1123620412 /nfs/dbraw/zinc/62/04/12/1123620412.db2.gz SKEHTXAKJXYTBT-UHFFFAOYSA-N 1 0 286.394 3.798 20 10 CHCDRO COc1ccc([C@H](C)[NH2+]Cc2cccc(C)c2O)cc1C ZINC000896803944 1123625787 /nfs/dbraw/zinc/62/57/87/1123625787.db2.gz OZSNRFYCKMQVGB-AWEZNQCLSA-N 1 0 285.387 3.868 20 10 CHCDRO C[C@@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)c1ccccc1 ZINC000858086654 1123630406 /nfs/dbraw/zinc/63/04/06/1123630406.db2.gz LXEBPPPKWBVMDU-GFCCVEGCSA-N 1 0 290.357 3.882 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2cnc(C(C)(C)C)s2)c1 ZINC000858237285 1123639088 /nfs/dbraw/zinc/63/90/88/1123639088.db2.gz IXYABMZLFDIYGL-UHFFFAOYSA-N 1 0 290.432 3.744 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C/C=C\c2ccc(N(C)C)cc2)c1 ZINC000858239686 1123639117 /nfs/dbraw/zinc/63/91/17/1123639117.db2.gz SDSZAABBQVCXFV-PLNGDYQASA-N 1 0 296.414 3.570 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2cnc(C3CCC3)s2)c1 ZINC000858237626 1123639176 /nfs/dbraw/zinc/63/91/76/1123639176.db2.gz NTGLGUZXSJBAKT-UHFFFAOYSA-N 1 0 288.416 3.714 20 10 CHCDRO Cc1cc(C[NH2+]Cc2cccn2C)c(C)n1-c1ccccc1 ZINC000858292843 1123642545 /nfs/dbraw/zinc/64/25/45/1123642545.db2.gz GOSLJCCDSYUENI-UHFFFAOYSA-N 1 0 293.414 3.722 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CC[C@H]2CCCOC2)cc1 ZINC000858445275 1123654764 /nfs/dbraw/zinc/65/47/64/1123654764.db2.gz DXBAJDUFJXFUKP-JKSUJKDBSA-N 1 0 290.451 3.610 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CO[C@H](C2CC2)C1)c1cc(Cl)ccc1O ZINC000858547927 1123661236 /nfs/dbraw/zinc/66/12/36/1123661236.db2.gz PMBBZLVKFDWNIU-INWMFGNUSA-N 1 0 295.810 3.654 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CO[C@H](C2CC2)C1)c1cc(Cl)ccc1O ZINC000858547933 1123661247 /nfs/dbraw/zinc/66/12/47/1123661247.db2.gz PMBBZLVKFDWNIU-NOLJZWGESA-N 1 0 295.810 3.654 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CO[C@@H](C2CC2)C1)c1cc(Cl)ccc1O ZINC000858547925 1123661702 /nfs/dbraw/zinc/66/17/02/1123661702.db2.gz PMBBZLVKFDWNIU-DUVNUKRYSA-N 1 0 295.810 3.654 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)c1ccc(Cl)cc1O)c1ccns1 ZINC000858576114 1123663654 /nfs/dbraw/zinc/66/36/54/1123663654.db2.gz IIYJXCMNJOWRFU-RKDXNWHRSA-N 1 0 282.796 3.914 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H](c2cncc(F)c2)C2CC2)cc1 ZINC000281403684 1123706228 /nfs/dbraw/zinc/70/62/28/1123706228.db2.gz YXHNEPUEEXJPNQ-SFHVURJKSA-N 1 0 299.393 3.528 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2ccc(F)cc2)c(O)c1 ZINC000284199159 1123748034 /nfs/dbraw/zinc/74/80/34/1123748034.db2.gz RZQZMGREDIWTEP-ZDUSSCGKSA-N 1 0 273.351 3.999 20 10 CHCDRO Cc1cccc(C[NH2+][C@H]2CCSC3(CCC3)C2)c1O ZINC000896950394 1123792455 /nfs/dbraw/zinc/79/24/55/1123792455.db2.gz FVGBDUBARHOJCL-AWEZNQCLSA-N 1 0 277.433 3.609 20 10 CHCDRO C[C@]1(C[NH2+]CCCSc2nccs2)CCCS1 ZINC000862280710 1123798380 /nfs/dbraw/zinc/79/83/80/1123798380.db2.gz BCDQSUCCDWAELM-GFCCVEGCSA-N 1 0 288.507 3.501 20 10 CHCDRO CCc1cccc(C[NH2+][C@H]2CCCc3cccnc32)c1O ZINC000897072464 1123810303 /nfs/dbraw/zinc/81/03/03/1123810303.db2.gz PAXQNSYRCVEMMH-INIZCTEOSA-N 1 0 282.387 3.517 20 10 CHCDRO CCc1cccc(C[NH2+][C@@H](c2ccccn2)C2CCC2)c1O ZINC000862478102 1123813407 /nfs/dbraw/zinc/81/34/07/1123813407.db2.gz SIMFBKZEWPEMKO-GOSISDBHSA-N 1 0 296.414 3.981 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H](C)CSC(C)(C)C)c1 ZINC000862476399 1123813466 /nfs/dbraw/zinc/81/34/66/1123813466.db2.gz SEDNEXWGKLUNFZ-LBPRGKRZSA-N 1 0 267.438 3.710 20 10 CHCDRO Oc1c(C[NH+]2CC(Cc3ccco3)C2)ccc2ccccc21 ZINC000862487780 1123815142 /nfs/dbraw/zinc/81/51/42/1123815142.db2.gz VSWNGVKSKOWFDB-UHFFFAOYSA-N 1 0 293.366 3.813 20 10 CHCDRO CCc1cccc(C[N@@H+]2CC[C@@H](c3ccc(O)cc3)C2)c1O ZINC000862541226 1123817956 /nfs/dbraw/zinc/81/79/56/1123817956.db2.gz QZCHBXLLHUKVQF-MRXNPFEDSA-N 1 0 297.398 3.650 20 10 CHCDRO CC(=O)Nc1cccc([C@H](C)[NH2+][C@H](C)c2ccccc2O)c1 ZINC000192946495 1123867569 /nfs/dbraw/zinc/86/75/69/1123867569.db2.gz FLRSDLXLTQANGA-QWHCGFSZSA-N 1 0 298.386 3.762 20 10 CHCDRO CCSCC[N@H+](Cc1ccco1)Cc1ccccc1O ZINC000119483104 1123872226 /nfs/dbraw/zinc/87/22/26/1123872226.db2.gz TUMPWYSKGPYFKX-UHFFFAOYSA-N 1 0 291.416 3.741 20 10 CHCDRO COc1cc(C[N@H+](CC2CC2)CC2CCC2)c(O)cc1C ZINC000794710158 1123940014 /nfs/dbraw/zinc/94/00/14/1123940014.db2.gz JIOXZNDQRNSWFW-UHFFFAOYSA-N 1 0 289.419 3.721 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCOC(C)(C)C2)c(O)c1C ZINC000120220036 1123945192 /nfs/dbraw/zinc/94/51/92/1123945192.db2.gz SXXMHFFRFLDXHK-ZIAGYGMSSA-N 1 0 277.408 3.617 20 10 CHCDRO CCCCOCCC[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000794796447 1123950007 /nfs/dbraw/zinc/95/00/07/1123950007.db2.gz UJEPSFTXDIYPSK-INIZCTEOSA-N 1 0 279.424 3.948 20 10 CHCDRO CC[C@@H]([NH2+]CC(C)(C)SC)c1ccc(C)cc1O ZINC000794800342 1123950876 /nfs/dbraw/zinc/95/08/76/1123950876.db2.gz CTKLLRFXJKICTL-CYBMUJFWSA-N 1 0 267.438 3.883 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](OC)C(C)(C)C)c1ccc(C)cc1O ZINC000794802984 1123953231 /nfs/dbraw/zinc/95/32/31/1123953231.db2.gz PBFLCJPGONMPAG-GOEBONIOSA-N 1 0 279.424 3.802 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](OC)C(C)(C)C)c1ccc(C)cc1O ZINC000794802986 1123953246 /nfs/dbraw/zinc/95/32/46/1123953246.db2.gz PBFLCJPGONMPAG-ZBFHGGJFSA-N 1 0 279.424 3.802 20 10 CHCDRO CC[C@@H]([NH2+]C1CCC(O)(CC)CC1)c1ccc(C)cc1O ZINC000794810397 1123955532 /nfs/dbraw/zinc/95/55/32/1123955532.db2.gz KZQGYVUANVVMPG-BFHRDPOASA-N 1 0 291.435 3.825 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1ccc[nH]1)c1ccc(C)cc1O ZINC000794814684 1123957901 /nfs/dbraw/zinc/95/79/01/1123957901.db2.gz HYCCHVUKPLDRPD-GXTWGEPZSA-N 1 0 258.365 3.831 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CC)c1ccc(C)cc1O)[C@@H]1CCCO1 ZINC000794815934 1123959141 /nfs/dbraw/zinc/95/91/41/1123959141.db2.gz MKUUQGDJCSAAKM-UXLLHSPISA-N 1 0 277.408 3.699 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CO)CC(C)(C)C)c1ccc(C)cc1O ZINC000794818336 1123959749 /nfs/dbraw/zinc/95/97/49/1123959749.db2.gz RVUKBZYAEOYGAK-UKRRQHHQSA-N 1 0 279.424 3.538 20 10 CHCDRO COC1(C[NH2+][C@@H](C)c2cc(C)ccc2O)CCC(C)CC1 ZINC000794834478 1123964841 /nfs/dbraw/zinc/96/48/41/1123964841.db2.gz NVKPTDRYPZNSIU-DBQDNQAGSA-N 1 0 291.435 3.947 20 10 CHCDRO COCC1CCC([NH2+][C@@H](C)c2cc(Cl)ccc2O)CC1 ZINC000840882342 1123982980 /nfs/dbraw/zinc/98/29/80/1123982980.db2.gz TYTFDMSFRDVTOR-DCBWTQNWSA-N 1 0 297.826 3.901 20 10 CHCDRO Oc1ccccc1C[NH2+]Cc1ccc(CC(F)(F)F)cc1 ZINC000865442508 1123985257 /nfs/dbraw/zinc/98/52/57/1123985257.db2.gz NLNUPKGVPMWDGO-UHFFFAOYSA-N 1 0 295.304 3.787 20 10 CHCDRO CC[C@H]([NH2+][C@@H](CC)[C@H](O)C(C)C)c1ccc(N(C)C)cc1 ZINC000840884156 1123996417 /nfs/dbraw/zinc/99/64/17/1123996417.db2.gz ZUCHOABMWLUFTE-OKZBNKHCSA-N 1 0 292.467 3.589 20 10 CHCDRO COC1([C@H](C)[NH2+][C@H](C)c2cc(Cl)ccc2O)CCC1 ZINC000840884905 1123997271 /nfs/dbraw/zinc/99/72/71/1123997271.db2.gz ROPBYZVIHFORGJ-MNOVXSKESA-N 1 0 283.799 3.654 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C[C@@H]2Cc3ccccc32)cc1 ZINC000314761898 1124001515 /nfs/dbraw/zinc/00/15/15/1124001515.db2.gz QZPMMBFRLONQLQ-SFHVURJKSA-N 1 0 294.442 3.962 20 10 CHCDRO CC[C@](C)([NH2+]Cc1ccccc1O)c1ccc(F)cc1 ZINC000865659865 1124003200 /nfs/dbraw/zinc/00/32/00/1124003200.db2.gz GOGSFGIDZJUELF-KRWDZBQOSA-N 1 0 273.351 3.946 20 10 CHCDRO CCOc1ccc(C[NH2+][C@H](C)c2ccccc2C)c(O)c1 ZINC000865731409 1124009101 /nfs/dbraw/zinc/00/91/01/1124009101.db2.gz MNXYHRQUVPOSBP-CQSZACIVSA-N 1 0 285.387 3.950 20 10 CHCDRO COc1cccc(C[NH2+][C@@H]2CCC[C@@H]2C(C)(C)C)c1O ZINC000840971621 1124067239 /nfs/dbraw/zinc/06/72/39/1124067239.db2.gz QBEZXLMANHGHRG-UONOGXRCSA-N 1 0 277.408 3.705 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccnc(F)c1)c1cc(Cl)ccc1O ZINC000866472563 1124069015 /nfs/dbraw/zinc/06/90/15/1124069015.db2.gz BDYDOCYDHLGPCC-ZDUSSCGKSA-N 1 0 294.757 3.821 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2C[C@H]2C(F)(F)F)c(O)c1 ZINC000866500396 1124073359 /nfs/dbraw/zinc/07/33/59/1124073359.db2.gz RRBIKMYTLHWEOR-HBNTYKKESA-N 1 0 273.298 3.610 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@H]2C(F)(F)F)c2c1c(F)ccc2O ZINC000866499024 1124073777 /nfs/dbraw/zinc/07/37/77/1124073777.db2.gz CWQBXKAJGJTLPP-ZXZZCXTASA-N 1 0 289.272 3.620 20 10 CHCDRO CC[C@@H]([NH2+]C1Cc2ccccc2C1)c1ccccc1O ZINC000121092435 1124074963 /nfs/dbraw/zinc/07/49/63/1124074963.db2.gz DHFSTJPLDNYVRJ-QGZVFWFLSA-N 1 0 267.372 3.600 20 10 CHCDRO CC[C@H]([NH2+][C@H](C1CCC1)[C@@H]1CCOC1)c1ccccc1O ZINC000866512726 1124076426 /nfs/dbraw/zinc/07/64/26/1124076426.db2.gz OFPWGMPISYGPNY-UWWQBHOKSA-N 1 0 289.419 3.638 20 10 CHCDRO CC[C@H]([NH2+][C@H](C1CCC1)[C@H]1CCOC1)c1ccccc1O ZINC000866512725 1124076797 /nfs/dbraw/zinc/07/67/97/1124076797.db2.gz OFPWGMPISYGPNY-QILLFSRXSA-N 1 0 289.419 3.638 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2c3ccccc3CN2C)c1 ZINC000866564453 1124082860 /nfs/dbraw/zinc/08/28/60/1124082860.db2.gz VPFVXIJHIYTZCQ-KDOFPFPSSA-N 1 0 296.414 3.538 20 10 CHCDRO CC[C@@H]([NH2+]C1([C@H]2CCCCO2)CCC1)c1ccccc1O ZINC000866622788 1124091242 /nfs/dbraw/zinc/09/12/42/1124091242.db2.gz JBUFCHGMBOALLB-NVXWUHKLSA-N 1 0 289.419 3.925 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCCn2nccc21)c1ccc(N(C)C)cc1 ZINC000866632722 1124091865 /nfs/dbraw/zinc/09/18/65/1124091865.db2.gz ORMZXCJXQVTDIN-IRXDYDNUSA-N 1 0 298.434 3.525 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H]2CCCn3nccc32)cc1 ZINC000866633494 1124092387 /nfs/dbraw/zinc/09/23/87/1124092387.db2.gz WCIBVSLPOCIBLJ-RHSMWYFYSA-N 1 0 298.434 3.525 20 10 CHCDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]Cc1ccnc(F)c1 ZINC001118994275 1131244620 /nfs/dbraw/zinc/24/46/20/1131244620.db2.gz SCPUKTTZNZTPRF-AAEUAGOBSA-N 1 0 286.350 3.573 20 10 CHCDRO Cc1ccccc1[C@H]1CC[N@H+](Cc2ccc(N)cc2)C1 ZINC001120370606 1131274350 /nfs/dbraw/zinc/27/43/50/1131274350.db2.gz BXTNPSPYLJKGRN-INIZCTEOSA-N 1 0 266.388 3.567 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](C)c2nccnc2C)cc1 ZINC000872133192 1124693065 /nfs/dbraw/zinc/69/30/65/1124693065.db2.gz LLUBFNSDTKJVQP-ZFWWWQNUSA-N 1 0 298.434 3.653 20 10 CHCDRO CCCOc1ccc(C[NH2+]Cc2ccnc(F)c2)cc1C ZINC000873149908 1124741399 /nfs/dbraw/zinc/74/13/99/1124741399.db2.gz GOIZBNTWZIVKHD-UHFFFAOYSA-N 1 0 288.366 3.608 20 10 CHCDRO C[C@@H]([NH2+]CCCN(C)c1ccccc1)c1ccccc1O ZINC000019906527 1124768102 /nfs/dbraw/zinc/76/81/02/1124768102.db2.gz ANAOUOZTLLFAPH-OAHLLOKOSA-N 1 0 284.403 3.569 20 10 CHCDRO Cc1ccc(C[C@@H](C)[NH2+]Cc2cccc(C)c2O)s1 ZINC000124831967 1124819880 /nfs/dbraw/zinc/81/98/80/1124819880.db2.gz PQGUMEATJBXJQT-GFCCVEGCSA-N 1 0 275.417 3.791 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCc2cccc(F)c2C1)c1ccccc1O ZINC001170956511 1131313653 /nfs/dbraw/zinc/31/36/53/1131313653.db2.gz XEZQHNPLHODIAC-GXTWGEPZSA-N 1 0 285.362 3.739 20 10 CHCDRO CCC(CC)[C@H](C[NH2+][C@H](C)c1ccc(C)cc1O)N(C)C ZINC000021521147 1124932554 /nfs/dbraw/zinc/93/25/54/1124932554.db2.gz XHCKRADYTMRTNU-PBHICJAKSA-N 1 0 292.467 3.718 20 10 CHCDRO Cc1ccc(CNc2cc(C[NH+](C)C)ccc2C)c(O)c1 ZINC000876869077 1124986301 /nfs/dbraw/zinc/98/63/01/1124986301.db2.gz PNZVTJBOWLPQGW-UHFFFAOYSA-N 1 0 284.403 3.683 20 10 CHCDRO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1ccc(C)cc1O ZINC000876901082 1124988616 /nfs/dbraw/zinc/98/86/16/1124988616.db2.gz YMZMJFPNEFIWJX-AWEZNQCLSA-N 1 0 285.387 3.868 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]CCc1csc(C(C)C)n1 ZINC000876997015 1124997013 /nfs/dbraw/zinc/99/70/13/1124997013.db2.gz KXWGLVBHTOVTRA-UHFFFAOYSA-N 1 0 290.432 3.613 20 10 CHCDRO COCC(C)(C)CCC[NH2+]Cc1cc(Cl)c(C)cc1O ZINC000825933602 1125003604 /nfs/dbraw/zinc/00/36/04/1125003604.db2.gz BDSICUYMQXSAJL-UHFFFAOYSA-N 1 0 299.842 3.896 20 10 CHCDRO Cc1cccc(O)c1C[NH2+][C@@H]1CCOC2(CCCCC2)C1 ZINC000877087440 1125008713 /nfs/dbraw/zinc/00/87/13/1125008713.db2.gz LYKGGFGUSKPVFG-OAHLLOKOSA-N 1 0 289.419 3.672 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(C)cc1O)c1c(C)noc1C ZINC000877120140 1125012443 /nfs/dbraw/zinc/01/24/43/1125012443.db2.gz OISWVOYETYWOCP-CQSZACIVSA-N 1 0 274.364 3.546 20 10 CHCDRO CCC(CC)[C@H]1C[C@H]([NH2+]Cc2c(C)cccc2O)CCO1 ZINC000877167484 1125016291 /nfs/dbraw/zinc/01/62/91/1125016291.db2.gz ZOCXYQPRFNBMOK-CRAIPNDOSA-N 1 0 291.435 3.774 20 10 CHCDRO Cc1cccc(O)c1C[NH+]1CCC(Cc2cccnc2)CC1 ZINC000877172957 1125017665 /nfs/dbraw/zinc/01/76/65/1125017665.db2.gz ZPSOJSFAYLVVMH-UHFFFAOYSA-N 1 0 296.414 3.550 20 10 CHCDRO CCn1ccnc1[C@H]1CCCC[N@@H+]1Cc1ccc(C)cc1O ZINC000877494887 1125034795 /nfs/dbraw/zinc/03/47/95/1125034795.db2.gz VOIWQJHQFOVYNK-MRXNPFEDSA-N 1 0 299.418 3.644 20 10 CHCDRO CSc1cccc(F)c1C[NH2+]Cc1ccc(C)cc1O ZINC000877513923 1125036360 /nfs/dbraw/zinc/03/63/60/1125036360.db2.gz CXGYXJJUGIZGBI-UHFFFAOYSA-N 1 0 291.391 3.851 20 10 CHCDRO CSCc1ccc(C[NH2+]Cc2ccc(C)cc2O)cc1 ZINC000877518086 1125039065 /nfs/dbraw/zinc/03/90/65/1125039065.db2.gz FFRLMIKGLIDCAD-UHFFFAOYSA-N 1 0 287.428 3.853 20 10 CHCDRO Cc1cccc(O)c1CNc1ccc(C[NH+](C)C)c(C)c1 ZINC000877585713 1125048643 /nfs/dbraw/zinc/04/86/43/1125048643.db2.gz NNZSXKSQIZSTLN-UHFFFAOYSA-N 1 0 284.403 3.683 20 10 CHCDRO CSC1CC[NH+](Cc2cc(Cl)cc(C)c2O)CC1 ZINC000877663309 1125061735 /nfs/dbraw/zinc/06/17/35/1125061735.db2.gz OSGGLBQXQFHFBM-UHFFFAOYSA-N 1 0 285.840 3.681 20 10 CHCDRO Cc1ccc(C[NH2+]CC2([C@H]3CCCCO3)CCC2)c(O)c1 ZINC000877697845 1125064568 /nfs/dbraw/zinc/06/45/68/1125064568.db2.gz NVXIDNLFZCUHAV-QGZVFWFLSA-N 1 0 289.419 3.530 20 10 CHCDRO COc1ccc(C[C@H](C)[NH2+][C@H](C)c2ccccc2O)cc1 ZINC000877756338 1125073172 /nfs/dbraw/zinc/07/31/72/1125073172.db2.gz IADFUTDRGZYQCX-UONOGXRCSA-N 1 0 285.387 3.683 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCO[C@@H](C(C)(C)C)C1)c1ccccc1O ZINC000877756888 1125074409 /nfs/dbraw/zinc/07/44/09/1125074409.db2.gz BVOAYNYNDAAAAI-XJKCOSOUSA-N 1 0 277.408 3.637 20 10 CHCDRO Cc1cc(C[NH2+][C@@H](C)c2ccccc2O)c(C)s1 ZINC000877757168 1125074815 /nfs/dbraw/zinc/07/48/15/1125074815.db2.gz KSUJTUAAGNIGJQ-NSHDSACASA-N 1 0 261.390 3.921 20 10 CHCDRO CCn1c(C[NH2+][C@H](C)c2ccccc2O)nc2ccccc21 ZINC000877756559 1125075607 /nfs/dbraw/zinc/07/56/07/1125075607.db2.gz RTQLTVSCJVQTRN-CYBMUJFWSA-N 1 0 295.386 3.613 20 10 CHCDRO Oc1c(C[NH2+]C[C@@H]2C[C@@H]3CCC[C@@H]3O2)ccc2ccccc21 ZINC000877806534 1125083149 /nfs/dbraw/zinc/08/31/49/1125083149.db2.gz PDKHIBIFTDXDPF-ZVZYQTTQSA-N 1 0 297.398 3.593 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2cccc(C)n2)cc1 ZINC000127229054 1125164383 /nfs/dbraw/zinc/16/43/83/1125164383.db2.gz LWJQWQCIIAUUOJ-HNNXBMFYSA-N 1 0 283.419 3.697 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@@H]2CC[C@H](c3ccccc3)C2)c1 ZINC000127330025 1125177723 /nfs/dbraw/zinc/17/77/23/1125177723.db2.gz XPRABYWNKBOFEB-DOTOQJQBSA-N 1 0 297.398 3.827 20 10 CHCDRO CC[C@@H](C[NH2+][C@H](C)c1ccccc1O)CC(F)F ZINC000879650180 1125223894 /nfs/dbraw/zinc/22/38/94/1125223894.db2.gz NJOOWTNSLUIKRK-GHMZBOCLSA-N 1 0 257.324 3.724 20 10 CHCDRO Cc1cc(Br)cc(C[NH2+][C@@H]2CC[C@H](C)C2)c1O ZINC000783710100 1125285307 /nfs/dbraw/zinc/28/53/07/1125285307.db2.gz JNSWVPRREQEBDK-TVQRCGJNSA-N 1 0 298.224 3.741 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(NC2(C)CC[NH2+]CC2)cc1 ZINC001168185544 1125357064 /nfs/dbraw/zinc/35/70/64/1125357064.db2.gz ILJADWKCRSTDRK-UHFFFAOYSA-N 1 0 283.419 3.648 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]CC2(C)CC(F)(F)C2)cc1 ZINC000883250847 1125384845 /nfs/dbraw/zinc/38/48/45/1125384845.db2.gz QQLDUOAJUZOZHY-PLNGDYQASA-N 1 0 294.389 3.791 20 10 CHCDRO CC[C@H]([NH2+][C@@H](CC)[C@@H]1CCCOC1)c1ccc(C)cc1O ZINC000883353279 1125400549 /nfs/dbraw/zinc/40/05/49/1125400549.db2.gz RNIGAGAPSNQZEG-PVAVHDDUSA-N 1 0 291.435 3.947 20 10 CHCDRO CSCC[C@@H](C)[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000131611165 1125401185 /nfs/dbraw/zinc/40/11/85/1125401185.db2.gz PZMJEOOKHYKJEF-CHWSQXEVSA-N 1 0 266.454 3.545 20 10 CHCDRO COC[C@@H](C)[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000131869296 1125410472 /nfs/dbraw/zinc/41/04/72/1125410472.db2.gz BGYAXMZDXUSCGH-ZIAGYGMSSA-N 1 0 294.414 3.502 20 10 CHCDRO C[C@H]([NH2+]CCCSc1nccs1)c1cncc(F)c1 ZINC000132272731 1125416797 /nfs/dbraw/zinc/41/67/97/1125416797.db2.gz JLOIWODPGGMDSX-JTQLQIEISA-N 1 0 297.424 3.510 20 10 CHCDRO CC(C)(C[NH2+]Cc1c(O)cccc1Cl)C1CCOCC1 ZINC000897450249 1125418053 /nfs/dbraw/zinc/41/80/53/1125418053.db2.gz AZQKCCROUNVMSX-UHFFFAOYSA-N 1 0 297.826 3.588 20 10 CHCDRO CCCCC[N@H+](Cc1cccc(OC)c1O)C(C)C ZINC000133255303 1125440086 /nfs/dbraw/zinc/44/00/86/1125440086.db2.gz OQZHRLFLACXRLD-UHFFFAOYSA-N 1 0 265.397 3.801 20 10 CHCDRO Cc1cc(C[N@H+]2CCC[C@H](C)CC2)ccc1N(C)C ZINC001139669736 1131356008 /nfs/dbraw/zinc/35/60/08/1131356008.db2.gz KECHHBWXBQMRPL-AWEZNQCLSA-N 1 0 260.425 3.683 20 10 CHCDRO CSC(C)(C)C[C@@H](C)[NH2+][C@@H](C)c1ccccc1O ZINC001258324811 1129200231 /nfs/dbraw/zinc/20/02/31/1129200231.db2.gz XIUOZJMZJLSEBO-NEPJUHHUSA-N 1 0 267.438 3.963 20 10 CHCDRO Cc1cc(C[NH+]2[C@H](C)CCC[C@H]2C)ccc1N(C)C ZINC001139669994 1131358120 /nfs/dbraw/zinc/35/81/20/1131358120.db2.gz UAGXLURETLVNSF-HUUCEWRRSA-N 1 0 260.425 3.824 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2ccccc2O)[C@@H](c2ccco2)C1 ZINC000245611764 1129213690 /nfs/dbraw/zinc/21/36/90/1129213690.db2.gz OCOGKZNCGYAXLV-UKRRQHHQSA-N 1 0 271.360 3.958 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000245617722 1129214864 /nfs/dbraw/zinc/21/48/64/1129214864.db2.gz VVKPXSJVEABDOY-JYYAWHABSA-N 1 0 290.451 3.749 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@H]2CCc3cccc(O)c32)c1 ZINC000295771530 1129219731 /nfs/dbraw/zinc/21/97/31/1129219731.db2.gz AJPRBUWNQQFBIZ-WBMJQRKESA-N 1 0 283.371 3.739 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@@H]1CCc3ccccc31)CC2 ZINC000295923175 1129219861 /nfs/dbraw/zinc/21/98/61/1129219861.db2.gz JUNGQAGDAFDSEA-CVEARBPZSA-N 1 0 265.356 3.657 20 10 CHCDRO COc1ccccc1[C@@H](C)[NH2+][C@H]1CCc2cccc(O)c21 ZINC000296095471 1129220976 /nfs/dbraw/zinc/22/09/76/1129220976.db2.gz UCKQXESTYMORDI-DOMZBBRYSA-N 1 0 283.371 3.739 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2C[C@H](C)[C@@H]2c2ccccc2)c1 ZINC000245839687 1129227630 /nfs/dbraw/zinc/22/76/30/1129227630.db2.gz JLWOCYYTUWMFIG-SCLBCKFNSA-N 1 0 283.371 3.594 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC(C)(C)N2CCCCC2)c(O)c1 ZINC000184847706 1129256413 /nfs/dbraw/zinc/25/64/13/1129256413.db2.gz GMNLIXWSFBXWLO-OAHLLOKOSA-N 1 0 290.451 3.616 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccccc1F ZINC000037764534 1129267039 /nfs/dbraw/zinc/26/70/39/1129267039.db2.gz YNODWLQZNOTTTD-LBPRGKRZSA-N 1 0 271.335 3.611 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC000037770570 1129267622 /nfs/dbraw/zinc/26/76/22/1129267622.db2.gz KYTYFCGLLSHHKQ-AWEZNQCLSA-N 1 0 267.372 3.781 20 10 CHCDRO COc1cccc(C[NH2+]CC[C@H]2CCCC[C@@H]2C)c1O ZINC000734005019 1129290591 /nfs/dbraw/zinc/29/05/91/1129290591.db2.gz OCEPZALUVOODLN-UONOGXRCSA-N 1 0 277.408 3.707 20 10 CHCDRO c1ccc(SCC[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC000037904251 1129290786 /nfs/dbraw/zinc/29/07/86/1129290786.db2.gz ISWHPCKXNCBVLV-UHFFFAOYSA-N 1 0 285.412 3.503 20 10 CHCDRO COc1cc(C)cc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)c1 ZINC000090723908 1129326282 /nfs/dbraw/zinc/32/62/82/1129326282.db2.gz XZTASWLDGKGQFH-OAHLLOKOSA-N 1 0 298.430 3.920 20 10 CHCDRO CC[C@H](C)[C@@H](C)[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1 ZINC000247242174 1129362564 /nfs/dbraw/zinc/36/25/64/1129362564.db2.gz YZYVBURMFKCHCN-ARFHVFGLSA-N 1 0 290.451 3.608 20 10 CHCDRO COc1ccccc1/C=C/C[N@H+](C)Cc1ccccc1O ZINC000091956823 1129375657 /nfs/dbraw/zinc/37/56/57/1129375657.db2.gz ORGBDMBQRRGJNB-JXMROGBWSA-N 1 0 283.371 3.546 20 10 CHCDRO COc1cccc(C[NH2+]C[C@@H]2CCC[C@H](C)[C@@H]2C)c1O ZINC000795588904 1129378678 /nfs/dbraw/zinc/37/86/78/1129378678.db2.gz QOELZYHBXBSQKR-IHRRRGAJSA-N 1 0 277.408 3.563 20 10 CHCDRO CC[C@H](C)[C@@H]1CCCC[N@@H+]1Cc1cc2c(cc1O)OCO2 ZINC000738056767 1129389422 /nfs/dbraw/zinc/38/94/22/1129389422.db2.gz QCDCZOYKQCPWRK-JSGCOSHPSA-N 1 0 291.391 3.522 20 10 CHCDRO COc1cccc(C[N@@H+]2CCc3ccccc3[C@@H]2C)c1O ZINC000093149539 1129417767 /nfs/dbraw/zinc/41/77/67/1129417767.db2.gz BWPMWNCJOVFREK-ZDUSSCGKSA-N 1 0 283.371 3.520 20 10 CHCDRO COc1cccc(C[N@@H+]2CCc3ccccc3[C@H]2C)c1O ZINC000093149536 1129417997 /nfs/dbraw/zinc/41/79/97/1129417997.db2.gz BWPMWNCJOVFREK-CYBMUJFWSA-N 1 0 283.371 3.520 20 10 CHCDRO COc1ccc2ccc(O)c(C[N@@H+]3C[C@@H](C)C[C@@H]3C)c2c1 ZINC000740860580 1129421051 /nfs/dbraw/zinc/42/10/51/1129421051.db2.gz QWHCKEBXBPBETR-STQMWFEESA-N 1 0 285.387 3.784 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](CC)Cc2ccccn2)cc1 ZINC000093338944 1129421430 /nfs/dbraw/zinc/42/14/30/1129421430.db2.gz BRFZPKXUEZHBLB-UHFFFAOYSA-N 1 0 297.446 3.950 20 10 CHCDRO Cc1cccc([C@@H](C)C[NH2+]Cc2ccc3c(c2)CCO3)c1 ZINC000741255098 1129432133 /nfs/dbraw/zinc/43/21/33/1129432133.db2.gz FPYLCBFRJTWGFE-HNNXBMFYSA-N 1 0 281.399 3.823 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccccc1C)c1ccccc1O ZINC000094182980 1129441677 /nfs/dbraw/zinc/44/16/77/1129441677.db2.gz BQXARZSDLDXXOA-KRWDZBQOSA-N 1 0 269.388 3.984 20 10 CHCDRO CN(C)c1ccc(CNc2[nH+]ccn2-c2ccccc2)cc1 ZINC000795805964 1129447615 /nfs/dbraw/zinc/44/76/15/1129447615.db2.gz QSCRBXVKBGIRBE-UHFFFAOYSA-N 1 0 292.386 3.550 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1Cc2ccccc21)c1cc(F)ccc1O ZINC000094617597 1129448523 /nfs/dbraw/zinc/44/85/23/1129448523.db2.gz CZAAHWQWQZEBMV-WCQYABFASA-N 1 0 271.335 3.522 20 10 CHCDRO Cc1ccc(O)c(CNc2[nH+]ccn2Cc2ccccc2)c1 ZINC000795804310 1129449047 /nfs/dbraw/zinc/44/90/47/1129449047.db2.gz WSNOHWMWMGBEPK-UHFFFAOYSA-N 1 0 293.370 3.558 20 10 CHCDRO Oc1ccccc1C[N@H+](CCCCF)C1CCCC1 ZINC000795912083 1129457364 /nfs/dbraw/zinc/45/73/64/1129457364.db2.gz NMMWEAOPDBDLLW-UHFFFAOYSA-N 1 0 265.372 3.887 20 10 CHCDRO CC1=C(C)C[N@H+](Cc2cc(Br)ccc2O)CC1 ZINC000796019199 1129462682 /nfs/dbraw/zinc/46/26/82/1129462682.db2.gz ZPFVXNQOPLXROI-UHFFFAOYSA-N 1 0 296.208 3.697 20 10 CHCDRO CC1=C(C)C[N@H+](Cc2cc(Cl)ccc2O)CC1 ZINC000796021807 1129463209 /nfs/dbraw/zinc/46/32/09/1129463209.db2.gz WHOZVDIBPQXLBC-UHFFFAOYSA-N 1 0 251.757 3.588 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC=C(c3ccco3)C2)cc1 ZINC000796120577 1129467795 /nfs/dbraw/zinc/46/77/95/1129467795.db2.gz LYDZWKMTSJMQKO-UHFFFAOYSA-N 1 0 282.387 3.635 20 10 CHCDRO CC(C)C1CC[NH+](Cc2cc3c(cc2O)CCC3)CC1 ZINC000742172801 1129468791 /nfs/dbraw/zinc/46/87/91/1129468791.db2.gz PGEAASPOEZEEPE-UHFFFAOYSA-N 1 0 273.420 3.749 20 10 CHCDRO Cc1csc([C@H](C)[NH2+]Cc2cc(C)c(C)cc2O)n1 ZINC000742369881 1129471629 /nfs/dbraw/zinc/47/16/29/1129471629.db2.gz ZHGSHZGKVNIXRW-LBPRGKRZSA-N 1 0 276.405 3.625 20 10 CHCDRO CCCN(CCC)c1ccc(C[NH2+][C@@H]2CCSC2)cc1 ZINC000742383035 1129472917 /nfs/dbraw/zinc/47/29/17/1129472917.db2.gz RVEWOBJKHSSSPA-MRXNPFEDSA-N 1 0 292.492 3.908 20 10 CHCDRO CC[C@H](C)C[C@@H](C)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000742379880 1129476186 /nfs/dbraw/zinc/47/61/86/1129476186.db2.gz CDBHMAHYCYLTFI-QWHCGFSZSA-N 1 0 266.404 3.806 20 10 CHCDRO CCOc1cccc(C[NH2+][C@H]2C[C@H](C)C[C@H](C)C2)c1O ZINC000250521538 1129483873 /nfs/dbraw/zinc/48/38/73/1129483873.db2.gz TUDKGKGOYZKECU-NHAGDIPZSA-N 1 0 277.408 3.705 20 10 CHCDRO CC[C@@]1(C)CCC[N@H+](Cc2c(O)ccc3ccncc32)C1 ZINC000743386114 1129521463 /nfs/dbraw/zinc/52/14/63/1129521463.db2.gz BGABQUITVAHXFX-SFHVURJKSA-N 1 0 284.403 3.953 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]CC2=CCCCC2)c1 ZINC000379578534 1129556428 /nfs/dbraw/zinc/55/64/28/1129556428.db2.gz CFTSTCFOZYFQFU-LBPRGKRZSA-N 1 0 261.365 3.552 20 10 CHCDRO CO[C@H](C[NH2+]Cc1cc(-c2ccccc2)ccc1O)C(C)C ZINC000744449084 1129577673 /nfs/dbraw/zinc/57/76/73/1129577673.db2.gz RVXKVXKJJKGDIU-LJQANCHMSA-N 1 0 299.414 3.820 20 10 CHCDRO Cc1ccc2cc(C[NH2+]Cc3ccccc3O)ccc2n1 ZINC000097862082 1129627195 /nfs/dbraw/zinc/62/71/95/1129627195.db2.gz NLUQWZXTLKKOOL-UHFFFAOYSA-N 1 0 278.355 3.539 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CC(C)(C)SC)cc1 ZINC000766362208 1129659750 /nfs/dbraw/zinc/65/97/50/1129659750.db2.gz QNQSNOUHBMVCGB-CYBMUJFWSA-N 1 0 280.481 3.935 20 10 CHCDRO CC[C@H]([NH2+]CC(C)(C)SC)c1ccc(N(C)C)cc1 ZINC000766360797 1129660280 /nfs/dbraw/zinc/66/02/80/1129660280.db2.gz BIRKXHIBHNSKCL-HNNXBMFYSA-N 1 0 280.481 3.935 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@@H](C)c2ccncc2)cc1 ZINC000766491245 1129669319 /nfs/dbraw/zinc/66/93/19/1129669319.db2.gz YREXPOQKJCFWAL-HZPDHXFCSA-N 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CCOCc1cc(C[NH2+][C@@H]2CCC(C)(C)C2)ccc1OC ZINC000768662079 1129867542 /nfs/dbraw/zinc/86/75/42/1129867542.db2.gz PHVNMOWUQPMBHC-MRXNPFEDSA-N 1 0 291.435 3.900 20 10 CHCDRO C[N@H+](Cc1ccccc1O)Cc1ccccc1C1CC1 ZINC000768872083 1129878568 /nfs/dbraw/zinc/87/85/68/1129878568.db2.gz BRRZILKLJLYKMR-UHFFFAOYSA-N 1 0 267.372 3.902 20 10 CHCDRO CC[C@H]1COCC[N@@H+]1Cc1cc(-c2ccccc2)ccc1O ZINC000768882133 1129878915 /nfs/dbraw/zinc/87/89/15/1129878915.db2.gz QALPZBCPNMTURP-SFHVURJKSA-N 1 0 297.398 3.670 20 10 CHCDRO CCCN(CCC)c1ccc(C[N@@H+]2CCCOCC2)cc1 ZINC000768891738 1129879293 /nfs/dbraw/zinc/87/92/93/1129879293.db2.gz XCDAYKZMWQFXOG-UHFFFAOYSA-N 1 0 290.451 3.535 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2cc(C)cc(Cl)n2)c1 ZINC000800492163 1129879452 /nfs/dbraw/zinc/87/94/52/1129879452.db2.gz CRPQDLNJNWJFLW-LBPRGKRZSA-N 1 0 290.794 3.908 20 10 CHCDRO C[C@H]([NH2+][C@H]1Cc2ccc(Cl)cc2C1)c1ccccc1O ZINC000800496240 1129880114 /nfs/dbraw/zinc/88/01/14/1129880114.db2.gz UMPACILOIJIFRV-NHYWBVRUSA-N 1 0 287.790 3.864 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC[C@H]3CCC[C@@H]32)cc1C ZINC000769101750 1129890558 /nfs/dbraw/zinc/89/05/58/1129890558.db2.gz GCCQFHJCYLNDME-ZBFHGGJFSA-N 1 0 259.393 3.774 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CC[C@@H]1C1CCC1 ZINC000800970747 1129900585 /nfs/dbraw/zinc/90/05/85/1129900585.db2.gz DSJLAYOFPHHRPV-QZTJIDSGSA-N 1 0 272.436 3.729 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H]2CCC[C@@H]2CCCF)cc1F ZINC000800969566 1129900859 /nfs/dbraw/zinc/90/08/59/1129900859.db2.gz RKVVANKGRPJEJM-ZBFHGGJFSA-N 1 0 296.405 3.900 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCC[C@@H]2C(C)(C)C)c1O ZINC000769308703 1129901224 /nfs/dbraw/zinc/90/12/24/1129901224.db2.gz AXQAVYLIQRDKME-OAHLLOKOSA-N 1 0 277.408 3.801 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCCO[C@H](c3ccccc3)C2)c1 ZINC000769316434 1129901617 /nfs/dbraw/zinc/90/16/17/1129901617.db2.gz OLQKTEAFYCFRER-IBGZPJMESA-N 1 0 297.398 3.664 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCCO[C@@H](c3ccccc3)C2)c1 ZINC000769316438 1129902047 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C[C@H]1C[NH+](Cc2ccc(N3CCCCC3)cc2)C[C@@H]1C ZINC000769448500 1129911095 /nfs/dbraw/zinc/91/10/95/1129911095.db2.gz SRPOZHBIVYTDHG-HOTGVXAUSA-N 1 0 272.436 3.765 20 10 CHCDRO COc1cccc(C[N@@H+]2CCC[C@H](CC(C)C)C2)c1O ZINC000769506611 1129914736 /nfs/dbraw/zinc/91/47/36/1129914736.db2.gz ZNAWRKBQXFNMII-CQSZACIVSA-N 1 0 277.408 3.659 20 10 CHCDRO COc1cccc(O)c1C[N@@H+]1C[C@@H](C)[C@H]1c1ccccc1 ZINC000769542056 1129916054 /nfs/dbraw/zinc/91/60/54/1129916054.db2.gz ZBHKIUAKEUHDQL-ACJLOTCBSA-N 1 0 283.371 3.594 20 10 CHCDRO COc1cccc(C[N@@H+]2CCC[C@@H]2CCC(C)C)c1O ZINC000769538160 1129916227 /nfs/dbraw/zinc/91/62/27/1129916227.db2.gz UFGKBTLJQWDHBB-OAHLLOKOSA-N 1 0 277.408 3.801 20 10 CHCDRO COc1cccc(C[N@@H+]2CCC[C@H]2CCC(C)C)c1O ZINC000769538159 1129916386 /nfs/dbraw/zinc/91/63/86/1129916386.db2.gz UFGKBTLJQWDHBB-HNNXBMFYSA-N 1 0 277.408 3.801 20 10 CHCDRO Cc1ccc(O)c(C[N@H+]2C[C@@H](C)[C@H]2c2ccccc2)c1 ZINC000769541982 1129916437 /nfs/dbraw/zinc/91/64/37/1129916437.db2.gz XXKGMBZWBFCETR-KDOFPFPSSA-N 1 0 267.372 3.894 20 10 CHCDRO Cc1ccc(O)c(C[N@H+]2C[C@H](C)[C@@H]2c2ccccc2)c1 ZINC000769541980 1129916500 /nfs/dbraw/zinc/91/65/00/1129916500.db2.gz XXKGMBZWBFCETR-KBXCAEBGSA-N 1 0 267.372 3.894 20 10 CHCDRO C[C@H]1C[N@H+](Cc2ccc(N(C)C)cc2)[C@@H]1c1ccccc1 ZINC000769538896 1129916595 /nfs/dbraw/zinc/91/65/95/1129916595.db2.gz GCPRIDMFJDAVNK-KXBFYZLASA-N 1 0 280.415 3.946 20 10 CHCDRO CCS[C@H]1CC[C@@H]([N@H+](C)Cc2c(O)cccc2OC)C1 ZINC000769549024 1129916966 /nfs/dbraw/zinc/91/69/66/1129916966.db2.gz JUWGXIWUTIPHAI-OLZOCXBDSA-N 1 0 295.448 3.507 20 10 CHCDRO CCCC[N@@H+](Cc1ccccc1O)C[C@H](O)c1ccccc1 ZINC000801596601 1129931932 /nfs/dbraw/zinc/93/19/32/1129931932.db2.gz HCGUVCNPWBTHTH-IBGZPJMESA-N 1 0 299.414 3.728 20 10 CHCDRO CC[C@H]1CN(C)c2ccccc2C[N@@H+]1Cc1ccccc1O ZINC000770505297 1129947854 /nfs/dbraw/zinc/94/78/54/1129947854.db2.gz NVVMLJHMHIATNF-KRWDZBQOSA-N 1 0 296.414 3.623 20 10 CHCDRO CC[N@H+](CCc1cccs1)Cc1ccccc1O ZINC000770508598 1129948257 /nfs/dbraw/zinc/94/82/57/1129948257.db2.gz BASQNWWCXUCHFB-UHFFFAOYSA-N 1 0 261.390 3.518 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2ccccc2O)[C@H]2CCCC[C@H]12 ZINC000770510086 1129948325 /nfs/dbraw/zinc/94/83/25/1129948325.db2.gz XHJMBYSYLJYJDF-BMFZPTHFSA-N 1 0 259.393 3.793 20 10 CHCDRO COc1ccc(C[NH2+][C@H]2CC[C@H](c3ccccc3)C2)c(O)c1 ZINC000770739391 1129957618 /nfs/dbraw/zinc/95/76/18/1129957618.db2.gz AHKFFORCXGPSFT-RDJZCZTQSA-N 1 0 297.398 3.827 20 10 CHCDRO CCC[N@@H+](Cc1c(O)cccc1Cl)CC1CC1 ZINC000771925057 1129995198 /nfs/dbraw/zinc/99/51/98/1129995198.db2.gz VMPFMKCADAJDPK-UHFFFAOYSA-N 1 0 253.773 3.668 20 10 CHCDRO Cc1ccsc1C[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC000771935414 1129996255 /nfs/dbraw/zinc/99/62/55/1129996255.db2.gz RRHGRKFTLNRXSG-UHFFFAOYSA-N 1 0 274.433 3.755 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000771937464 1129996845 /nfs/dbraw/zinc/99/68/45/1129996845.db2.gz CXTGRLUJJFRIQS-OAHLLOKOSA-N 1 0 273.763 3.993 20 10 CHCDRO CCCC[N@@H+](Cc1ccccc1O)C[C@@H]1CCC=CO1 ZINC000802657750 1130027650 /nfs/dbraw/zinc/02/76/50/1130027650.db2.gz QIBWHBDXOIRUCJ-INIZCTEOSA-N 1 0 275.392 3.687 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]Cc1cccc2cc[nH]c21 ZINC000786160920 1130081607 /nfs/dbraw/zinc/08/16/07/1130081607.db2.gz MLPIOTQQWJOPMV-UHFFFAOYSA-N 1 0 286.762 3.817 20 10 CHCDRO CO[C@H](c1ccccc1)[C@H](C)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000786782065 1130117354 /nfs/dbraw/zinc/11/73/54/1130117354.db2.gz FBWPMTZUZFWHLN-KXBFYZLASA-N 1 0 298.430 3.618 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H]2CCO[C@H]2C2CC2)c1O ZINC000903260812 1130138475 /nfs/dbraw/zinc/13/84/75/1130138475.db2.gz RMQCHYLBBFCJRG-HQQWDMGQSA-N 1 0 295.810 3.572 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC[C@@H]2CCCC[C@@H]2O)c(O)c1C ZINC000903265784 1130140503 /nfs/dbraw/zinc/14/05/03/1130140503.db2.gz SSNFLEYNGQHHDZ-VYDXJSESSA-N 1 0 291.435 3.601 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@@H]2CCCC3(CC3)C2)c1O ZINC000903279634 1130144217 /nfs/dbraw/zinc/14/42/17/1130144217.db2.gz OFJUEKZNEREKLW-CHWSQXEVSA-N 1 0 275.392 3.774 20 10 CHCDRO C[C@@H]([NH2+]C1CC2(C1)CO[C@H](C)C2)c1cc(Cl)ccc1O ZINC000903281283 1130145364 /nfs/dbraw/zinc/14/53/64/1130145364.db2.gz GJORIWNVYHIFFW-UUKUIKCLSA-N 1 0 295.810 3.654 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1cncs1)c1ccc(C)cc1O ZINC000903312719 1130151980 /nfs/dbraw/zinc/15/19/80/1130151980.db2.gz XXROKCJCXJDKMK-AAEUAGOBSA-N 1 0 276.405 3.959 20 10 CHCDRO CC[C@@H]([NH2+][C@H](c1ncccn1)C1CC1)c1ccc(C)cc1O ZINC000903321759 1130154223 /nfs/dbraw/zinc/15/42/23/1130154223.db2.gz BVTZBPPWDQHXRP-WBVHZDCISA-N 1 0 297.402 3.683 20 10 CHCDRO Cc1nc2ccccn2c1C[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000903422538 1130174089 /nfs/dbraw/zinc/17/40/89/1130174089.db2.gz ONAAQBSSXSEWRV-ZDUSSCGKSA-N 1 0 295.386 3.508 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CCc2cccnc2C)c(O)c1 ZINC000903418867 1130174229 /nfs/dbraw/zinc/17/42/29/1130174229.db2.gz PLSPZKZJJDJUPG-HNNXBMFYSA-N 1 0 284.403 3.606 20 10 CHCDRO CCC(O)(CC)CC[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000788264550 1130180365 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277.383 3.622 20 10 CHCDRO CCO[C@H]1CCC[N@H+](Cc2ccc(C(C)(C)C)cc2O)C1 ZINC001235685986 1130768662 /nfs/dbraw/zinc/76/86/62/1130768662.db2.gz WGBCZTZQMYJDCK-INIZCTEOSA-N 1 0 291.435 3.691 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2Cc3ccccc3OC[C@@H]2C)cc1C ZINC000782288975 1130769174 /nfs/dbraw/zinc/76/91/74/1130769174.db2.gz KYRMLIPRSVXMRU-HNNXBMFYSA-N 1 0 297.398 3.792 20 10 CHCDRO CC(C)[C@@H](CC(F)(F)F)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000782543216 1130783031 /nfs/dbraw/zinc/78/30/31/1130783031.db2.gz FUARLJKWADMWLD-CQSZACIVSA-N 1 0 288.357 3.819 20 10 CHCDRO C[C@@H](CCc1cccc(F)c1)[N@H+](C)Cc1ccccc1O ZINC000783424586 1130822918 /nfs/dbraw/zinc/82/29/18/1130822918.db2.gz PBDYXAVBUPGNTO-AWEZNQCLSA-N 1 0 287.378 3.984 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccc2ccccc2n1)c1ccccc1O ZINC000783505928 1130831363 /nfs/dbraw/zinc/83/13/63/1130831363.db2.gz ROAVZRLOBIPNKB-CQSZACIVSA-N 1 0 292.382 3.834 20 10 CHCDRO Cc1ccc(CC[C@@H](C)[NH2+][C@H](C)c2ccccc2O)o1 ZINC000783516065 1130832263 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ZINC000814229992 1130849051 /nfs/dbraw/zinc/84/90/51/1130849051.db2.gz IRYWBAYEDZKMJD-GOSISDBHSA-N 1 0 296.414 3.987 20 10 CHCDRO Fc1ccc([C@H]2C[C@H]([NH2+]Cc3ccc4c(c3)CCO4)C2)cc1 ZINC000814300107 1130861514 /nfs/dbraw/zinc/86/15/14/1130861514.db2.gz GYUAWRSHNBYDNO-SAABIXHNSA-N 1 0 297.373 3.796 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]C(C)(C)C(C)(C)C)c1 ZINC000814301375 1130863687 /nfs/dbraw/zinc/86/36/87/1130863687.db2.gz XOZFQWPEOHJGGZ-UHFFFAOYSA-N 1 0 265.397 3.705 20 10 CHCDRO COc1cc(C)cc(C[N@@H+]2C[C@H](C)CC(C)(C)C2)c1O ZINC000784005869 1130867764 /nfs/dbraw/zinc/86/77/64/1130867764.db2.gz AWROTEKFRNWVLS-CYBMUJFWSA-N 1 0 277.408 3.577 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]CCCc2ccc(C)cc2)c1 ZINC000784264646 1130894591 /nfs/dbraw/zinc/89/45/91/1130894591.db2.gz BCOZEISUOOYLOW-OAHLLOKOSA-N 1 0 299.414 3.993 20 10 CHCDRO Cc1cc(C[N@@H+](C)[C@H](C)c2ccco2)ccc1N(C)C ZINC000815028084 1130953589 /nfs/dbraw/zinc/95/35/89/1130953589.db2.gz PWCQCOZPDHDXNC-CQSZACIVSA-N 1 0 272.392 3.847 20 10 CHCDRO Cc1cc(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)ccc1N(C)C ZINC000815064263 1130955918 /nfs/dbraw/zinc/95/59/18/1130955918.db2.gz BYJFGJCRNRUCCB-GOSISDBHSA-N 1 0 283.419 3.726 20 10 CHCDRO Cc1ccc([C@H](O)[C@@H](C)[NH2+][C@@H](C)c2ccc(C)cc2O)cc1 ZINC000797061043 1130957902 /nfs/dbraw/zinc/95/79/02/1130957902.db2.gz MYYQTFOUSSLXFW-QMTMVMCOSA-N 1 0 299.414 3.782 20 10 CHCDRO CCS[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(N(C)CC)cc1 ZINC000815116285 1130958157 /nfs/dbraw/zinc/95/81/57/1130958157.db2.gz HTUCZQBKITULBK-DLBZAZTESA-N 1 0 292.492 3.907 20 10 CHCDRO Cc1ccoc1C[N@@H+](C)Cc1ccc(N(C)C)c(C)c1 ZINC000815120131 1130959262 /nfs/dbraw/zinc/95/92/62/1130959262.db2.gz BXWGSBWGANLFAT-UHFFFAOYSA-N 1 0 272.392 3.594 20 10 CHCDRO CCCCOCCC[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000815552569 1130998480 /nfs/dbraw/zinc/99/84/80/1130998480.db2.gz FATRRQFRSRADGR-OAHLLOKOSA-N 1 0 279.424 3.866 20 10 CHCDRO Cc1csc(CC[NH2+][C@@H](C)c2c(C)cc(C)cc2O)n1 ZINC000815559088 1130999659 /nfs/dbraw/zinc/99/96/59/1130999659.db2.gz XDRSCSKFIURZJB-ZDUSSCGKSA-N 1 0 290.432 3.667 20 10 CHCDRO CCc1ccc(C[N@@H+]2CC[C@H](Oc3ccccc3)C2)c(O)c1 ZINC001236790746 1131006080 /nfs/dbraw/zinc/00/60/80/1131006080.db2.gz XSAOCLRWPDYRAX-SFHVURJKSA-N 1 0 297.398 3.608 20 10 CHCDRO CCc1ccc(C[N@H+](C)CCc2ccccc2OC)c(O)c1 ZINC001236787358 1131006134 /nfs/dbraw/zinc/00/61/34/1131006134.db2.gz BLCMFINNMLLNLR-UHFFFAOYSA-N 1 0 299.414 3.638 20 10 CHCDRO CCc1ccc(C[N@@H+]2CCc3cccc(OC)c3C2)c(O)c1 ZINC001236784291 1131006221 /nfs/dbraw/zinc/00/62/21/1131006221.db2.gz UCTNKWIUNGYUBG-UHFFFAOYSA-N 1 0 297.398 3.522 20 10 CHCDRO CCc1ccc(C[N@H+](CC)Cc2ccc(OC)cc2)c(O)c1 ZINC001236786531 1131006319 /nfs/dbraw/zinc/00/63/19/1131006319.db2.gz CFHGBKVMMMZPCK-UHFFFAOYSA-N 1 0 299.414 3.985 20 10 CHCDRO CCc1ccc(C[N@@H+]2CCc3cc(C)ccc3C2)c(O)c1 ZINC001236788567 1131007035 /nfs/dbraw/zinc/00/70/35/1131007035.db2.gz PFGPIOVLFQDUPU-UHFFFAOYSA-N 1 0 281.399 3.821 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CC[C@H](C)C[C@@H]2C)c(Cl)c1 ZINC001236800746 1131008421 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Cc1ccc(O)c(C[NH2+][C@H]2C[C@H](c3ccccc3F)C2)c1 ZINC000797876906 1131011619 /nfs/dbraw/zinc/01/16/19/1131011619.db2.gz SHUDYEWTOJMDRS-CTYIDZIISA-N 1 0 285.362 3.876 20 10 CHCDRO CCCN(CC)C[C@H](C)[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000815627912 1131012098 /nfs/dbraw/zinc/01/20/98/1131012098.db2.gz NCHYAGUGVWGELM-HOTGVXAUSA-N 1 0 292.467 3.780 20 10 CHCDRO CC[C@H]([NH2+]CC(C)(F)F)c1cccc(Cl)c1[O-] ZINC000815645084 1131014689 /nfs/dbraw/zinc/01/46/89/1131014689.db2.gz UVYUFTAQUIHYOZ-JTQLQIEISA-N 1 0 263.715 3.742 20 10 CHCDRO CC[C@H]([NH2+]CC[C@@H](C)F)c1cc(Cl)ccc1O ZINC000815645532 1131015806 /nfs/dbraw/zinc/01/58/06/1131015806.db2.gz IWZSHSLKZRXUJR-SKDRFNHKSA-N 1 0 259.752 3.834 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](CO)C1CCCCC1)c1ccccc1O ZINC000815648119 1131017273 /nfs/dbraw/zinc/01/72/73/1131017273.db2.gz FDCQXESLDYQXHA-RDJZCZTQSA-N 1 0 291.435 3.622 20 10 CHCDRO Oc1cc2ccccc2cc1C[N@@H+]1CC[C@H](C(F)(F)F)C1 ZINC001236834374 1131017979 /nfs/dbraw/zinc/01/79/79/1131017979.db2.gz 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C[C@@]1(C[NH2+]Cc2ccc3ccccc3c2O)CCCS1 ZINC000816556493 1131109861 /nfs/dbraw/zinc/10/98/61/1131109861.db2.gz KUZHNQSBYIPBOH-KRWDZBQOSA-N 1 0 287.428 3.921 20 10 CHCDRO CO[C@H](C[NH2+]Cc1ccc2ccccc2c1O)C(C)(C)C ZINC000816553799 1131110392 /nfs/dbraw/zinc/11/03/92/1131110392.db2.gz HHEFMPSFGLVRID-MRXNPFEDSA-N 1 0 287.403 3.696 20 10 CHCDRO Oc1c(C[N@@H+]2CCC[C@H]2[C@H]2CCCO2)ccc2ccccc21 ZINC000816603925 1131114769 /nfs/dbraw/zinc/11/47/69/1131114769.db2.gz SQLMRJKNMKPITP-ZWKOTPCHSA-N 1 0 297.398 3.689 20 10 CHCDRO Cc1cccc(C[NH2+][C@H]2C[C@H](c3ccc(F)cc3)C2)c1O ZINC000816625780 1131115132 /nfs/dbraw/zinc/11/51/32/1131115132.db2.gz NKXLVVKSDFRXPZ-JCNLHEQBSA-N 1 0 285.362 3.876 20 10 CHCDRO CCc1noc(C)c1C[NH2+]Cc1ccc2ccccc2c1O ZINC000816638400 1131117282 /nfs/dbraw/zinc/11/72/82/1131117282.db2.gz KZPXQOUVYBPBEE-UHFFFAOYSA-N 1 0 296.370 3.694 20 10 CHCDRO CCCN(CCC)c1ccc(C[N@@H+]2CC[C@H]2COC)cc1 ZINC000816636695 1131118138 /nfs/dbraw/zinc/11/81/38/1131118138.db2.gz FIWNGEHOMYDRRB-SFHVURJKSA-N 1 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GCWGYAKFYANALQ-UHFFFAOYSA-N 1 0 265.353 3.533 20 10 CHCDRO Cc1cc(F)cc(C[NH+]2CCC3(CC[C@@H](F)C3)CC2)c1O ZINC001238069700 1131168265 /nfs/dbraw/zinc/16/82/65/1131168265.db2.gz KAXIYYNWXGOALC-CQSZACIVSA-N 1 0 295.373 3.944 20 10 CHCDRO CC[N@@H+](Cc1ccc(N2CCCC2)cc1)CC1CCC1 ZINC001116878853 1131169002 /nfs/dbraw/zinc/16/90/02/1131169002.db2.gz GGEVLYGBEQHTBZ-UHFFFAOYSA-N 1 0 272.436 3.909 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccncc1Cl ZINC000817574471 1131171911 /nfs/dbraw/zinc/17/19/11/1131171911.db2.gz ONJOJCZJALLKLJ-NSHDSACASA-N 1 0 288.778 3.521 20 10 CHCDRO CC[C@@H]1C[C@@H]([NH2+][C@H](C)c2ccc(N(C)CC)cc2)CCO1 ZINC000817586085 1131173818 /nfs/dbraw/zinc/17/38/18/1131173818.db2.gz LPFVIJKKALCZLQ-UWWQBHOKSA-N 1 0 290.451 3.751 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C2CCC([NH+](C)C)CC2)c(O)c1 ZINC000817586825 1131174422 /nfs/dbraw/zinc/17/44/22/1131174422.db2.gz SQZOFCTYKSHCOF-FHERZECASA-N 1 0 290.451 3.532 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]C[C@@H]1CC13CCSCC3)CC2 ZINC000817590627 1131175261 /nfs/dbraw/zinc/17/52/61/1131175261.db2.gz ZFXYGZBXRQYBNP-UONOGXRCSA-N 1 0 289.444 3.502 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccc(N)cc1)C(C)(C)c1ccccc1 ZINC000817955924 1131190623 /nfs/dbraw/zinc/19/06/23/1131190623.db2.gz LMDWRUSGQNDPEC-OAHLLOKOSA-N 1 0 282.431 3.767 20 10 CHCDRO Cc1ccc(C)c([C@H](C)[NH2+]CCc2ccc(N)cc2)c1 ZINC000817955774 1131190749 /nfs/dbraw/zinc/19/07/49/1131190749.db2.gz HLKBLNBZWCJKGV-HNNXBMFYSA-N 1 0 268.404 3.779 20 10 CHCDRO Cc1cccc2c1[C@@H](C)C[C@@H]2[NH2+]CCc1ccc(N)cc1 ZINC000817958173 1131190965 /nfs/dbraw/zinc/19/09/65/1131190965.db2.gz SQRNGPVLPYJPCX-KSSFIOAISA-N 1 0 280.415 3.958 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccc(N)cc1)[C@@H]1CCCC[C@H]1C ZINC000817957819 1131191028 /nfs/dbraw/zinc/19/10/28/1131191028.db2.gz PIEYGWXOWVJBPK-CKEIUWERSA-N 1 0 260.425 3.616 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccc(N)cc1)c1cccc(OC)c1 ZINC000817956423 1131191388 /nfs/dbraw/zinc/19/13/88/1131191388.db2.gz YQWPANNFGGALTI-SFHVURJKSA-N 1 0 284.403 3.561 20 10 CHCDRO Nc1ccc(CC[NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)cc1 ZINC000817958771 1131191653 /nfs/dbraw/zinc/19/16/53/1131191653.db2.gz YDCGOZYLOCROPV-IEBWSBKVSA-N 1 0 280.415 3.737 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCN(c2ccc(OC)cc2)C1)C(C)C ZINC000818345429 1131209833 /nfs/dbraw/zinc/20/98/33/1131209833.db2.gz UOVYLWLZBFIJBA-YJBOKZPZSA-N 1 0 290.451 3.546 20 10 CHCDRO COc1ccc(N2CC[C@@H](C[NH2+][C@H](C)C(C)(C)C)C2)cc1 ZINC000818341811 1131209982 /nfs/dbraw/zinc/20/99/82/1131209982.db2.gz GZIXXRLLLRFLQM-CABCVRRESA-N 1 0 290.451 3.546 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C[C@@H]2CSc3ccccc32)c1 ZINC000824484043 1131470762 /nfs/dbraw/zinc/47/07/62/1131470762.db2.gz YTJLDLIIDXPDKE-CQSZACIVSA-N 1 0 285.412 3.680 20 10 CHCDRO Oc1ccccc1C[NH2+][C@@H]1CCCc2c(F)cc(F)cc21 ZINC000824468493 1131472239 /nfs/dbraw/zinc/47/22/39/1131472239.db2.gz KHSAIPGEGXVPIF-MRXNPFEDSA-N 1 0 289.325 3.838 20 10 CHCDRO CC(C)(C[NH2+]Cc1cc(Cl)ccc1O)c1ccccn1 ZINC000824583503 1131477244 /nfs/dbraw/zinc/47/72/44/1131477244.db2.gz NPOYICUSBUHCFI-UHFFFAOYSA-N 1 0 290.794 3.508 20 10 CHCDRO c1cc(N2CCCCC2)ccc1C[NH+]1C[C@H]2CCC[C@@H]2C1 ZINC001138213856 1131477795 /nfs/dbraw/zinc/47/77/95/1131477795.db2.gz CDTDXXKKCICNCO-QZTJIDSGSA-N 1 0 284.447 3.909 20 10 CHCDRO C[C@H]1C[C@@H](CF)[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC001138215413 1131477861 /nfs/dbraw/zinc/47/78/61/1131477861.db2.gz DUWIRGIRSLXRIE-YJBOKZPZSA-N 1 0 290.426 3.857 20 10 CHCDRO Cc1c(CN2CCC(F)(F)[C@@H](F)C2)c2ccccc2n1C ZINC001138252722 1131482231 /nfs/dbraw/zinc/48/22/31/1131482231.db2.gz RVMUHDBAKYOONP-HNNXBMFYSA-N 1 0 296.336 3.666 20 10 CHCDRO Cc1c(C[N@@H+]2CCC(F)(F)[C@H](C)C2)c2ccccc2n1C ZINC001138252785 1131482294 /nfs/dbraw/zinc/48/22/94/1131482294.db2.gz UWZDNPNEKTUXIE-GFCCVEGCSA-N 1 0 292.373 3.964 20 10 CHCDRO Cc1c(C[N@@H+]2CC[C@@H](C(F)(F)F)C2)c2ccccc2n1C ZINC001138256809 1131483432 /nfs/dbraw/zinc/48/34/32/1131483432.db2.gz LMLMOZDSVBETCA-GFCCVEGCSA-N 1 0 296.336 3.871 20 10 CHCDRO CN1CCCc2cc(C[N@@H+]3CCc4sccc4C3)ccc21 ZINC001138355100 1131494182 /nfs/dbraw/zinc/49/41/82/1131494182.db2.gz HCIGZVQEPWWIRW-UHFFFAOYSA-N 1 0 298.455 3.689 20 10 CHCDRO CN1CCCc2cc(C[N@@H+]3CCCC4(CCC4)C3)ccc21 ZINC001138359640 1131494258 /nfs/dbraw/zinc/49/42/58/1131494258.db2.gz XFVBZHMSGLGNCF-UHFFFAOYSA-N 1 0 284.447 3.835 20 10 CHCDRO COc1cccc(C[NH2+]Cc2cc(Cl)c(C)cc2O)c1 ZINC000825038115 1131494551 /nfs/dbraw/zinc/49/45/51/1131494551.db2.gz QWOABUKDLDHBJE-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO Cc1cc(O)c(C[NH2+]Cc2ccccc2C)cc1Cl ZINC000825044631 1131494603 /nfs/dbraw/zinc/49/46/03/1131494603.db2.gz YIGOGWRXNGZTHM-UHFFFAOYSA-N 1 0 275.779 3.952 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H]2C)c(OC)c1 ZINC001138387342 1131497020 /nfs/dbraw/zinc/49/70/20/1131497020.db2.gz CECMGVXOZPQKHN-AWEZNQCLSA-N 1 0 276.424 3.526 20 10 CHCDRO CC[C@H]1CCC[N@@H+]1Cc1ccc(N(CC)CC)cc1OC ZINC001138389174 1131497094 /nfs/dbraw/zinc/49/70/94/1131497094.db2.gz LGZYMDCCNNDGQY-INIZCTEOSA-N 1 0 290.451 3.916 20 10 CHCDRO COc1ccccc1C[NH2+]Cc1cc(Cl)c(C)cc1O ZINC000825058678 1131497133 /nfs/dbraw/zinc/49/71/33/1131497133.db2.gz IQBSZZVYYIIQTD-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO COC(C)(C)C[C@@H](C)[NH2+]Cc1cc(Cl)c(C)cc1O ZINC000825316516 1131506694 /nfs/dbraw/zinc/50/66/94/1131506694.db2.gz VUQOQYHJBYHOEK-LLVKDONJSA-N 1 0 285.815 3.647 20 10 CHCDRO C[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000035275583 1131558892 /nfs/dbraw/zinc/55/88/92/1131558892.db2.gz AYDXSPPKCJYZIC-YJBOKZPZSA-N 1 0 272.436 3.955 20 10 CHCDRO Cc1cc(O)c(C[NH+]2CCC3(CC3(F)F)CC2)cc1C ZINC000844726079 1131595060 /nfs/dbraw/zinc/59/50/60/1131595060.db2.gz WLSRNSZDUIBVNS-UHFFFAOYSA-N 1 0 281.346 3.630 20 10 CHCDRO Cc1cc(C[N@@H+]2CCC[C@H]3CCC[C@@H]32)ccc1N(C)C ZINC001139672716 1131627076 /nfs/dbraw/zinc/62/70/76/1131627076.db2.gz CUAYIKDNPQKSMK-AEFFLSMTSA-N 1 0 272.436 3.826 20 10 CHCDRO Cc1cc(C[N@H+](C)Cc2ccccc2F)ccc1N(C)C ZINC001139671861 1131627175 /nfs/dbraw/zinc/62/71/75/1131627175.db2.gz PJHZERDUCPGDHU-UHFFFAOYSA-N 1 0 286.394 3.832 20 10 CHCDRO CC[N@H+](Cc1cccc(F)c1)Cc1cc(F)ccc1O ZINC001140058468 1131660151 /nfs/dbraw/zinc/66/01/51/1131660151.db2.gz BIAMAVTWWDXSPQ-UHFFFAOYSA-N 1 0 277.314 3.693 20 10 CHCDRO Cc1ccc(C)c(C[NH+]2CCC3(CC(F)C3)CC2)c1O ZINC001140181965 1131672890 /nfs/dbraw/zinc/67/28/90/1131672890.db2.gz YOVODVWXYVCSHY-UHFFFAOYSA-N 1 0 277.383 3.723 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCCC(F)(F)CC2)c1O ZINC001140178842 1131673560 /nfs/dbraw/zinc/67/35/60/1131673560.db2.gz ZKZODDSJBJPIDI-UHFFFAOYSA-N 1 0 269.335 3.630 20 10 CHCDRO Cc1ccc(C)c(CN2Cc3cnc(Cl)cc3C2)c1O ZINC001140185557 1131673998 /nfs/dbraw/zinc/67/39/98/1131673998.db2.gz YOGUJHUPPWBZNU-UHFFFAOYSA-N 1 0 288.778 3.573 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cccc3c2CCC3)c1 ZINC000845971560 1131674004 /nfs/dbraw/zinc/67/40/04/1131674004.db2.gz LLNSUMXDWKJVPW-ZDUSSCGKSA-N 1 0 297.398 3.740 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCC[C@@H]3CCC[C@@H]32)c1O ZINC001140182553 1131674310 /nfs/dbraw/zinc/67/43/10/1131674310.db2.gz VDNOVTYOURTYFE-HOCLYGCPSA-N 1 0 259.393 3.774 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]Cc1cnc(C2CC2)s1 ZINC000846059117 1131680050 /nfs/dbraw/zinc/68/00/50/1131680050.db2.gz YOBRNMNFSBWTSR-UHFFFAOYSA-N 1 0 294.807 3.669 20 10 CHCDRO CN(C)c1ccc(C[NH2+]CC[C@]2(C)C[C@]2(F)Cl)cc1 ZINC000846036458 1131681575 /nfs/dbraw/zinc/68/15/75/1131681575.db2.gz LNWZMZFNQXYYCQ-HUUCEWRRSA-N 1 0 284.806 3.547 20 10 CHCDRO C[C@@H](C[NH2+][C@@H]1CCc2cccc(O)c21)c1cccc(F)c1 ZINC000834537483 1131681643 /nfs/dbraw/zinc/68/16/43/1131681643.db2.gz DQLRHDPYAOAKRL-BLLLJJGKSA-N 1 0 285.362 3.912 20 10 CHCDRO c1csc(SCCC[NH2+][C@@H](C2CC2)C2CCC2)n1 ZINC000834592889 1131685444 /nfs/dbraw/zinc/68/54/44/1131685444.db2.gz FSBGUUYSYHNHFJ-CYBMUJFWSA-N 1 0 282.478 3.794 20 10 CHCDRO C[C@H](C[NH2+][C@H]1CCc2cccc(O)c21)Cc1cccs1 ZINC000834603237 1131687580 /nfs/dbraw/zinc/68/75/80/1131687580.db2.gz XEGWGRMGZGWWON-WFASDCNBSA-N 1 0 287.428 3.909 20 10 CHCDRO Cc1ccc2c(c1)[C@H]([NH2+][C@@H]1CCc3cccc(O)c31)CC2 ZINC000834639752 1131689972 /nfs/dbraw/zinc/68/99/72/1131689972.db2.gz ASQRMYFGIKFAKU-IAGOWNOFSA-N 1 0 279.383 3.965 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]C1CC(c3ccccc3)C1)CC2 ZINC000834640974 1131689980 /nfs/dbraw/zinc/68/99/80/1131689980.db2.gz VDEFTRSLHISLCA-JCYILVPMSA-N 1 0 279.383 3.915 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CCSC(C)(C)C)c1O ZINC000846149315 1131691020 /nfs/dbraw/zinc/69/10/20/1131691020.db2.gz KTQQQXHCYBHDQD-LLVKDONJSA-N 1 0 283.437 3.583 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1cccc(OC)c1O)c1ccncc1 ZINC000846148607 1131691417 /nfs/dbraw/zinc/69/14/17/1131691417.db2.gz RQLGMIHBHIXEOG-WFASDCNBSA-N 1 0 286.375 3.598 20 10 CHCDRO CCSCC[C@@H](C)[NH2+][C@@H](C)c1cccc(OC)c1O ZINC000846148914 1131691422 /nfs/dbraw/zinc/69/14/22/1131691422.db2.gz ULNNQMVXBPIHGN-NEPJUHHUSA-N 1 0 283.437 3.583 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]C[C@@H](C)C(C)(C)C)c1O ZINC000846148431 1131691513 /nfs/dbraw/zinc/69/15/13/1131691513.db2.gz ZIGOHEVVVGOOSO-NEPJUHHUSA-N 1 0 265.397 3.734 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@H]2CCCC2(C)C)c1O ZINC000846150507 1131692264 /nfs/dbraw/zinc/69/22/64/1131692264.db2.gz QNMHIUQBISUAEB-RISCZKNCSA-N 1 0 263.381 3.630 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CC2(CC(C)C)CC2)c1O ZINC000846153559 1131692422 /nfs/dbraw/zinc/69/24/22/1131692422.db2.gz JTSZWACWTBUFTB-CYBMUJFWSA-N 1 0 277.408 3.878 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]C[C@H]2CCCC(F)(F)C2)c1O ZINC000846166875 1131692967 /nfs/dbraw/zinc/69/29/67/1131692967.db2.gz DSAKGDWLFGHICS-RYUDHWBXSA-N 1 0 299.361 3.877 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]C2(Cc3ccccc3)CC2)c1O ZINC000846165618 1131692985 /nfs/dbraw/zinc/69/29/85/1131692985.db2.gz WONKQJAXAAKSPR-AWEZNQCLSA-N 1 0 297.398 3.827 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]Cc2cccc(C)c2)c1O ZINC000846135666 1131693587 /nfs/dbraw/zinc/69/35/87/1131693587.db2.gz FUVWDTASQYHOQA-CYBMUJFWSA-N 1 0 271.360 3.560 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]Cc2sccc2C)c1O ZINC000846143706 1131694870 /nfs/dbraw/zinc/69/48/70/1131694870.db2.gz KIOWKOVHDRBDJH-NSHDSACASA-N 1 0 277.389 3.622 20 10 CHCDRO C[C@H]([NH2+]CCC1(CO)CCC1)c1ccc2ccccc2c1O ZINC000846209130 1131695702 /nfs/dbraw/zinc/69/57/02/1131695702.db2.gz AFCFLMIENHMPCB-AWEZNQCLSA-N 1 0 299.414 3.749 20 10 CHCDRO C[C@H]([NH2+]CC[C@]1(C)C[C@]1(F)Cl)c1ccccc1O ZINC000846185853 1131697797 /nfs/dbraw/zinc/69/77/97/1131697797.db2.gz UDTRKNACVWEWIU-ZLKJLUDKSA-N 1 0 271.763 3.748 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C2CC2)C2CCOCC2)c1 ZINC000846187594 1131697927 /nfs/dbraw/zinc/69/79/27/1131697927.db2.gz LDWNUOCXJKMDMT-UGSOOPFHSA-N 1 0 289.419 3.556 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H](C)COCC2CC2)cc1 ZINC000846203052 1131699586 /nfs/dbraw/zinc/69/95/86/1131699586.db2.gz DQCHRHRCYIMNGU-CABCVRRESA-N 1 0 290.451 3.608 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C2CC3(CCC3)C2)c(O)c1C ZINC000846211725 1131702649 /nfs/dbraw/zinc/70/26/49/1131702649.db2.gz IHPUQEFDOUEHCW-ZDUSSCGKSA-N 1 0 259.393 3.992 20 10 CHCDRO CC(C)O[C@@H]1C[C@@H]([NH2+][C@@H]2CCc3cccc(O)c32)C1(C)C ZINC000834766240 1131703621 /nfs/dbraw/zinc/70/36/21/1131703621.db2.gz RLDPWWKMHGJSLX-FVQBIDKESA-N 1 0 289.419 3.561 20 10 CHCDRO C[C@@H]1Cc2ccccc2C[N@@H+]1Cc1c(O)cccc1Cl ZINC001140342074 1131703630 /nfs/dbraw/zinc/70/36/30/1131703630.db2.gz SQCVBMAVYAYUQD-GFCCVEGCSA-N 1 0 287.790 3.992 20 10 CHCDRO COC1CCC(CC[NH2+][C@H]2CCc3cccc(O)c32)CC1 ZINC000834766648 1131703702 /nfs/dbraw/zinc/70/37/02/1131703702.db2.gz WDRPVAJTBWRCGG-BCLQGDPASA-N 1 0 289.419 3.564 20 10 CHCDRO C[C@@H]([NH2+]CCCC1CCOCC1)c1cc(Cl)ccc1O ZINC000834818755 1131707589 /nfs/dbraw/zinc/70/75/89/1131707589.db2.gz OPBSXOWOSNSBFN-GFCCVEGCSA-N 1 0 297.826 3.903 20 10 CHCDRO CCC1([NH2+][C@H](C)c2cc(Br)ccc2O)CC1 ZINC000834874632 1131715198 /nfs/dbraw/zinc/71/51/98/1131715198.db2.gz GBWHOTZXNJVNHD-SECBINFHSA-N 1 0 284.197 3.748 20 10 CHCDRO CC[C@@](C)(C[NH2+][C@@H](C)c1cc(Cl)ccc1O)OC ZINC000834883160 1131717817 /nfs/dbraw/zinc/71/78/17/1131717817.db2.gz ZOWPICLAQJKAPE-HZMBPMFUSA-N 1 0 271.788 3.511 20 10 CHCDRO Cc1ccncc1C[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000834886330 1131718805 /nfs/dbraw/zinc/71/88/05/1131718805.db2.gz CDVKYDJLBFXHTO-AWEZNQCLSA-N 1 0 296.414 3.825 20 10 CHCDRO CCCc1ncc(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)o1 ZINC000834898271 1131721857 /nfs/dbraw/zinc/72/18/57/1131721857.db2.gz BCQJJIXHVJQMGR-JTQLQIEISA-N 1 0 294.782 3.837 20 10 CHCDRO CCn1ccnc1[C@H](C)[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000834896110 1131722189 /nfs/dbraw/zinc/72/21/89/1131722189.db2.gz UQDFVXSPCNFEHV-KBPBESRZSA-N 1 0 287.407 3.637 20 10 CHCDRO CC[C@H]([NH2+]CCC[C@@H]1CCOC1)c1ccc(N(C)C)cc1 ZINC000834903545 1131726454 /nfs/dbraw/zinc/72/64/54/1131726454.db2.gz KTMIYWIWBGPGJY-QAPCUYQASA-N 1 0 290.451 3.610 20 10 CHCDRO COCC1(C[NH2+][C@H](C)c2ccc(C)cc2O)CCCC1 ZINC000834905836 1131728030 /nfs/dbraw/zinc/72/80/30/1131728030.db2.gz LRYLHIJRWNGRQB-CQSZACIVSA-N 1 0 277.408 3.558 20 10 CHCDRO CO[C@@H]([C@@H](C)[NH2+][C@@H](C)c1cc(Cl)ccc1O)C1CC1 ZINC000834905366 1131728082 /nfs/dbraw/zinc/72/80/82/1131728082.db2.gz UDZGSNVBTNRHEK-WMFXKJRFSA-N 1 0 283.799 3.510 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCOC(C)(C)C2)c(O)c1C ZINC000834910344 1131730456 /nfs/dbraw/zinc/73/04/56/1131730456.db2.gz OEFGBMQIGUOEHV-LSDHHAIUSA-N 1 0 291.435 3.865 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1C[C@H]1C1CC1)c1ccc(C)cc1O ZINC000834907258 1131730594 /nfs/dbraw/zinc/73/05/94/1131730594.db2.gz ZRBKKEQJFLYCRS-CWRNSKLLSA-N 1 0 259.393 3.787 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1C[C@H]1C1CC1)c1cc(Cl)ccc1O ZINC000834907175 1131730705 /nfs/dbraw/zinc/73/07/05/1131730705.db2.gz XZIQCZBQJZRAGW-PUYPPJJSSA-N 1 0 265.784 3.742 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@H]2CCOC(C)(C)C2)c(O)c1 ZINC000834908200 1131730854 /nfs/dbraw/zinc/73/08/54/1131730854.db2.gz BTUWYVZZPFIKEU-GJZGRUSLSA-N 1 0 291.435 3.865 20 10 CHCDRO CCC1CC[NH+](Cc2ccc(Cl)cc2O)CC1 ZINC001140463103 1131749441 /nfs/dbraw/zinc/74/94/41/1131749441.db2.gz SMMROARVMZOHLY-UHFFFAOYSA-N 1 0 253.773 3.668 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]Cc2ccsc2)cc1 ZINC000835032512 1131760769 /nfs/dbraw/zinc/76/07/69/1131760769.db2.gz FYNQMNVZDUIVDT-ONEGZZNKSA-N 1 0 272.417 3.617 20 10 CHCDRO C[C@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)c1cccnc1 ZINC000835036712 1131761036 /nfs/dbraw/zinc/76/10/36/1131761036.db2.gz QMLDXOOEVKCNNM-VOKGJARPSA-N 1 0 281.403 3.512 20 10 CHCDRO CC[C@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)c1ccncc1 ZINC000835039076 1131762311 /nfs/dbraw/zinc/76/23/11/1131762311.db2.gz ASPSFSAUWPNOJJ-VOFKWLDRSA-N 1 0 295.430 3.902 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+]C[C@H]2CCOC(C)(C)C2)c1O ZINC000835060005 1131767100 /nfs/dbraw/zinc/76/71/00/1131767100.db2.gz NXHLPDJEUVJAKY-LBPRGKRZSA-N 1 0 297.826 3.649 20 10 CHCDRO Cc1ccc(O)c(C[NH+]2CCC3(CC[C@@H](F)C3)CC2)c1 ZINC001140622956 1131830943 /nfs/dbraw/zinc/83/09/43/1131830943.db2.gz IIQJUBHAWDURFL-OAHLLOKOSA-N 1 0 277.383 3.805 20 10 CHCDRO Cc1c(O)ccc(C[NH+]2CCC(C(C)(C)C)CC2)c1O ZINC001140741729 1131905882 /nfs/dbraw/zinc/90/58/82/1131905882.db2.gz BDYFMMLWVCLISL-UHFFFAOYSA-N 1 0 277.408 3.664 20 10 CHCDRO COc1ccccc1[C@@H](C)[NH2+]Cc1ccc(N(C)C)c(C)c1 ZINC000773002875 1131916570 /nfs/dbraw/zinc/91/65/70/1131916570.db2.gz ZOELFLLVECMYIX-OAHLLOKOSA-N 1 0 298.430 3.920 20 10 CHCDRO CC(C)O[C@@H](C[N@H+](C)Cc1ccccc1O)c1ccccc1 ZINC000794412480 1131917793 /nfs/dbraw/zinc/91/77/93/1131917793.db2.gz PJMPKRWVLJCZEA-IBGZPJMESA-N 1 0 299.414 3.990 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCC23CCCC3)c(O)c1 ZINC001140850035 1131946031 /nfs/dbraw/zinc/94/60/31/1131946031.db2.gz BAGOMVHNVIEGCW-UHFFFAOYSA-N 1 0 288.435 3.757 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](C)C2CCC2)cc1 ZINC000773105789 1131945970 /nfs/dbraw/zinc/94/59/70/1131945970.db2.gz QWRJYDOHXWKIFQ-KBPBESRZSA-N 1 0 260.425 3.982 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CC(CC)(CC)CO)cc1 ZINC000773106694 1131947001 /nfs/dbraw/zinc/94/70/01/1131947001.db2.gz YPDOKOQKBTYAOT-OAHLLOKOSA-N 1 0 292.467 3.592 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCCC[C@H]2C)c(O)c1 ZINC001140851361 1131946981 /nfs/dbraw/zinc/94/69/81/1131946981.db2.gz IOLRSZOQVYPCML-CQSZACIVSA-N 1 0 276.424 3.613 20 10 CHCDRO Oc1ccccc1C[NH2+]C[C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000712975639 1131959319 /nfs/dbraw/zinc/95/93/19/1131959319.db2.gz WIUOUKNTUFDRDB-WCQYABFASA-N 1 0 287.325 3.851 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2C[C@@H]3CCC[C@@H]3C2)c(Cl)c1 ZINC001140921896 1131962500 /nfs/dbraw/zinc/96/25/00/1131962500.db2.gz VCOHZFGNAVTAFS-BETUJISGSA-N 1 0 278.827 3.638 20 10 CHCDRO Cc1ccc(C[N@H+](C)Cc2ccccc2C)c(O)c1 ZINC001140949868 1131969787 /nfs/dbraw/zinc/96/97/87/1131969787.db2.gz OAZAQMKVKMMXHC-UHFFFAOYSA-N 1 0 255.361 3.641 20 10 CHCDRO Cc1ccc(C[N@@H+]2CCSC[C@H]2c2ccccc2)c(O)c1 ZINC001140950835 1131970176 /nfs/dbraw/zinc/97/01/76/1131970176.db2.gz KJFOFZQMWYTRBM-KRWDZBQOSA-N 1 0 299.439 3.991 20 10 CHCDRO Cc1ccc(C[N@@H+]2CC[C@H]3CCCC[C@H]3C2)c(O)c1 ZINC001140950713 1131970467 /nfs/dbraw/zinc/97/04/67/1131970467.db2.gz FEMHWOKQCIHIBK-CABCVRRESA-N 1 0 259.393 3.713 20 10 CHCDRO Cc1ccc(C[N@@H+]2CCC[C@@H]3CCCC[C@H]32)c(O)c1 ZINC001140951120 1131971717 /nfs/dbraw/zinc/97/17/17/1131971717.db2.gz ZOSNWXPCVLPRJK-GOEBONIOSA-N 1 0 259.393 3.855 20 10 CHCDRO Cc1ccc(C[N@@H+]2CC[C@H]2c2ccccc2)c(O)c1 ZINC001140950922 1131972229 /nfs/dbraw/zinc/97/22/29/1131972229.db2.gz PDVVVGONJHUACG-INIZCTEOSA-N 1 0 253.345 3.648 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2CCCC[C@H]2C)c1 ZINC000037021617 1131989223 /nfs/dbraw/zinc/98/92/23/1131989223.db2.gz XJZGYMOCTLLUNG-XUJVJEKNSA-N 1 0 263.381 3.630 20 10 CHCDRO CC[C@@H]([NH2+]CC[C@H]1CCCS1)c1ccccc1O ZINC000715697810 1131990459 /nfs/dbraw/zinc/99/04/59/1131990459.db2.gz QLFKQEPUCUHSHK-TZMCWYRMSA-N 1 0 265.422 3.719 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccns1 ZINC000716023446 1132001201 /nfs/dbraw/zinc/00/12/01/1132001201.db2.gz WYEHCEGGPHLUKT-CYBMUJFWSA-N 1 0 287.432 3.594 20 10 CHCDRO C[C@@H]([NH2+]CC1C[C@H]2CC[C@@H](C1)S2)c1cc(F)ccc1O ZINC000716073884 1132004784 /nfs/dbraw/zinc/00/47/84/1132004784.db2.gz VVNXLLBQVQYPBF-WDFAYWTNSA-N 1 0 295.423 3.856 20 10 CHCDRO COc1ccccc1C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000037195517 1132008366 /nfs/dbraw/zinc/00/83/66/1132008366.db2.gz YISGIWGLTWGGGR-AWEZNQCLSA-N 1 0 284.403 3.612 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)C1CCCCC1 ZINC000037233605 1132024223 /nfs/dbraw/zinc/02/42/23/1132024223.db2.gz NRMIGYQKTSDROJ-AWEZNQCLSA-N 1 0 260.425 3.811 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2ccc(N(C)C)cc2)c(F)c1 ZINC001141195375 1132039385 /nfs/dbraw/zinc/03/93/85/1132039385.db2.gz LTDGILYNNZXQKR-UHFFFAOYSA-N 1 0 286.394 3.832 20 10 CHCDRO C[C@@H]1CC[C@H]([N@@H+]2CCCc3cc(O)c(O)cc3C2)C[C@@H]1C ZINC001172379414 1132171186 /nfs/dbraw/zinc/17/11/86/1132171186.db2.gz OGJDVXGEPJBOSU-WWGRRREGSA-N 1 0 289.419 3.671 20 10 CHCDRO CC[C@H](C)OCC[C@@H](C)[N@H+](CC)Cc1ccccc1O ZINC001172356434 1132185834 /nfs/dbraw/zinc/18/58/34/1132185834.db2.gz YKXOLRLMJKCTNS-CABCVRRESA-N 1 0 279.424 3.808 20 10 CHCDRO COC[C@@H]1CC[N@@H+]1Cc1cc2oc3ccccc3c2cc1O ZINC000840083747 1132246756 /nfs/dbraw/zinc/24/67/56/1132246756.db2.gz RBQLJXZONJWDLC-ZDUSSCGKSA-N 1 0 297.354 3.512 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@@H+]2CCSC3(CCC3)CC2)c1 ZINC000840174641 1132249632 /nfs/dbraw/zinc/24/96/32/1132249632.db2.gz RMKFMMTWTJFUTG-UHFFFAOYSA-N 1 0 291.460 3.871 20 10 CHCDRO CCO[C@H]1C[C@@H]([NH2+][C@H](C)c2ccc3ccccc3c2O)C1 ZINC000840764739 1132285182 /nfs/dbraw/zinc/28/51/82/1132285182.db2.gz YYHHPDNHMSKDQC-YUELXQCFSA-N 1 0 285.387 3.764 20 10 CHCDRO C[C@@H](CCCc1cccnc1)[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000840771078 1132285611 /nfs/dbraw/zinc/28/56/11/1132285611.db2.gz AAKCBHWNTVXPJF-WMLDXEAASA-N 1 0 296.414 3.776 20 10 CHCDRO COCC[C@H](C)C[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000840835602 1132291759 /nfs/dbraw/zinc/29/17/59/1132291759.db2.gz OCMHHBVFHLKDEA-UONOGXRCSA-N 1 0 291.435 3.594 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CS[C@@H](C)C2)cc1 ZINC000840855590 1132294324 /nfs/dbraw/zinc/29/43/24/1132294324.db2.gz MQYSWOWUGPGSLQ-YDHLFZDLSA-N 1 0 278.465 3.687 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CS[C@@H](C)C1)c1ccc(C)cc1O ZINC000840858965 1132295518 /nfs/dbraw/zinc/29/55/18/1132295518.db2.gz FGEKWZMMQRBCCZ-OBJOEFQTSA-N 1 0 265.422 3.635 20 10 CHCDRO C[C@@H]([NH2+]Cc1cnccc1C(C)(C)C)c1ccccc1O ZINC000840855859 1132295626 /nfs/dbraw/zinc/29/56/26/1132295626.db2.gz OQXHPZQAIJRHDV-CYBMUJFWSA-N 1 0 284.403 3.936 20 10 CHCDRO C[C@@H]1CC[N@@H+]1Cc1ccc(OCc2ccccc2)cc1O ZINC001231467507 1132295757 /nfs/dbraw/zinc/29/57/57/1132295757.db2.gz HKAMRGBSCCXKHJ-CQSZACIVSA-N 1 0 283.371 3.565 20 10 CHCDRO C[C@@H]([NH2+]CC(C)(C)OCC1CC1)c1ccc(N(C)C)cc1 ZINC000840874289 1132298471 /nfs/dbraw/zinc/29/84/71/1132298471.db2.gz YQGDASHVXSRUCV-CQSZACIVSA-N 1 0 290.451 3.608 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CC(C)(C)OCC2CC2)c(O)c1 ZINC000840876330 1132298834 /nfs/dbraw/zinc/29/88/34/1132298834.db2.gz LXXUKCOJTQAJAL-AWEZNQCLSA-N 1 0 291.435 3.865 20 10 CHCDRO Cc1cccc(C[NH2+]Cc2c(O)cc(C)cc2Cl)c1 ZINC000840872960 1132299194 /nfs/dbraw/zinc/29/91/94/1132299194.db2.gz OKWGRCAGZJNZKG-UHFFFAOYSA-N 1 0 275.779 3.952 20 10 CHCDRO CC[C@H]([NH2+]CC(C)(C)c1cccnc1)c1ccccc1O ZINC000840891059 1132304438 /nfs/dbraw/zinc/30/44/38/1132304438.db2.gz FJBJRFDOVDQYGV-INIZCTEOSA-N 1 0 284.403 3.806 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@@H](C)c2ccncc2)c(Cl)c1 ZINC000840903519 1132308434 /nfs/dbraw/zinc/30/84/34/1132308434.db2.gz ONISRWLYVGVCLA-GFCCVEGCSA-N 1 0 290.794 3.642 20 10 CHCDRO Cc1cc([C@@H]2CCC[N@H+]2Cc2ccc(N(C)C)cc2C)on1 ZINC000840910771 1132309055 /nfs/dbraw/zinc/30/90/55/1132309055.db2.gz LWAACHKSAIOAMS-KRWDZBQOSA-N 1 0 299.418 3.695 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CCSC2(CCC2)CC1 ZINC000840955008 1132313538 /nfs/dbraw/zinc/31/35/38/1132313538.db2.gz QDVHCJGHPURFHJ-UHFFFAOYSA-N 1 0 297.851 3.907 20 10 CHCDRO C[C@]1(CO)CCC[N@H+](Cc2c(O)ccc3ccccc32)CC1 ZINC001231587481 1132318251 /nfs/dbraw/zinc/31/82/51/1132318251.db2.gz CZIVWDIOVFIVQK-IBGZPJMESA-N 1 0 299.414 3.530 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCc3cc(F)c(F)cc3C2)c1O ZINC001231595137 1132321082 /nfs/dbraw/zinc/32/10/82/1132321082.db2.gz OPQMOPVAXZVCRN-UHFFFAOYSA-N 1 0 289.325 3.537 20 10 CHCDRO COc1ccc2c(c1)C[N@@H+](Cc1cccc(C)c1O)CCC2 ZINC001231595306 1132321235 /nfs/dbraw/zinc/32/12/35/1132321235.db2.gz VYKJEFJZJZOJSB-UHFFFAOYSA-N 1 0 297.398 3.658 20 10 CHCDRO CCCC[C@@H]1CCC[C@H]1[NH2+]CCc1ccc(N)cc1 ZINC000841035848 1132321715 /nfs/dbraw/zinc/32/17/15/1132321715.db2.gz PLLVPLNBNDLLSF-NVXWUHKLSA-N 1 0 260.425 3.760 20 10 CHCDRO C[C@H]([NH2+]CCc1ccc(N)cc1)[C@@H](C)c1ccccc1 ZINC000841035307 1132321763 /nfs/dbraw/zinc/32/17/63/1132321763.db2.gz MHKUMFSUGMUBLJ-CABCVRRESA-N 1 0 268.404 3.593 20 10 CHCDRO CC(C)[C@H](C[NH2+]CCc1ccc(N)cc1)c1ccccc1 ZINC000841039011 1132323666 /nfs/dbraw/zinc/32/36/66/1132323666.db2.gz XEIPCHFLNPBORI-IBGZPJMESA-N 1 0 282.431 3.841 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCC[C@@H]2c2cccnc2)c(O)c1 ZINC001231842987 1132375755 /nfs/dbraw/zinc/37/57/55/1132375755.db2.gz RFBNLABDPSBSBZ-QGZVFWFLSA-N 1 0 282.387 3.741 20 10 CHCDRO COc1cc(N(C)C)ccc1C[NH+]1CCC(C(C)C)CC1 ZINC001231854852 1132377892 /nfs/dbraw/zinc/37/78/92/1132377892.db2.gz MXCXKVNCUIFMGP-UHFFFAOYSA-N 1 0 290.451 3.629 20 10 CHCDRO Cc1cccc(CC[N@@H+](C)Cc2c(C)cc(C)cc2O)c1 ZINC001231847068 1132379933 /nfs/dbraw/zinc/37/99/33/1132379933.db2.gz VDAHGVKWRQAFMZ-UHFFFAOYSA-N 1 0 283.415 3.992 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2ccc3ccccc3c2O)CCC[C@@]1(C)O ZINC001231879573 1132389365 /nfs/dbraw/zinc/38/93/65/1132389365.db2.gz IZCXNJXCKWVHOW-AUUYWEPGSA-N 1 0 299.414 3.528 20 10 CHCDRO CC1(C)C[N@H+](Cc2ccc3ccccc3c2O)[C@@](C)(CO)C1 ZINC001231880000 1132390838 /nfs/dbraw/zinc/39/08/38/1132390838.db2.gz ZXIRGXWVVDDZDW-LJQANCHMSA-N 1 0 299.414 3.528 20 10 CHCDRO Oc1c(C[N@@H+]2CC[C@@]3(C2)CCCCO3)ccc2ccccc21 ZINC001231879381 1132391155 /nfs/dbraw/zinc/39/11/55/1132391155.db2.gz DECJKGSGNDSMGP-LJQANCHMSA-N 1 0 297.398 3.690 20 10 CHCDRO CCn1cc([C@@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2O)cn1 ZINC000841755522 1132391509 /nfs/dbraw/zinc/39/15/09/1132391509.db2.gz IHNDGUOIAAIRLV-GHMZBOCLSA-N 1 0 293.798 3.674 20 10 CHCDRO C[C@H]([NH2+][C@@H](CO)CC1CCCCC1)c1cc(F)ccc1O ZINC000841761317 1132395624 /nfs/dbraw/zinc/39/56/24/1132395624.db2.gz IGVABUIPPXECBW-SWLSCSKDSA-N 1 0 295.398 3.513 20 10 CHCDRO CCC[N@@H+](Cc1cc(F)c(F)cc1[O-])CC(C)C ZINC001142531284 1132404318 /nfs/dbraw/zinc/40/43/18/1132404318.db2.gz RXMVRMCMTRZDSZ-UHFFFAOYSA-N 1 0 257.324 3.538 20 10 CHCDRO CCCC[C@@H](CC(C)C)[NH2+]Cc1ccc(O)cc1O ZINC001173252496 1132422997 /nfs/dbraw/zinc/42/29/97/1132422997.db2.gz IZAUDXGXDVVXRK-AWEZNQCLSA-N 1 0 265.397 3.792 20 10 CHCDRO Oc1cc(O)c(C[NH+]2C3CCCC2CCC3)cc1Cl ZINC001232262296 1132444560 /nfs/dbraw/zinc/44/45/60/1132444560.db2.gz BFZQLFFWSJDHME-UHFFFAOYSA-N 1 0 281.783 3.658 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CCC[C@H](C)CC2)cc1Cl ZINC001232263827 1132444863 /nfs/dbraw/zinc/44/48/63/1132444863.db2.gz APVHAWIFCIGABZ-NSHDSACASA-N 1 0 283.799 3.676 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CC[C@H](C)C[C@@H]2C)cc1Cl ZINC001232270216 1132447459 /nfs/dbraw/zinc/44/74/59/1132447459.db2.gz YQXHUUKFGMTATI-QWRGUYRKSA-N 1 0 283.799 3.675 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]C2(c3ccccc3C)CC2)c1 ZINC000842732236 1132455268 /nfs/dbraw/zinc/45/52/68/1132455268.db2.gz JSSQCBCMFKZSMU-UHFFFAOYSA-N 1 0 297.398 3.878 20 10 CHCDRO CCCCOCC[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2C ZINC000040506502 1132473380 /nfs/dbraw/zinc/47/33/80/1132473380.db2.gz DABXSXAFOQJTNB-KBPBESRZSA-N 1 0 277.408 3.655 20 10 CHCDRO CC[C@@H]([NH2+]CCC1(COC)CC1)c1ccc(N(C)C)cc1 ZINC000842895338 1132474836 /nfs/dbraw/zinc/47/48/36/1132474836.db2.gz WATZYPZCHFZAGW-QGZVFWFLSA-N 1 0 290.451 3.610 20 10 CHCDRO CCSC[C@H](C)[N@H+](CC)Cc1ccc(N(C)C)cc1 ZINC001173316447 1132477637 /nfs/dbraw/zinc/47/76/37/1132477637.db2.gz XDSHLKUDGXMVFA-AWEZNQCLSA-N 1 0 280.481 3.716 20 10 CHCDRO CC(C)(C)c1cccc(C[N@@H+]2CCc3ncccc3C2)c1O ZINC001143110299 1132504040 /nfs/dbraw/zinc/50/40/40/1132504040.db2.gz BXNTTYXRAYRSIW-UHFFFAOYSA-N 1 0 296.414 3.643 20 10 CHCDRO C[N@H+](CCC1CC1)Cc1cccc(C(C)(C)C)c1O ZINC001143112600 1132504180 /nfs/dbraw/zinc/50/41/80/1132504180.db2.gz WPKFLKLTECWGJR-UHFFFAOYSA-N 1 0 261.409 3.922 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]C1(c2ccccc2Cl)CC1 ZINC000843418380 1132530421 /nfs/dbraw/zinc/53/04/21/1132530421.db2.gz COBDYATWTLGFBU-UHFFFAOYSA-N 1 0 291.753 3.964 20 10 CHCDRO COc1ccc(O)c(C[NH2+]C2(c3ccc(C)cc3)CCC2)c1 ZINC000843435312 1132534503 /nfs/dbraw/zinc/53/45/03/1132534503.db2.gz SRAHSGHBCSNHID-UHFFFAOYSA-N 1 0 297.398 3.878 20 10 CHCDRO CC[C@@H](C)[N@H+](C)Cc1c([O-])cc(Br)cc1F ZINC001233027903 1132565557 /nfs/dbraw/zinc/56/55/57/1132565557.db2.gz GBWFQWWHSIJNPF-MRVPVSSYSA-N 1 0 290.176 3.524 20 10 CHCDRO C[C@H]1CCC[N@H+](Cc2cc(C(C)(C)C)ccc2O)C1 ZINC001233283483 1132595890 /nfs/dbraw/zinc/59/58/90/1132595890.db2.gz ILPZNIVJYQQJSN-ZDUSSCGKSA-N 1 0 261.409 3.922 20 10 CHCDRO C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(C(F)(F)F)cc2O)C1 ZINC001233455141 1132624802 /nfs/dbraw/zinc/62/48/02/1132624802.db2.gz XYEANVNDKVJNFA-GHMZBOCLSA-N 1 0 287.325 3.889 20 10 CHCDRO CC1(C)CC[N@H+](Cc2ccc(C(F)(F)F)cc2O)C1 ZINC001233454248 1132625725 /nfs/dbraw/zinc/62/57/25/1132625725.db2.gz NKRPGPJCFGETBX-UHFFFAOYSA-N 1 0 273.298 3.643 20 10 CHCDRO Oc1cc(C(F)(F)F)ccc1C[NH+]1C2CCC1CC2 ZINC001233454062 1132625859 /nfs/dbraw/zinc/62/58/59/1132625859.db2.gz FKKKSEWTMNHLJN-UHFFFAOYSA-N 1 0 271.282 3.538 20 10 CHCDRO CCCCC[NH+](CCCCC)Cc1cc(O)c(O)cc1O ZINC001233486653 1132627212 /nfs/dbraw/zinc/62/72/12/1132627212.db2.gz WSTYIHVZSJBCAU-UHFFFAOYSA-N 1 0 295.423 3.986 20 10 CHCDRO Oc1cc(O)c(C[N@@H+]2CCCC[C@@H]2c2ccccc2)cc1O ZINC001233483171 1132627670 /nfs/dbraw/zinc/62/76/70/1132627670.db2.gz PUGDOGHCSNKXLY-OAHLLOKOSA-N 1 0 299.370 3.531 20 10 CHCDRO c1cc(Nc2ccc3c(c2)CCCN3)cc(N2CCCC2)[nH+]1 ZINC001159260161 1132821500 /nfs/dbraw/zinc/82/15/00/1132821500.db2.gz HRPKKYPTBGTHDE-UHFFFAOYSA-N 1 0 294.402 3.784 20 10 CHCDRO O=C1c2ccccc2-c2cccc(NC3=CCC[NH2+]CC3)c21 ZINC001159783737 1132909318 /nfs/dbraw/zinc/90/93/18/1132909318.db2.gz JYONKBSHOBZDLK-UHFFFAOYSA-N 1 0 290.366 3.577 20 10 CHCDRO Cc1cc(Nc2cc(Cl)cc(Cl)c2O)cc[nH+]1 ZINC001174657358 1132951480 /nfs/dbraw/zinc/95/14/80/1132951480.db2.gz SGRDATDXUCUOJV-UHFFFAOYSA-N 1 0 269.131 3.568 20 10 CHCDRO Cc1cc(Nc2ccc(Cc3ccc(N)cc3)cc2)cc[nH+]1 ZINC001174656907 1132951776 /nfs/dbraw/zinc/95/17/76/1132951776.db2.gz VPLSVWNSAJUQLC-UHFFFAOYSA-N 1 0 289.382 3.729 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(N[C@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC001162397593 1133074344 /nfs/dbraw/zinc/07/43/44/1133074344.db2.gz WQLQFRUFKWBORA-WBVHZDCISA-N 1 0 283.419 3.776 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(N[C@H]2CC[C@@H]3C[NH2+]C[C@@H]32)cc1 ZINC001163262661 1133139820 /nfs/dbraw/zinc/13/98/20/1133139820.db2.gz GTSYTFAZBCAISS-MNEFBYGVSA-N 1 0 295.430 3.504 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C/C=C/c2cccc(F)c2)c1 ZINC001206715341 1133265686 /nfs/dbraw/zinc/26/56/86/1133265686.db2.gz QTSNFVMDRRUEJQ-HWKANZROSA-N 1 0 271.335 3.643 20 10 CHCDRO COc1ccccc1[C@@H](C)[N@H+](C)Cc1ccccc1O ZINC001203558465 1133340101 /nfs/dbraw/zinc/34/01/01/1133340101.db2.gz IFYLIIQVFJRSOQ-CYBMUJFWSA-N 1 0 271.360 3.594 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CCC(C)(C)COC)cc1 ZINC001203573155 1133342191 /nfs/dbraw/zinc/34/21/91/1133342191.db2.gz VJDJMZKZFIOLGR-UHFFFAOYSA-N 1 0 292.467 3.685 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCC[C@](C)(F)CC2)c1O ZINC001203602398 1133343911 /nfs/dbraw/zinc/34/39/11/1133343911.db2.gz UJCVQZOYBNRHQX-INIZCTEOSA-N 1 0 281.371 3.505 20 10 CHCDRO COc1ccc(C[N@@H+]2CCC[C@H](c3ccccc3)C2)c(O)c1 ZINC001203629121 1133346227 /nfs/dbraw/zinc/34/62/27/1133346227.db2.gz RFKVANYZUFUVKU-INIZCTEOSA-N 1 0 297.398 3.780 20 10 CHCDRO COc1ccc(C[N@H+](C)Cc2ccc(C)c(C)c2)c(O)c1 ZINC001203634384 1133346523 /nfs/dbraw/zinc/34/65/23/1133346523.db2.gz CFNJCULITTXVBD-UHFFFAOYSA-N 1 0 285.387 3.650 20 10 CHCDRO Oc1ccc(Cl)cc1CN1Cc2ccc(F)cc2C1 ZINC001203664257 1133351541 /nfs/dbraw/zinc/35/15/41/1133351541.db2.gz UPFRCEHJWPSCHF-UHFFFAOYSA-N 1 0 277.726 3.701 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]C2CCC=CCC2)cc1 ZINC001203721613 1133358621 /nfs/dbraw/zinc/35/86/21/1133358621.db2.gz PYNALPPFWZUVNA-FPLPWBNLSA-N 1 0 270.420 3.854 20 10 CHCDRO Oc1ccc(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)cc1O ZINC001203878837 1133377935 /nfs/dbraw/zinc/37/79/35/1133377935.db2.gz DHHVMNLSLIXJEC-OAHLLOKOSA-N 1 0 287.334 3.574 20 10 CHCDRO CCCCC1CC[NH+](Cc2ccc(O)c(O)c2)CC1 ZINC001203877931 1133377983 /nfs/dbraw/zinc/37/79/83/1133377983.db2.gz LLDPUFVINFOXEZ-UHFFFAOYSA-N 1 0 263.381 3.500 20 10 CHCDRO Oc1ccc(C[NH+]2CCC(c3cccs3)CC2)cc1O ZINC001203878643 1133378915 /nfs/dbraw/zinc/37/89/15/1133378915.db2.gz JIJSLHJAHOTYCM-UHFFFAOYSA-N 1 0 289.400 3.539 20 10 CHCDRO C[N@H+](Cc1cccs1)Cc1ccc(N2CCCC2)cc1 ZINC001204015212 1133399563 /nfs/dbraw/zinc/39/95/63/1133399563.db2.gz JYNIBSJINSJMLO-UHFFFAOYSA-N 1 0 286.444 3.980 20 10 CHCDRO C[N@H+](Cc1ccsc1)Cc1ccc(N2CCCC2)cc1 ZINC001204039252 1133402848 /nfs/dbraw/zinc/40/28/48/1133402848.db2.gz ROPZQHNQVHAPOP-UHFFFAOYSA-N 1 0 286.444 3.980 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCc3ccccc3C2)cc1Cl ZINC001204145007 1133409982 /nfs/dbraw/zinc/40/99/82/1133409982.db2.gz MBQDDUXTQXGMTL-UHFFFAOYSA-N 1 0 287.790 3.912 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+]1C[C@@H](C)CC[C@@H]1C ZINC001204163906 1133412132 /nfs/dbraw/zinc/41/21/32/1133412132.db2.gz VLSLZNYUBQQIGF-ZFWWWQNUSA-N 1 0 260.425 3.681 20 10 CHCDRO C[C@@H]1c2cccn2CC[N@H+]1Cc1ccc(N2CCCC2)cc1 ZINC001204320905 1133436538 /nfs/dbraw/zinc/43/65/38/1133436538.db2.gz DCQHEKYKUKXWAQ-MRXNPFEDSA-N 1 0 295.430 3.665 20 10 CHCDRO C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001204322552 1133436643 /nfs/dbraw/zinc/43/66/43/1133436643.db2.gz RQHIGYQBORZLDO-HZPDHXFCSA-N 1 0 272.436 3.765 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[NH+]1CCC2(CC2)CC1 ZINC001204325689 1133437698 /nfs/dbraw/zinc/43/76/98/1133437698.db2.gz TZQRBSULAZLWEX-UHFFFAOYSA-N 1 0 270.420 3.663 20 10 CHCDRO C[C@@]1(F)CCC[N@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001204325820 1133438828 /nfs/dbraw/zinc/43/88/28/1133438828.db2.gz VPIBSJRKYYAHDU-QGZVFWFLSA-N 1 0 276.399 3.611 20 10 CHCDRO CC[N@H+](Cc1ccc(N)cc1)[C@@H](C)Cc1ccc(OC)cc1 ZINC001204869676 1133493912 /nfs/dbraw/zinc/49/39/12/1133493912.db2.gz GGBQNIOUCVJYQE-HNNXBMFYSA-N 1 0 298.430 3.731 20 10 CHCDRO CC[N@H+](Cc1cccc2[nH]ccc21)Cc1ccccc1O ZINC001205298207 1133556478 /nfs/dbraw/zinc/55/64/78/1133556478.db2.gz XIUARAISXKKINQ-UHFFFAOYSA-N 1 0 280.371 3.896 20 10 CHCDRO CC(C)c1ccc(O)c(C[N@H+](C)Cc2cccnc2)c1 ZINC001205334806 1133564001 /nfs/dbraw/zinc/56/40/01/1133564001.db2.gz MOCSIYSKDKLBCB-UHFFFAOYSA-N 1 0 270.376 3.543 20 10 CHCDRO CC[C@@H]1CC[N@H+](Cc2cc(F)c(N(C)C)cc2F)[C@H]1C ZINC001205471621 1133580174 /nfs/dbraw/zinc/58/01/74/1133580174.db2.gz OTMBQXDEVIWDIE-NWDGAFQWSA-N 1 0 282.378 3.651 20 10 CHCDRO CC[C@H]1CC[N@H+](Cc2ccc(Br)cc2O)[C@H]1C ZINC001205470635 1133580649 /nfs/dbraw/zinc/58/06/49/1133580649.db2.gz BEHYKYJAGMWUDP-QWRGUYRKSA-N 1 0 298.224 3.775 20 10 CHCDRO COc1cc(C[NH+]2CC(C(C)C)C2)c(O)c(C(C)(C)C)c1 ZINC001205542333 1133586905 /nfs/dbraw/zinc/58/69/05/1133586905.db2.gz YZIDCPWPFPRJMR-UHFFFAOYSA-N 1 0 291.435 3.786 20 10 CHCDRO CCc1cccc(C[N@H+](CCOC)[C@@H]2CC[C@@H](C)C2)c1O ZINC001205608818 1133593969 /nfs/dbraw/zinc/59/39/69/1133593969.db2.gz KQNCMWZGKHTIMR-RHSMWYFYSA-N 1 0 291.435 3.592 20 10 CHCDRO CCc1cccc(C[N@H+](CCOC)[C@H]2CC[C@H](C)C2)c1O ZINC001205608820 1133594422 /nfs/dbraw/zinc/59/44/22/1133594422.db2.gz KQNCMWZGKHTIMR-YOEHRIQHSA-N 1 0 291.435 3.592 20 10 CHCDRO CCCN(Cc1ccc(OCC)o1)c1ccc(C[NH3+])cc1 ZINC001205655850 1133599700 /nfs/dbraw/zinc/59/97/00/1133599700.db2.gz DHCDXTOOLOPIND-UHFFFAOYSA-N 1 0 288.391 3.554 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH+]1CC2(C1)CCCCC2 ZINC001206174067 1133667622 /nfs/dbraw/zinc/66/76/22/1133667622.db2.gz GYQZBGQPJIYDGY-UHFFFAOYSA-N 1 0 272.436 3.827 20 10 CHCDRO CC(C)OCC(C)(C)[NH2+]Cc1cc(C(C)C)ccc1O ZINC001206264199 1133678290 /nfs/dbraw/zinc/67/82/90/1133678290.db2.gz VHULKXYWAHXMBK-UHFFFAOYSA-N 1 0 279.424 3.809 20 10 CHCDRO C[C@@H]1CC[C@H](C)[C@@H]([NH2+]Cc2cc(Cl)ccc2O)C1 ZINC001206517427 1133712921 /nfs/dbraw/zinc/71/29/21/1133712921.db2.gz SYJPATMLBHDLKH-SUNKGSAMSA-N 1 0 267.800 3.960 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+][C@H]1CCCC12CCC2 ZINC001206516712 1133713000 /nfs/dbraw/zinc/71/30/00/1133713000.db2.gz CBELFWCLVSBLOS-AWEZNQCLSA-N 1 0 265.784 3.858 20 10 CHCDRO Oc1cc(Cl)ccc1C[N@@H+]1CCCC2(CC2)CC1 ZINC001206999795 1133758277 /nfs/dbraw/zinc/75/82/77/1133758277.db2.gz OLQMPGZRKVNDRV-UHFFFAOYSA-N 1 0 265.784 3.812 20 10 CHCDRO CC/C=C\CCC[N@@H+]1CCCc2cc(O)c(O)cc2C1 ZINC001208135282 1133882317 /nfs/dbraw/zinc/88/23/17/1133882317.db2.gz AAPYSTSUFXWRLC-ARJAWSKDSA-N 1 0 275.392 3.592 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(C[N@@H+]2CC[C@@H](F)C2)cc1 ZINC001209516355 1134032102 /nfs/dbraw/zinc/03/21/02/1134032102.db2.gz DROUWQLNONASBP-MRXNPFEDSA-N 1 0 272.367 3.638 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(C[N@@H+]2C[C@H]3[C@H](CF)[C@H]3C2)cc1 ZINC001209520142 1134034009 /nfs/dbraw/zinc/03/40/09/1134034009.db2.gz ONHSEYGXUXFBLG-LDLYASANSA-N 1 0 298.405 3.741 20 10 CHCDRO COc1ccc(C[NH2+]C[C@@H]2CC3CCC2CC3)cc1C ZINC000400032293 1134577216 /nfs/dbraw/zinc/57/72/16/1134577216.db2.gz TUEICAMIAIHUNZ-PREGVCBESA-N 1 0 273.420 3.920 20 10 CHCDRO CC[C@@H]1C[N@H+](Cc2c(O)ccc3ccccc32)[C@H](C)CO1 ZINC000403825820 1134877683 /nfs/dbraw/zinc/87/76/83/1134877683.db2.gz MLRPVNSDAAPNMU-UKRRQHHQSA-N 1 0 285.387 3.545 20 10 CHCDRO C[C@@H]1C[NH2+]C[C@H]1Oc1ccc(NN=C2C=CC(=O)C=C2)cc1 ZINC001218034668 1135046743 /nfs/dbraw/zinc/04/67/43/1135046743.db2.gz UXQVRYBSSBAWLP-SJKOYZFVSA-N 1 0 297.358 3.794 20 10 CHCDRO Cc1ccccc1[C@@H](C)Oc1ccc(N2CC[NH2+]CC2)cc1 ZINC001218295801 1135081516 /nfs/dbraw/zinc/08/15/16/1135081516.db2.gz OQXXINIUSIPLAF-MRXNPFEDSA-N 1 0 296.414 3.545 20 10 CHCDRO O=C1C=CC(=NNc2ccc(O[C@@H]3C=CC[NH2+]C3)cc2)C=C1 ZINC001218334085 1135090255 /nfs/dbraw/zinc/09/02/55/1135090255.db2.gz LDAFODTZUVOSND-QGZVFWFLSA-N 1 0 295.342 3.714 20 10 CHCDRO CC[C@@H](C)CC[C@H](C)Oc1ccc(N2CC[NH2+]CC2)cc1 ZINC001218356274 1135093889 /nfs/dbraw/zinc/09/38/89/1135093889.db2.gz BCXVHWJWJQPBRD-CVEARBPZSA-N 1 0 290.451 3.690 20 10 CHCDRO CCC[C@H](C)[C@@H](CC)Oc1ccc(N2CC[NH2+]CC2)cc1 ZINC001218439341 1135105202 /nfs/dbraw/zinc/10/52/02/1135105202.db2.gz SPFJDIQXZPLFJI-MAUKXSAKSA-N 1 0 290.451 3.690 20 10 CHCDRO Cc1cc(NCc2ccc(N)cc2)nc2ccccc12 ZINC000312433515 1135134324 /nfs/dbraw/zinc/13/43/24/1135134324.db2.gz IKGOUBZWSKVUKW-UHFFFAOYSA-N 1 0 263.344 3.738 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCCCOC(C)C)c1 ZINC000186529564 262315883 /nfs/dbraw/zinc/31/58/83/262315883.db2.gz ADNJQLKBDLHHRS-AWEZNQCLSA-N 1 0 265.397 3.556 20 10 CHCDRO Oc1ccccc1C[NH2+]Cc1cccc(C(F)(F)F)c1 ZINC000019906702 170918786 /nfs/dbraw/zinc/91/87/86/170918786.db2.gz IDCUEMWTOVTKED-UHFFFAOYSA-N 1 0 281.277 3.701 20 10 CHCDRO CCOc1cccc(C[NH2+][C@H](C)c2ccccc2C)c1O ZINC000020126189 171010491 /nfs/dbraw/zinc/01/04/91/171010491.db2.gz ONBGJLHBUJRTMT-CQSZACIVSA-N 1 0 285.387 3.950 20 10 CHCDRO C[C@@H]([NH2+]CCCOC1CCCCC1)c1ccccc1O ZINC000020191437 171057820 /nfs/dbraw/zinc/05/78/20/171057820.db2.gz POOHXNQPNWHOJI-CQSZACIVSA-N 1 0 277.408 3.782 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCCc2occc21)c1ccccc1O ZINC000020204259 171069796 /nfs/dbraw/zinc/06/97/96/171069796.db2.gz YTLCKFNSHLBJDU-RISCZKNCSA-N 1 0 257.333 3.713 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccccc1O)c1ccc(C)cc1 ZINC000037048091 172914720 /nfs/dbraw/zinc/91/47/20/172914720.db2.gz IMAYSANDEWDDMW-INIZCTEOSA-N 1 0 255.361 3.942 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)c1ccccc1F)c1ccccc1O ZINC000037763989 173690498 /nfs/dbraw/zinc/69/04/98/173690498.db2.gz UFCAIHTZFSGTDN-VXGBXAGGSA-N 1 0 259.324 3.943 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2cc(C)ccc2O)s1 ZINC000071408383 176156713 /nfs/dbraw/zinc/15/67/13/176156713.db2.gz VMNSVQRAZPZJPM-LBPRGKRZSA-N 1 0 261.390 3.921 20 10 CHCDRO COc1ccc(C[NH2+]Cc2ccc(C)cc2)cc1C ZINC000035052632 260006395 /nfs/dbraw/zinc/00/63/95/260006395.db2.gz CDTBQPACSNDRJE-UHFFFAOYSA-N 1 0 255.361 3.602 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]Cc2ccc(OC)c(C)c2)c1 ZINC000037771476 260116315 /nfs/dbraw/zinc/11/63/15/260116315.db2.gz XVLDDEODCRHLQH-CQSZACIVSA-N 1 0 285.387 3.863 20 10 CHCDRO COCc1ccccc1C[NH2+][C@H](C)c1cc(C)ccc1O ZINC000037762789 260117079 /nfs/dbraw/zinc/11/70/79/260117079.db2.gz GRAZISLXJDRBHH-CQSZACIVSA-N 1 0 285.387 3.698 20 10 CHCDRO CC[C@H]([NH2+]CCCCNc1ccccn1)c1ccccc1O ZINC000155601059 261104807 /nfs/dbraw/zinc/10/48/07/261104807.db2.gz BAKGDJQYUMJCGT-INIZCTEOSA-N 1 0 299.418 3.720 20 10 CHCDRO COc1cccc(C[N@H+](C)Cc2ccc(Cl)s2)c1O ZINC000162776243 261293836 /nfs/dbraw/zinc/29/38/36/261293836.db2.gz TVSBONJXZPMRQZ-UHFFFAOYSA-N 1 0 297.807 3.748 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1cccnc1)c1cc(Cl)ccc1O ZINC000184882978 262032386 /nfs/dbraw/zinc/03/23/86/262032386.db2.gz ZQOOGRWAMSNWJC-WDEREUQCSA-N 1 0 276.767 3.852 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)c2cc(C)ccc2O)cc1F ZINC000184927608 262034325 /nfs/dbraw/zinc/03/43/25/262034325.db2.gz MZHSQROQQFDHDK-LBPRGKRZSA-N 1 0 289.350 3.699 20 10 CHCDRO C[C@H]([NH2+]Cc1nccs1)c1cc2c(cc1O)CCCC2 ZINC000185087802 262041108 /nfs/dbraw/zinc/04/11/08/262041108.db2.gz YXRRFYDPSVQYDH-NSHDSACASA-N 1 0 288.416 3.578 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCC[C@H]2OCC[C@@H]21)c1cc(Cl)ccc1O ZINC000185771778 262069758 /nfs/dbraw/zinc/06/97/58/262069758.db2.gz AASAGWINFRAWIS-MWKWWEEBSA-N 1 0 295.810 3.654 20 10 CHCDRO COc1cc(C)cc(C[NH2+][C@@H](C)c2ccc(C)cc2O)c1 ZINC000186156333 262081971 /nfs/dbraw/zinc/08/19/71/262081971.db2.gz XUSCBDMWCUTQOS-AWEZNQCLSA-N 1 0 285.387 3.868 20 10 CHCDRO COc1cc(F)cc(C[NH2+][C@H](C)c2cc(C)ccc2O)c1 ZINC000186216503 262084316 /nfs/dbraw/zinc/08/43/16/262084316.db2.gz DWHUDZKMSQHOLU-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO Oc1ccccc1C[NH2+]C[C@@H](c1ccccc1)C(F)(F)F ZINC000186433577 262093496 /nfs/dbraw/zinc/09/34/96/262093496.db2.gz SARXEURNEXYNNY-AWEZNQCLSA-N 1 0 295.304 3.828 20 10 CHCDRO C[C@@H]([NH2+]CC[C@H]1CCCCO1)c1cc(Cl)ccc1O ZINC000186515157 262096352 /nfs/dbraw/zinc/09/63/52/262096352.db2.gz YCANDAKMZMTIHR-DGCLKSJQSA-N 1 0 283.799 3.655 20 10 CHCDRO C[C@@H](C[NH2+][C@@H](C)c1cc(Cl)ccc1O)c1nccs1 ZINC000186727259 262107151 /nfs/dbraw/zinc/10/71/51/262107151.db2.gz JJRMKFHIZBPUCG-UWVGGRQHSA-N 1 0 296.823 3.956 20 10 CHCDRO C[C@H](C[NH2+][C@H](C)c1cc(Cl)ccc1O)c1nccs1 ZINC000186727306 262107254 /nfs/dbraw/zinc/10/72/54/262107254.db2.gz JJRMKFHIZBPUCG-NXEZZACHSA-N 1 0 296.823 3.956 20 10 CHCDRO COCCCCC[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000119773862 262170768 /nfs/dbraw/zinc/17/07/68/262170768.db2.gz WNXZPUWTEWTSJH-UHFFFAOYSA-N 1 0 290.451 3.583 20 10 CHCDRO C[C@H](C[NH2+][C@H](C)c1ccc(N(C)C)cc1)c1nccs1 ZINC000186737996 262321686 /nfs/dbraw/zinc/32/16/86/262321686.db2.gz GJTPUJYIUBPCDB-CHWSQXEVSA-N 1 0 289.448 3.663 20 10 CHCDRO C[C@@H]([NH2+]CCc1cc(F)cc(F)c1)c1ccccc1O ZINC000060717653 262391808 /nfs/dbraw/zinc/39/18/08/262391808.db2.gz FPXPTKRWUAQYHG-LLVKDONJSA-N 1 0 277.314 3.564 20 10 CHCDRO COc1ccc2c(c1)[C@@H]([NH2+][C@H](C)c1ccccc1O)CCO2 ZINC000274413182 263023836 /nfs/dbraw/zinc/02/38/36/263023836.db2.gz SGQQHAUKBQBIMW-WBMJQRKESA-N 1 0 299.370 3.575 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]C[C@@H]2CCCC(F)(F)C2)c1 ZINC000282071838 263074063 /nfs/dbraw/zinc/07/40/63/263074063.db2.gz QPKJLBSNKWYQQH-GFCCVEGCSA-N 1 0 299.361 3.706 20 10 CHCDRO Cc1cc(O)c(C[NH+]2CCC(c3ccccn3)CC2)cc1C ZINC000371319906 267388258 /nfs/dbraw/zinc/38/82/58/267388258.db2.gz WPSRSZGBBXPBAB-UHFFFAOYSA-N 1 0 296.414 3.784 20 10 CHCDRO Cc1ccc2c(c1)[C@@H]([NH2+][C@@H](C)c1cc(C)ccc1O)CO2 ZINC000373265104 267658381 /nfs/dbraw/zinc/65/83/81/267658381.db2.gz IDFLYKXCPCBUSJ-BBRMVZONSA-N 1 0 283.371 3.793 20 10 CHCDRO C[C@@H](Cc1ccc(O)cc1)[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000185351919 327838234 /nfs/dbraw/zinc/83/82/34/327838234.db2.gz GXJSDVYARGAMMP-RYUDHWBXSA-N 1 0 289.350 3.519 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CCOC3(CCC3)C2)c(O)c1 ZINC000285134389 328247453 /nfs/dbraw/zinc/24/74/53/328247453.db2.gz LOFPBIHZDGZPAZ-LSDHHAIUSA-N 1 0 289.419 3.761 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cccs1 ZINC000037362890 326919189 /nfs/dbraw/zinc/91/91/89/326919189.db2.gz GKQAYSFTGURXQK-LLVKDONJSA-N 1 0 259.374 3.534 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C)[C@]1(C)CCCO1 ZINC000559901757 327270034 /nfs/dbraw/zinc/27/00/34/327270034.db2.gz FIAMFJRWTBPPMG-KSSFIOAISA-N 1 0 286.419 3.534 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]CC[C@H]2CCCOC2)c1O ZINC000527925532 330296478 /nfs/dbraw/zinc/29/64/78/330296478.db2.gz MLGQMLYJFKPDKF-CHWSQXEVSA-N 1 0 297.826 3.821 20 10 CHCDRO C[C@H]([NH2+]CC[C@@H]1CCCOC1)c1cc(Cl)ccc1O ZINC000527925213 330296535 /nfs/dbraw/zinc/29/65/35/330296535.db2.gz IJEZJULSIRSTED-RYUDHWBXSA-N 1 0 283.799 3.513 20 10 CHCDRO C[C@H]([NH2+][C@@H]1[C@H](C)O[C@@H](C)[C@H]1C)c1cc(Cl)ccc1O ZINC000528003898 330300395 /nfs/dbraw/zinc/30/03/95/330300395.db2.gz PBUSEUASCXHYLF-YQEZVOHVSA-N 1 0 283.799 3.508 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]CC[C@H]2CC=CCC2)c1 ZINC000527975901 330301930 /nfs/dbraw/zinc/30/19/30/330301930.db2.gz BKCMGXZARXWJII-KBPBESRZSA-N 1 0 275.392 3.798 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H]2CCCc3sccc32)c1O ZINC000154657287 330663243 /nfs/dbraw/zinc/66/32/43/330663243.db2.gz OADGJFRHKMPOSD-CQSZACIVSA-N 1 0 273.401 3.929 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1cccc(O)c1 ZINC000195287402 331166193 /nfs/dbraw/zinc/16/61/93/331166193.db2.gz BLNTZBJDKIHNBX-CQSZACIVSA-N 1 0 296.414 3.625 20 10 CHCDRO CCCC[C@H](COC)[NH2+]Cc1c(C)c2ccccc2n1C ZINC000475198956 331617594 /nfs/dbraw/zinc/61/75/94/331617594.db2.gz RYWOXUSTOLWAGU-OAHLLOKOSA-N 1 0 288.435 3.782 20 10 CHCDRO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1cc(F)ccc1O ZINC000226583152 333265344 /nfs/dbraw/zinc/26/53/44/333265344.db2.gz NECLQHIGIZYABD-LBPRGKRZSA-N 1 0 289.350 3.699 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)c1ccc2ccccc2c1O)c1cnn(C)c1 ZINC000273366853 334764858 /nfs/dbraw/zinc/76/48/58/334764858.db2.gz BRUFTYRQYWQBGO-CHWSQXEVSA-N 1 0 295.386 3.691 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1cccc([N+](=O)[O-])c1 ZINC000295992121 334904895 /nfs/dbraw/zinc/90/48/95/334904895.db2.gz NUFDGPWWIFAWPO-IAQYHMDHSA-N 1 0 298.342 3.639 20 10 CHCDRO CCCOc1ccc(C[NH2+]C2(c3ccccc3)CC2)c(O)c1 ZINC000264565251 520364514 /nfs/dbraw/zinc/36/45/14/520364514.db2.gz SVULMXALYVJEEA-UHFFFAOYSA-N 1 0 297.398 3.960 20 10 CHCDRO CCCOc1ccc(C[NH2+][C@@H](C)c2ccc(C)o2)c(O)c1 ZINC000101589497 520371505 /nfs/dbraw/zinc/37/15/05/520371505.db2.gz BLPNXGWYDGHPDW-ZDUSSCGKSA-N 1 0 289.375 3.933 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]Cc2ncccc2C)cc1 ZINC000071339573 520907855 /nfs/dbraw/zinc/90/78/55/520907855.db2.gz PAHPPZDPEYSRCN-UHFFFAOYSA-N 1 0 283.419 3.526 20 10 CHCDRO CCOC1CC(CC[NH2+][C@@H](C)c2ccc(C)c(C)c2O)C1 ZINC000276707481 521645426 /nfs/dbraw/zinc/64/54/26/521645426.db2.gz WKLBJIKQHPGWBJ-FHERZECASA-N 1 0 291.435 3.865 20 10 CHCDRO CCOC1CC(CC[NH2+][C@H](CC)c2ccc(C)cc2O)C1 ZINC000280138340 521646911 /nfs/dbraw/zinc/64/69/11/521646911.db2.gz POAJWGRVPSCGBT-VMBOVVBDSA-N 1 0 291.435 3.947 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCO[C@H](C(C)C)C1)c1ccc(C)cc1O ZINC000279977635 522721400 /nfs/dbraw/zinc/72/14/00/522721400.db2.gz DIQNVQYNVFHRMH-HFTRVMKXSA-N 1 0 291.435 3.945 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(OC)cc1)c1ccc(C)cc1O ZINC000280159016 522876596 /nfs/dbraw/zinc/87/65/96/522876596.db2.gz QQLRWPMSYYNFDQ-QGZVFWFLSA-N 1 0 285.387 3.950 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CCOC2(CCC2)C1)c1ccc(C)cc1O ZINC000280274250 522952422 /nfs/dbraw/zinc/95/24/22/522952422.db2.gz YATCFJANFWAJCD-GOEBONIOSA-N 1 0 289.419 3.843 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H](C)c2cc(F)ccc2O)c1 ZINC000094616895 524434523 /nfs/dbraw/zinc/43/45/23/524434523.db2.gz GCRBGSRUBVPTFJ-LBPRGKRZSA-N 1 0 259.324 3.691 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@@H]2CCCc3sccc32)c1 ZINC000061359915 524756575 /nfs/dbraw/zinc/75/65/75/524756575.db2.gz GRRVKUXIDVRHMM-CQSZACIVSA-N 1 0 289.400 3.630 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@H](c2ccccc2)C2CC2)c1 ZINC000037075042 524756864 /nfs/dbraw/zinc/75/68/64/524756864.db2.gz BORBHRIXPAEASO-GOSISDBHSA-N 1 0 283.371 3.642 20 10 CHCDRO COc1ccc([C@H](C)[NH2+][C@@H](C)c2cc(F)ccc2O)cc1 ZINC000094618474 525328652 /nfs/dbraw/zinc/32/86/52/525328652.db2.gz ZGOJSUWESJRWPD-RYUDHWBXSA-N 1 0 289.350 3.952 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H](C)c2ccc(F)cc2F)c1 ZINC000071407297 525351570 /nfs/dbraw/zinc/35/15/70/525351570.db2.gz AWYUSDULKURCNU-NSHDSACASA-N 1 0 277.314 3.830 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1COc2ccccc21)c1ccc(N(C)C)cc1 ZINC000289824635 525398921 /nfs/dbraw/zinc/39/89/21/525398921.db2.gz AIVDGJZDVZVQTE-GOEBONIOSA-N 1 0 296.414 3.579 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1cccs1 ZINC000050286240 525531552 /nfs/dbraw/zinc/53/15/52/525531552.db2.gz WRSIONHEWJFIME-CYBMUJFWSA-N 1 0 286.444 3.981 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)Cc1ccsc1)c1ccccc1O ZINC000049154517 525601398 /nfs/dbraw/zinc/60/13/98/525601398.db2.gz BKRMWDVAUHISKD-NWDGAFQWSA-N 1 0 261.390 3.736 20 10 CHCDRO COc1cccc(C[NH2+]Cc2cc(C)c(C)cc2C)c1O ZINC000265107111 526024208 /nfs/dbraw/zinc/02/42/08/526024208.db2.gz VKWDGHAVGZOMHB-UHFFFAOYSA-N 1 0 285.387 3.616 20 10 CHCDRO Oc1ccccc1C[NH2+]C1CCC(C(F)(F)F)CC1 ZINC000037092507 526372841 /nfs/dbraw/zinc/37/28/41/526372841.db2.gz JXKYUOIZZSBDFO-UHFFFAOYSA-N 1 0 273.298 3.603 20 10 CHCDRO Cc1n[nH]c(C)c1[C@@H]1CCCCC[N@@H+]1Cc1ccccc1O ZINC000290340323 526513496 /nfs/dbraw/zinc/51/34/96/526513496.db2.gz FJCDBQSYCBLQDD-INIZCTEOSA-N 1 0 299.418 3.849 20 10 CHCDRO CCOc1cccc(C[N@H+](C)C2CCC(C)CC2)c1O ZINC000133507849 1125464293 /nfs/dbraw/zinc/46/42/93/1125464293.db2.gz VSBBRZDQVDHNNU-UHFFFAOYSA-N 1 0 277.408 3.801 20 10 CHCDRO CC[N@H+](CC[C@H](C)SC)Cc1ccc(N(C)C)cc1 ZINC001208147661 1117826045 /nfs/dbraw/zinc/82/60/45/1117826045.db2.gz KGWKXERVHNMLAG-AWEZNQCLSA-N 1 0 280.481 3.716 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@](C)(O)CCC(C)C)c(O)c1 ZINC000185528100 1117839096 /nfs/dbraw/zinc/83/90/96/1117839096.db2.gz JCAVJRGASMXXER-RHSMWYFYSA-N 1 0 279.424 3.538 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]C2CCCCCC2)c1O ZINC000076274331 1118284131 /nfs/dbraw/zinc/28/41/31/1118284131.db2.gz DJNKFHQCLREAEC-UHFFFAOYSA-N 1 0 283.799 3.867 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C2CCC(C)(C)CC2)cc1 ZINC000075209332 1118280243 /nfs/dbraw/zinc/28/02/43/1118280243.db2.gz HHQLHOKIGZKWKC-UHFFFAOYSA-N 1 0 260.425 3.811 20 10 CHCDRO CC[C@H]1CCCC[C@@H]1[NH2+]Cc1cc(F)ccc1O ZINC000226584020 1119212818 /nfs/dbraw/zinc/21/28/18/1119212818.db2.gz DIAJHERTUMQGHO-FZMZJTMJSA-N 1 0 251.345 3.590 20 10 CHCDRO CCOc1ccccc1C[NH2+]Cc1c(O)cccc1Cl ZINC000113326419 1125494238 /nfs/dbraw/zinc/49/42/38/1125494238.db2.gz OQCUSBSAIOGNRV-UHFFFAOYSA-N 1 0 291.778 3.734 20 10 CHCDRO CCN(C)c1ccc(C[N@H+](C)[C@H](C)C2(C)CC2)cc1 ZINC000773766757 1121807155 /nfs/dbraw/zinc/80/71/55/1121807155.db2.gz VHPIIYCYRCELOW-CQSZACIVSA-N 1 0 260.425 3.763 20 10 CHCDRO CC[N@@H+](Cc1ccc(N(C)C)cc1)CC1CCCC1 ZINC001202190844 1123184724 /nfs/dbraw/zinc/18/47/24/1123184724.db2.gz UDGKNSYWPOUKQS-UHFFFAOYSA-N 1 0 260.425 3.765 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccns2)c(O)c1C ZINC000858575587 1123663980 /nfs/dbraw/zinc/66/39/80/1123663980.db2.gz BLRDDKNFWXWEAS-NEPJUHHUSA-N 1 0 276.405 3.877 20 10 CHCDRO CC[C@@H](C)[C@](C)(O)C[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000794809927 1123956618 /nfs/dbraw/zinc/95/66/18/1123956618.db2.gz RXHXCVUTDUTWRC-UKPHBRMFSA-N 1 0 279.424 3.538 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CC(C)(C)C(C)(F)F)c1O ZINC000866546619 1124081569 /nfs/dbraw/zinc/08/15/69/1124081569.db2.gz OULUHYWLQNYACV-JTQLQIEISA-N 1 0 287.350 3.733 20 10 CHCDRO Cc1cc(C[N@H+]2CC[C@H](C)C[C@H]2C)ccc1N(C)C ZINC001139672724 1131627751 /nfs/dbraw/zinc/62/77/51/1131627751.db2.gz CZMASXAHFVQDOW-DZGCQCFKSA-N 1 0 260.425 3.681 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)CCC(F)(F)F)c1 ZINC000845970868 1131673407 /nfs/dbraw/zinc/67/34/07/1131673407.db2.gz DUWRINQLHSTIFN-VHSXEESVSA-N 1 0 291.313 3.782 20 10 CHCDRO C[C@@H](COCC1CC1)[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000846203774 1131700064 /nfs/dbraw/zinc/70/00/64/1131700064.db2.gz BDCYZPKMHMFSAV-QWRGUYRKSA-N 1 0 283.799 3.511 20 10 CHCDRO COc1cccc(C[NH+]2CCC3(CCCCC3)CC2)c1O ZINC000133923860 1125509587 /nfs/dbraw/zinc/50/95/87/1125509587.db2.gz LRFIJBDKDOKJRP-UHFFFAOYSA-N 1 0 289.419 3.947 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCOC(C)(C)C1)c1cc(Cl)ccc1O ZINC000120213938 1125542259 /nfs/dbraw/zinc/54/22/59/1125542259.db2.gz HOGYPBKJNSSVOD-ZYHUDNBSSA-N 1 0 283.799 3.654 20 10 CHCDRO Oc1ccccc1C[NH2+]Cc1csc2ccccc12 ZINC000134227340 1125543810 /nfs/dbraw/zinc/54/38/10/1125543810.db2.gz ZLPWJDTVMZOELL-UHFFFAOYSA-N 1 0 269.369 3.897 20 10 CHCDRO Oc1ccccc1C[NH2+]Cc1cccc(Cl)c1Cl ZINC000134231024 1125545480 /nfs/dbraw/zinc/54/54/80/1125545480.db2.gz GDUPMKCWNGAJTC-UHFFFAOYSA-N 1 0 282.170 3.989 20 10 CHCDRO CC[C@@H]1CC[N@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000134978254 1125572125 /nfs/dbraw/zinc/57/21/25/1125572125.db2.gz ADWULJAFIUERPW-CYBMUJFWSA-N 1 0 255.361 3.777 20 10 CHCDRO C[C@@H]1CC[C@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC000135147727 1125579421 /nfs/dbraw/zinc/57/94/21/1125579421.db2.gz NPAIESKTJBLRKC-ZBFHGGJFSA-N 1 0 258.409 3.565 20 10 CHCDRO CC(C)[C@@H]1CC[N@H+](Cc2cccc(Br)c2[O-])C1 ZINC000135648979 1125594238 /nfs/dbraw/zinc/59/42/38/1125594238.db2.gz FIKNPDXGNGGTGX-LLVKDONJSA-N 1 0 298.224 3.633 20 10 CHCDRO CC[C@H]1CCCCC[N@@H+]1Cc1cc(OC)ccc1O ZINC000135749554 1125596591 /nfs/dbraw/zinc/59/65/91/1125596591.db2.gz ZHYNOVLRPHTAEQ-AWEZNQCLSA-N 1 0 263.381 3.555 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H]2CC[C@@H](C)[C@@H](C)C2)c1O ZINC000221374943 1125729062 /nfs/dbraw/zinc/72/90/62/1125729062.db2.gz UOPDHVSXPPRQFG-VNHYZAJKSA-N 1 0 277.408 3.705 20 10 CHCDRO Oc1c(C[N@@H+]2C[C@@H]3CCCC[C@@H]32)ccc2ccccc21 ZINC000826539025 1125755577 /nfs/dbraw/zinc/75/55/77/1125755577.db2.gz NLTWXYABVHDATK-YOEHRIQHSA-N 1 0 267.372 3.920 20 10 CHCDRO C[N@H+](Cc1cnc(C(C)(C)C)s1)Cc1ccccc1O ZINC000091974545 1125756480 /nfs/dbraw/zinc/75/64/80/1125756480.db2.gz BNOSLWIIINUPHV-UHFFFAOYSA-N 1 0 290.432 3.778 20 10 CHCDRO COC(C)(C)C[C@H](C)[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000121951865 1125780834 /nfs/dbraw/zinc/78/08/34/1125780834.db2.gz XWIXPBJHLMGHSE-UONOGXRCSA-N 1 0 278.440 3.607 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)C1CC1)c1cc2c(cc1O)CCCC2 ZINC000184892701 1129260935 /nfs/dbraw/zinc/26/09/35/1129260935.db2.gz LOIBZBJOPYUAPR-NWDGAFQWSA-N 1 0 259.393 3.720 20 10 CHCDRO C[C@H](Cc1ccsc1)[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000094617882 1129448299 /nfs/dbraw/zinc/44/82/99/1129448299.db2.gz CKBYQARLIPUVJS-MNOVXSKESA-N 1 0 279.380 3.875 20 10 CHCDRO COc1ccccc1[C@H](C)[NH2+]Cc1cccc(C)c1O ZINC000158064991 1126745652 /nfs/dbraw/zinc/74/56/52/1126745652.db2.gz JRONVOZKSCJWOI-ZDUSSCGKSA-N 1 0 271.360 3.560 20 10 CHCDRO CCC[N@H+](Cc1ccc(Cl)nc1)Cc1ccccc1O ZINC000174373975 1126769398 /nfs/dbraw/zinc/76/93/98/1126769398.db2.gz DGVXODJUIAESIH-UHFFFAOYSA-N 1 0 290.794 3.853 20 10 CHCDRO Cc1cnc(C(C)(C)[NH2+]Cc2ccc(N(C)C)cc2)s1 ZINC000175982464 1126788030 /nfs/dbraw/zinc/78/80/30/1126788030.db2.gz LDMNMNMLZRPCEA-UHFFFAOYSA-N 1 0 289.448 3.542 20 10 CHCDRO Cc1cccc(C[NH+]2CCC(OCCC(C)C)CC2)c1O ZINC000179783108 1126833977 /nfs/dbraw/zinc/83/39/77/1126833977.db2.gz FQOBTVUXNCKNFM-UHFFFAOYSA-N 1 0 291.435 3.728 20 10 CHCDRO Cc1cc(O)c(CNc2ccc(C(C)(C)[NH3+])cc2)cc1C ZINC000904470792 1126853718 /nfs/dbraw/zinc/85/37/18/1126853718.db2.gz QNNDVBZZFQDSLH-UHFFFAOYSA-N 1 0 284.403 3.815 20 10 CHCDRO C[C@@H]([NH2+][C@@H](c1ccccc1)[C@@H]1CCCO1)c1ccccc1O ZINC000183467307 1126887520 /nfs/dbraw/zinc/88/75/20/1126887520.db2.gz WAWHYULJGQOWFP-CCKFTAQKSA-N 1 0 297.398 3.963 20 10 CHCDRO COc1cc(C)ccc1C[NH2+][C@H](C)c1ccccc1O ZINC000183555821 1126888910 /nfs/dbraw/zinc/88/89/10/1126888910.db2.gz WGAPWPOBMIVFQF-CYBMUJFWSA-N 1 0 271.360 3.560 20 10 CHCDRO Cc1cc(NCc2ccc(N3CCCC3)cc2)cc[nH+]1 ZINC000185752375 1126902201 /nfs/dbraw/zinc/90/22/01/1126902201.db2.gz JKJPYFHALUBSBK-UHFFFAOYSA-N 1 0 267.376 3.602 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](CC)CC(C)(C)C)c1 ZINC000812794664 1130717676 /nfs/dbraw/zinc/71/76/76/1130717676.db2.gz NWTROLFAKUMXNZ-UHFFFAOYSA-N 1 0 265.397 3.659 20 10 CHCDRO CC(C)c1csc(C[NH2+][C@@H](C)c2cc(F)ccc2O)n1 ZINC000185808676 1126902765 /nfs/dbraw/zinc/90/27/65/1126902765.db2.gz CXNCHRJFYULUJQ-JTQLQIEISA-N 1 0 294.395 3.962 20 10 CHCDRO CSCc1cccc(C[NH2+]Cc2cc(C)ccc2O)c1 ZINC000189483229 1126932583 /nfs/dbraw/zinc/93/25/83/1126932583.db2.gz CTNZZXUBBLZHKB-UHFFFAOYSA-N 1 0 287.428 3.853 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H]2CCc3c2cccc3F)c1 ZINC000113329855 1127003401 /nfs/dbraw/zinc/00/34/01/1127003401.db2.gz QIGCBOBMAQOGBF-INIZCTEOSA-N 1 0 271.335 3.617 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(Cl)o2)c1 ZINC000698077357 1127038990 /nfs/dbraw/zinc/03/89/90/1127038990.db2.gz ZPEMQEQJLQUENK-JTQLQIEISA-N 1 0 265.740 3.798 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C2C[C@H](C)O[C@@H](C)C2)cc1 ZINC000245617730 1129214453 /nfs/dbraw/zinc/21/44/53/1129214453.db2.gz VVKPXSJVEABDOY-KKUMJFAQSA-N 1 0 290.451 3.749 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCOC2(CCC2)C1)c1ccc(N(C)C)cc1 ZINC000271565876 1127093135 /nfs/dbraw/zinc/09/31/35/1127093135.db2.gz XWUVBCYBIGFRPS-GDBMZVCRSA-N 1 0 288.435 3.505 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)CSC)c1ccc(N(C)C)cc1 ZINC000151002621 1127117384 /nfs/dbraw/zinc/11/73/84/1127117384.db2.gz FEZHVYWQFLTJBU-DOMZBBRYSA-N 1 0 266.454 3.545 20 10 CHCDRO C[C@H]([NH2+][C@@H]1C=CCC1)c1ccc2ccccc2c1O ZINC000698192233 1127185604 /nfs/dbraw/zinc/18/56/04/1127185604.db2.gz VETBCJWKJWAPNA-GXTWGEPZSA-N 1 0 253.345 3.915 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCCC23CC3)cc1Br ZINC001237676527 1131126319 /nfs/dbraw/zinc/12/63/19/1131126319.db2.gz KGRHAAZTPAXQIK-UHFFFAOYSA-N 1 0 296.208 3.592 20 10 CHCDRO CCCC1CC[NH+](Cc2cccc(OCC)c2O)CC1 ZINC000133772015 1127193838 /nfs/dbraw/zinc/19/38/38/1127193838.db2.gz VUBXYSWGJZUHQP-UHFFFAOYSA-N 1 0 277.408 3.803 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC=C(c3ccncc3)C2)cc1C ZINC000285235405 1127219816 /nfs/dbraw/zinc/21/98/16/1127219816.db2.gz VVOOHBXUUQYZMW-UHFFFAOYSA-N 1 0 294.398 3.693 20 10 CHCDRO CCC[N@H+](Cc1ccccc1)Cc1cc2c(cc1O)OCO2 ZINC000057534732 1127263140 /nfs/dbraw/zinc/26/31/40/1127263140.db2.gz AHMPKJJJUNBPLS-UHFFFAOYSA-N 1 0 299.370 3.533 20 10 CHCDRO COCC(C)(C)CCC[NH2+][C@H](C)c1ccc(C)cc1O ZINC000287033162 1127283562 /nfs/dbraw/zinc/28/35/62/1127283562.db2.gz LYDYAXHWDZCLJY-CQSZACIVSA-N 1 0 279.424 3.804 20 10 CHCDRO COCC(C)(C)CCC[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000287217972 1127297051 /nfs/dbraw/zinc/29/70/51/1127297051.db2.gz XIGBQXAQWIDCHA-LBPRGKRZSA-N 1 0 283.387 3.635 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)[C@H](C)OC)c1cccc(Cl)c1[O-] ZINC000287540936 1127309713 /nfs/dbraw/zinc/30/97/13/1127309713.db2.gz FBLVRJXZFDASCV-KWBADKCTSA-N 1 0 271.788 3.510 20 10 CHCDRO COC1CCC([NH2+]Cc2c(C)c3ccccc3n2C)CC1 ZINC000355140100 1127320768 /nfs/dbraw/zinc/32/07/68/1127320768.db2.gz XIEZKHDSTBIQRW-UHFFFAOYSA-N 1 0 286.419 3.534 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CC[C@@H](C)C1)c1cc(Br)ccc1O ZINC000783311245 1127363478 /nfs/dbraw/zinc/36/34/78/1127363478.db2.gz UDPFBRNQHMNWRM-JFGNBEQYSA-N 1 0 298.224 3.994 20 10 CHCDRO C[C@@H]1CC[C@H]([NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)C1 ZINC000783311316 1127363521 /nfs/dbraw/zinc/36/35/21/1127363521.db2.gz VHSHPJXETVHWJH-MPPDQPJWSA-N 1 0 263.356 3.858 20 10 CHCDRO C[C@@H]1CC[C@H]([NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)C1 ZINC000783311314 1127363873 /nfs/dbraw/zinc/36/38/73/1127363873.db2.gz VHSHPJXETVHWJH-HNCHTBHHSA-N 1 0 263.356 3.858 20 10 CHCDRO C[C@H]([NH2+]Cc1cc(F)ccc1O)c1c(F)cccc1F ZINC000226585470 1127412332 /nfs/dbraw/zinc/41/23/32/1127412332.db2.gz CEPVZJUFSAEHQS-VIFPVBQESA-N 1 0 281.277 3.660 20 10 CHCDRO CC[C@H]1CCC[C@@H]([NH2+]Cc2cc(F)ccc2O)C1 ZINC000226611034 1127412429 /nfs/dbraw/zinc/41/24/29/1127412429.db2.gz WBYQVJGSCGGRNO-SMDDNHRTSA-N 1 0 251.345 3.590 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc(F)ccc1O)c1ccccc1OC ZINC000226584458 1127412497 /nfs/dbraw/zinc/41/24/97/1127412497.db2.gz SLQJJROKMVTWJV-OAHLLOKOSA-N 1 0 289.350 3.781 20 10 CHCDRO Oc1ccccc1C[NH2+]Cc1cc(F)cc(C(F)(F)F)c1 ZINC000158091717 1127437447 /nfs/dbraw/zinc/43/74/47/1127437447.db2.gz BQKWRKCQVJGZMH-UHFFFAOYSA-N 1 0 299.267 3.840 20 10 CHCDRO Cc1c[nH+]ccc1N1CC=C(c2c[nH]c3ncccc23)CC1 ZINC000359445588 1127463811 /nfs/dbraw/zinc/46/38/11/1127463811.db2.gz WTLMPKJTHKSUQM-UHFFFAOYSA-N 1 0 290.370 3.560 20 10 CHCDRO CC[C@H]([NH2+]CCC1(COC)CCC1)c1ccccc1O ZINC000293567970 1127506278 /nfs/dbraw/zinc/50/62/78/1127506278.db2.gz BBJRXTVNCWLAHE-HNNXBMFYSA-N 1 0 277.408 3.640 20 10 CHCDRO Cc1ccsc1C[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000295954954 1129219791 /nfs/dbraw/zinc/21/97/91/1129219791.db2.gz LTMYWYPVJUXYHH-GFCCVEGCSA-N 1 0 259.374 3.539 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CC2CCSCC2)c(O)c1 ZINC000293792330 1127520547 /nfs/dbraw/zinc/52/05/47/1127520547.db2.gz QQZBDIORQUSMLL-ZDUSSCGKSA-N 1 0 279.449 3.803 20 10 CHCDRO Nc1ccc(C[NH2+]C2(c3cccc(Cl)c3)CC2)cc1 ZINC001120371520 1127522273 /nfs/dbraw/zinc/52/22/73/1127522273.db2.gz ZXCSWGQJHFTCSI-UHFFFAOYSA-N 1 0 272.779 3.701 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CC[C@@H]3CCC[C@@H]3C2)cc1Cl ZINC001231868394 1127544564 /nfs/dbraw/zinc/54/45/64/1127544564.db2.gz UTBHXSWHKGMAAS-QWHCGFSZSA-N 1 0 279.811 3.976 20 10 CHCDRO C[N@@H+](Cc1cc(-c2ccccc2)ccc1O)C[C@H]1CCCO1 ZINC000761229653 1127553304 /nfs/dbraw/zinc/55/33/04/1127553304.db2.gz RWIHNFJHSKQPNU-GOSISDBHSA-N 1 0 297.398 3.670 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CCC[C@@H]3CCC[C@H]32)c1O ZINC000228631165 1127576321 /nfs/dbraw/zinc/57/63/21/1127576321.db2.gz SKMCTMWNNIIWDB-SMDDNHRTSA-N 1 0 295.810 3.819 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]C[C@H](C)C(C)(C)C)c1O ZINC000228674526 1127584038 /nfs/dbraw/zinc/58/40/38/1127584038.db2.gz BGHTZJXLOXYAIF-JTQLQIEISA-N 1 0 285.815 3.826 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]C[C@@H](C)C(C)(C)C)c1O ZINC000228674516 1127584136 /nfs/dbraw/zinc/58/41/36/1127584136.db2.gz BGHTZJXLOXYAIF-SNVBAGLBSA-N 1 0 285.815 3.826 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CCc2ccncc2C)c(O)c1 ZINC000294698886 1127593289 /nfs/dbraw/zinc/59/32/89/1127593289.db2.gz IXZFDGJNLBTVEF-OAHLLOKOSA-N 1 0 284.403 3.606 20 10 CHCDRO CC(C)(CO)CC[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000294879137 1127606385 /nfs/dbraw/zinc/60/63/85/1127606385.db2.gz VLFSDTDYQGOFNE-UHFFFAOYSA-N 1 0 299.414 3.557 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1OCCc2ccccc21)c1ccccc1O ZINC000362488601 1127639385 /nfs/dbraw/zinc/63/93/85/1127639385.db2.gz RVMJOJRSDLWNFO-MJGOQNOKSA-N 1 0 297.398 3.747 20 10 CHCDRO CCn1cc([C@H](C)[NH2+][C@@H](C)c2cc(Cl)ccc2O)cn1 ZINC000295965858 1127658654 /nfs/dbraw/zinc/65/86/54/1127658654.db2.gz NIKXYLOWEJPUOC-QWRGUYRKSA-N 1 0 293.798 3.674 20 10 CHCDRO CCCOc1ccc(C[NH2+][C@H]2CCc3cccc(O)c32)cc1 ZINC000296179932 1127664354 /nfs/dbraw/zinc/66/43/54/1127664354.db2.gz YCKKOGXNESKNFQ-KRWDZBQOSA-N 1 0 297.398 3.958 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccnc(C(F)(F)F)c1)c1ccccc1O ZINC000296555996 1127675945 /nfs/dbraw/zinc/67/59/45/1127675945.db2.gz RUOKIMDVOOORFL-SNVBAGLBSA-N 1 0 296.292 3.657 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]C1(c3cccc(F)c3)CC1)CC2 ZINC000296646054 1127679974 /nfs/dbraw/zinc/67/99/74/1127679974.db2.gz DAQKWSHKTXIYGY-OAHLLOKOSA-N 1 0 283.346 3.798 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)c2ccsc2)cc1C ZINC000061361603 1127685419 /nfs/dbraw/zinc/68/54/19/1127685419.db2.gz BSAICHHQRZUCMI-LBPRGKRZSA-N 1 0 261.390 3.916 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]C[C@H]1CCOc3ccccc31)CC2 ZINC000297551410 1127699255 /nfs/dbraw/zinc/69/92/55/1127699255.db2.gz FRGQRECSVJITRT-GDBMZVCRSA-N 1 0 295.382 3.535 20 10 CHCDRO CC(C)[C@H](C[NH2+][C@@H]1CCc2cccc(O)c21)c1cccnc1 ZINC000297619699 1127701611 /nfs/dbraw/zinc/70/16/11/1127701611.db2.gz IWGOPEIVBAMFMI-DLBZAZTESA-N 1 0 296.414 3.804 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]Cc1c(F)cccc1Cl)CC2 ZINC000297909187 1127711403 /nfs/dbraw/zinc/71/14/03/1127711403.db2.gz WNYJMUNZTMJJBH-AWEZNQCLSA-N 1 0 291.753 3.962 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H]2COc3c2cccc3Cl)c1 ZINC000365943898 1127741541 /nfs/dbraw/zinc/74/15/41/1127741541.db2.gz AVBCPBJBACDLEG-AWEZNQCLSA-N 1 0 289.762 3.577 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]C[C@H]2CC[C@@H](C)C2)c1O ZINC000230407283 1127752062 /nfs/dbraw/zinc/75/20/62/1127752062.db2.gz FTIURANCXNKSLK-MNOVXSKESA-N 1 0 283.799 3.580 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)c1ccc2ccccc2c1O)c1cn[nH]c1 ZINC000230669588 1127771143 /nfs/dbraw/zinc/77/11/43/1127771143.db2.gz DCYVUZTYZJFNJR-VXGBXAGGSA-N 1 0 281.359 3.680 20 10 CHCDRO CS[C@@H]1CC[C@H]([NH2+][C@@H](C)c2cc(C)ccc2O)C1 ZINC000230664430 1127771850 /nfs/dbraw/zinc/77/18/50/1127771850.db2.gz JYNMNKKZWDELET-RWMBFGLXSA-N 1 0 265.422 3.635 20 10 CHCDRO CS[C@@H]1CCC[C@@H]([NH2+][C@@H](C)c2cc(F)ccc2O)C1 ZINC000230662612 1127772017 /nfs/dbraw/zinc/77/20/17/1127772017.db2.gz RWLOIORZDBHVMN-CYZMBNFOSA-N 1 0 283.412 3.856 20 10 CHCDRO Cc1ccc2c(c1)[C@@H]([NH2+][C@@H](C)c1ccc(C)cc1O)CO2 ZINC000373263965 1127831185 /nfs/dbraw/zinc/83/11/85/1127831185.db2.gz ALZQDANLCCULLR-BBRMVZONSA-N 1 0 283.371 3.793 20 10 CHCDRO C[C@@H](CCCO)C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000296577963 1129222816 /nfs/dbraw/zinc/22/28/16/1129222816.db2.gz UBTPESOIDBLCAL-KBPBESRZSA-N 1 0 287.403 3.605 20 10 CHCDRO CSCC1CCC([NH2+][C@@H]2CCc3cccc(O)c32)CC1 ZINC000296475482 1129223007 /nfs/dbraw/zinc/22/30/07/1129223007.db2.gz NYTDEGUHLLMVNK-PESDSKBTSA-N 1 0 291.460 3.891 20 10 CHCDRO Cc1cccc2c(CC[NH2+]Cc3ccccc3O)c[nH]c21 ZINC000174448239 1127893536 /nfs/dbraw/zinc/89/35/36/1127893536.db2.gz RKTOVWMXJVZLCS-UHFFFAOYSA-N 1 0 280.371 3.514 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc(C)cc(Cl)n1)c1ccccc1O ZINC000800492512 1127899804 /nfs/dbraw/zinc/89/98/04/1127899804.db2.gz JYCABQOCXLBIQD-CQSZACIVSA-N 1 0 290.794 3.990 20 10 CHCDRO CCC1(C[NH2+]Cc2cc(Cl)cc(OC)c2O)CCC1 ZINC000230935170 1127988203 /nfs/dbraw/zinc/98/82/03/1127988203.db2.gz LHYLSHQZRPPBMK-UHFFFAOYSA-N 1 0 283.799 3.724 20 10 CHCDRO CC[C@@H](c1cccc(Cl)c1[O-])[NH+]1CCC([NH3+])(CC)CC1 ZINC000925759805 1128141210 /nfs/dbraw/zinc/14/12/10/1128141210.db2.gz MFKDWFFGQOAYIE-AWEZNQCLSA-N 1 0 296.842 3.700 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccccc1)c1ccc(N(C)C)cc1 ZINC000152956647 1128158536 /nfs/dbraw/zinc/15/85/36/1128158536.db2.gz YQIYZYLTUMWHFA-SFHVURJKSA-N 1 0 268.404 3.994 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H]2CCC[C@@H]2CCCF)cc1 ZINC000800965093 1128160537 /nfs/dbraw/zinc/16/05/37/1128160537.db2.gz CHLIURNXFYKROB-WBVHZDCISA-N 1 0 278.415 3.761 20 10 CHCDRO C[C@H](CCc1ccc(O)cc1)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000074336351 1128164677 /nfs/dbraw/zinc/16/46/77/1128164677.db2.gz RZNBZZUODADIMC-OAHLLOKOSA-N 1 0 298.430 3.569 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)Cc2cccc(F)c2)cc1C ZINC001168465525 1128173976 /nfs/dbraw/zinc/17/39/76/1128173976.db2.gz SPWJTHAVDYVIKS-AWEZNQCLSA-N 1 0 287.378 3.864 20 10 CHCDRO C[C@@H]1CCC[C@H]([N@H+](C)Cc2cc3c(cc2O)CCC3)C1 ZINC000914785175 1128244489 /nfs/dbraw/zinc/24/44/89/1128244489.db2.gz RIUPUGBZQJNYNI-DYVFJYSZSA-N 1 0 273.420 3.891 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@]23CCC[C@H]2OCC3)c(O)c1 ZINC000926915064 1128202212 /nfs/dbraw/zinc/20/22/12/1128202212.db2.gz DMQHDCZNKMPHFU-YXJHDRRASA-N 1 0 289.419 3.619 20 10 CHCDRO Cc1cnc(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)c(C)c1 ZINC000926960346 1128205746 /nfs/dbraw/zinc/20/57/46/1128205746.db2.gz OJYWYTDCLAKYKI-OAHLLOKOSA-N 1 0 284.403 3.872 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@H+]2CC3(CCC3)C[C@H]2C)c1 ZINC000762140264 1128273360 /nfs/dbraw/zinc/27/33/60/1128273360.db2.gz TZBPPGAWULOVNV-CQSZACIVSA-N 1 0 259.393 3.774 20 10 CHCDRO COc1cc(C)cc(C[NH+]2CCC3(CCCC3)CC2)c1O ZINC000754742157 1128300166 /nfs/dbraw/zinc/30/01/66/1128300166.db2.gz QTMNTOGQIMPVOP-UHFFFAOYSA-N 1 0 289.419 3.865 20 10 CHCDRO Cc1cc(C[NH+]2C[C@@H](C)O[C@H](C)C2)c(O)c(C(C)(C)C)c1 ZINC000915789552 1128339869 /nfs/dbraw/zinc/33/98/69/1128339869.db2.gz QQDCWDIWULHTBT-ZIAGYGMSSA-N 1 0 291.435 3.607 20 10 CHCDRO Cc1ccccc1C[N@@H+](C)Cc1cc2c(cc1O)CCC2 ZINC000915810974 1128340572 /nfs/dbraw/zinc/34/05/72/1128340572.db2.gz LZHNTXDMOVBXQZ-UHFFFAOYSA-N 1 0 281.399 3.821 20 10 CHCDRO COc1ccc(C[NH2+]CCO[C@@H]2CCCC[C@H]2C)cc1C ZINC000916838469 1128457226 /nfs/dbraw/zinc/45/72/26/1128457226.db2.gz CVDGCXPSCNOZPH-RDTXWAMCSA-N 1 0 291.435 3.689 20 10 CHCDRO CCC[C@@H](C)CC[C@@H](C)[NH2+]Cc1ccc(O)c(O)c1 ZINC001257472343 1128473349 /nfs/dbraw/zinc/47/33/49/1128473349.db2.gz SJCDMSAIWRXJLD-CHWSQXEVSA-N 1 0 265.397 3.792 20 10 CHCDRO c1csc([C@H]([NH2+]Cc2ccc3c(c2)CCO3)C2CC2)c1 ZINC000917394108 1128497079 /nfs/dbraw/zinc/49/70/79/1128497079.db2.gz QJQUXXLLPRENDN-QGZVFWFLSA-N 1 0 285.412 3.924 20 10 CHCDRO CC[C@@H](C[NH2+]Cc1ccc2c(c1)CCO2)c1ccccc1 ZINC000917392618 1128497158 /nfs/dbraw/zinc/49/71/58/1128497158.db2.gz DXBNQKMUCGMUBL-INIZCTEOSA-N 1 0 281.399 3.905 20 10 CHCDRO Cc1cccc(C[N@@H+](C)Cc2cc(C)c(C)cc2O)c1 ZINC000917483012 1128501268 /nfs/dbraw/zinc/50/12/68/1128501268.db2.gz MAOOOJZPBLHINM-UHFFFAOYSA-N 1 0 269.388 3.949 20 10 CHCDRO CCCCOCC[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000917972870 1128528790 /nfs/dbraw/zinc/52/87/90/1128528790.db2.gz GHHCXGAUNOTCRP-UHFFFAOYSA-N 1 0 290.451 3.534 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)C[C@H]2CCCCO2)cc1C(C)C ZINC000918735202 1128569677 /nfs/dbraw/zinc/56/96/77/1128569677.db2.gz HTMDGJXCRCADFD-MRXNPFEDSA-N 1 0 291.435 3.825 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCCC[C@@H]2C)c1 ZINC000042856715 1128587438 /nfs/dbraw/zinc/58/74/38/1128587438.db2.gz STZNTCSHOHHFMQ-MELADBBJSA-N 1 0 277.408 3.878 20 10 CHCDRO CCO[C@@H](CC[NH2+][C@@H](CC)c1ccccc1O)C(C)C ZINC000156164499 1128628846 /nfs/dbraw/zinc/62/88/46/1128628846.db2.gz MOOSWOKYJLMMEE-RDJZCZTQSA-N 1 0 279.424 3.884 20 10 CHCDRO COCc1ccc(C[N@H+](C)Cc2ccc(N(C)C)cc2)cc1 ZINC000155176480 1128661338 /nfs/dbraw/zinc/66/13/38/1128661338.db2.gz ZRKMQGSINHTTRE-UHFFFAOYSA-N 1 0 298.430 3.531 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCC[C@H]1Cc1ccc(F)cc1 ZINC000778998137 1128675515 /nfs/dbraw/zinc/67/55/15/1128675515.db2.gz IPWXLVCDWLCLNC-KRWDZBQOSA-N 1 0 285.362 3.738 20 10 CHCDRO Oc1ccc(F)cc1C[N@H+](Cc1ccccc1)C1CC1 ZINC000778996062 1128675529 /nfs/dbraw/zinc/67/55/29/1128675529.db2.gz LJWNOXWGHDRCFD-UHFFFAOYSA-N 1 0 271.335 3.696 20 10 CHCDRO CC1(C)C[N@H+](Cc2ccccc2O)Cc2ccccc21 ZINC000779020691 1128683217 /nfs/dbraw/zinc/68/32/17/1128683217.db2.gz OJSUCBWLXGDKEH-UHFFFAOYSA-N 1 0 267.372 3.686 20 10 CHCDRO C[C@H]1C[C@H](c2ccccc2)C[N@@H+]1Cc1cc(F)ccc1O ZINC000779020261 1128683567 /nfs/dbraw/zinc/68/35/67/1128683567.db2.gz LBGSTMVPFPJIGN-ZFWWWQNUSA-N 1 0 285.362 3.909 20 10 CHCDRO COc1ccc(C[NH2+]C2[C@@H](C)CCC[C@@H]2C)cc1C ZINC000921067179 1128699375 /nfs/dbraw/zinc/69/93/75/1128699375.db2.gz NPSONTRMSNYGEC-STQMWFEESA-N 1 0 261.409 3.918 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCCSC1)c1ccc(N(C)C)cc1 ZINC000159583651 1128711836 /nfs/dbraw/zinc/71/18/36/1128711836.db2.gz FVRJYHVMFWRVDB-HOCLYGCPSA-N 1 0 278.465 3.689 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CCCSC1)c1ccc(N(C)C)cc1 ZINC000159583550 1128712467 /nfs/dbraw/zinc/71/24/67/1128712467.db2.gz FVRJYHVMFWRVDB-GDBMZVCRSA-N 1 0 278.465 3.689 20 10 CHCDRO CC(C)C[C@H](C)C[C@@H](C)[NH2+]CCc1ccc(O)c(O)c1 ZINC001258056550 1128714339 /nfs/dbraw/zinc/71/43/39/1128714339.db2.gz QBDFUECEUALOFH-UONOGXRCSA-N 1 0 279.424 3.691 20 10 CHCDRO C[C@H](Cc1ccsc1)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000048557316 1128717041 /nfs/dbraw/zinc/71/70/41/1128717041.db2.gz VRCWIUMNVRHHNH-CYBMUJFWSA-N 1 0 274.433 3.535 20 10 CHCDRO COCC1=CC[N@H+](Cc2cc(C(C)C)c(C)cc2O)CC1 ZINC000185036213 1117757483 /nfs/dbraw/zinc/75/74/83/1117757483.db2.gz GUCYEKUIHRLENE-UHFFFAOYSA-N 1 0 289.419 3.603 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)c2cc(F)ccc2O)c(C)c1 ZINC000185066833 1117759050 /nfs/dbraw/zinc/75/90/50/1117759050.db2.gz IAAFPWXNFMUXMS-ZDUSSCGKSA-N 1 0 273.351 3.999 20 10 CHCDRO COc1ccc(CCC[NH2+][C@H](C)c2cc(C)ccc2O)cc1 ZINC000185094962 1117761724 /nfs/dbraw/zinc/76/17/24/1117761724.db2.gz NXYNNZVDKSZIDO-OAHLLOKOSA-N 1 0 299.414 3.993 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCOc2cccc(F)c2)c(O)c1 ZINC000185106326 1117764769 /nfs/dbraw/zinc/76/47/69/1117764769.db2.gz CRSSOUJLAZGTFP-ZDUSSCGKSA-N 1 0 289.350 3.569 20 10 CHCDRO CCCC(O)(CCC)C[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000185500805 1117830003 /nfs/dbraw/zinc/83/00/03/1117830003.db2.gz APPANDUSHDGXJO-AWEZNQCLSA-N 1 0 279.424 3.683 20 10 CHCDRO Cc1noc(C)c1[C@H](C)[NH2+]Cc1cc(Cl)ccc1O ZINC000073007033 1117863140 /nfs/dbraw/zinc/86/31/40/1117863140.db2.gz RPEBVAQKNCNUIU-QMMMGPOBSA-N 1 0 280.755 3.501 20 10 CHCDRO Cc1nc(CC[NH2+][C@@H](C)c2cc(C)ccc2O)sc1C ZINC000185797372 1117897329 /nfs/dbraw/zinc/89/73/29/1117897329.db2.gz GKIFOKYEBCFIJF-LBPRGKRZSA-N 1 0 290.432 3.667 20 10 CHCDRO C[C@@H]1CCCCC[N@@H+]1Cc1c(O)cccc1Cl ZINC000211443467 1118047428 /nfs/dbraw/zinc/04/74/28/1118047428.db2.gz UBYWENFTWGWBIV-LLVKDONJSA-N 1 0 253.773 3.810 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2CCC[C@@H]2c2cccn2C)cc1C ZINC000179706159 1128755190 /nfs/dbraw/zinc/75/51/90/1128755190.db2.gz MCMUNVKZXWWYQB-QGZVFWFLSA-N 1 0 284.403 3.685 20 10 CHCDRO CCC[N@@H+](Cc1cc(Cl)ccc1O)C[C@@H]1CCCCO1 ZINC000769339527 1118099703 /nfs/dbraw/zinc/09/97/03/1118099703.db2.gz RDBWBKXKZBPKIS-HNNXBMFYSA-N 1 0 297.826 3.827 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1C[C@@H]1C)c1ccc(N2CCCCC2)cc1 ZINC000765336881 1118144828 /nfs/dbraw/zinc/14/48/28/1118144828.db2.gz LIUZHOPNLNGLOI-YQQAZPJKSA-N 1 0 272.436 3.984 20 10 CHCDRO C[C@@H]([NH2+]CCC(C)(C)C)c1ccc(N2CCOCC2)cc1 ZINC000765335721 1118144842 /nfs/dbraw/zinc/14/48/42/1118144842.db2.gz XAAIJHKZCBWSQV-OAHLLOKOSA-N 1 0 290.451 3.610 20 10 CHCDRO CC(C)CC1([NH2+]Cc2ccc(Br)cc2O)CC1 ZINC000706127783 1118151623 /nfs/dbraw/zinc/15/16/23/1118151623.db2.gz KXCYYNBSGZGZAR-UHFFFAOYSA-N 1 0 298.224 3.823 20 10 CHCDRO CCCCOCC[NH2+][C@H](C)c1ccc(N(C)CC)cc1 ZINC000765454209 1118153119 /nfs/dbraw/zinc/15/31/19/1118153119.db2.gz BXSYGAMTSJMIRW-OAHLLOKOSA-N 1 0 278.440 3.610 20 10 CHCDRO CC[C@H]([NH2+]CCC1(COC)CC1)c1ccc(N(C)C)cc1 ZINC000842895335 1118158951 /nfs/dbraw/zinc/15/89/51/1118158951.db2.gz WATZYPZCHFZAGW-KRWDZBQOSA-N 1 0 290.451 3.610 20 10 CHCDRO C[C@H](CSC(C)(C)C)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000765608814 1118182112 /nfs/dbraw/zinc/18/21/12/1118182112.db2.gz LNNCNROTZSVRJL-GFCCVEGCSA-N 1 0 279.449 3.631 20 10 CHCDRO CCc1ccc([C@H](C)[NH2+]Cc2ccc3c(c2)CCO3)o1 ZINC000765610641 1118182362 /nfs/dbraw/zinc/18/23/62/1118182362.db2.gz WNGJWKQAXQTXSA-LBPRGKRZSA-N 1 0 271.360 3.628 20 10 CHCDRO CC[C@@H]([NH2+]CCN(CC)C(C)C)c1ccc(N(C)C)cc1 ZINC000765626674 1118184715 /nfs/dbraw/zinc/18/47/15/1118184715.db2.gz ALFXXNGAYARNFB-GOSISDBHSA-N 1 0 291.483 3.524 20 10 CHCDRO CC(C)=CC[NH2+][C@H](C)c1ccc(Br)cc1O ZINC000188444482 1128762150 /nfs/dbraw/zinc/76/21/50/1128762150.db2.gz OFVZNOQDTYFSLJ-SNVBAGLBSA-N 1 0 284.197 3.772 20 10 CHCDRO Cc1ccccc1OCCC[NH2+][C@@H](C)c1ccccc1O ZINC000179874722 1128763887 /nfs/dbraw/zinc/76/38/87/1128763887.db2.gz HSPAFHYTBDKVCG-HNNXBMFYSA-N 1 0 285.387 3.820 20 10 CHCDRO C[C@H]([NH2+]CCO[C@@H]1CCCC[C@H]1C)c1ccccc1O ZINC000179899065 1128764187 /nfs/dbraw/zinc/76/41/87/1128764187.db2.gz NOAFLZSUMYVRFM-JKIFEVAISA-N 1 0 277.408 3.638 20 10 CHCDRO CC[N@H+](Cc1cc(F)ccc1O)[C@H](C)c1ccc(C#N)cc1 ZINC000179937339 1128766924 /nfs/dbraw/zinc/76/69/24/1128766924.db2.gz MAJFWUUSHKCKJV-CYBMUJFWSA-N 1 0 298.361 3.986 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCOc2ccccc21)c1ccccc1O ZINC000186184053 1118288574 /nfs/dbraw/zinc/28/85/74/1118288574.db2.gz KNHPEAHHUPSMFG-PBHICJAKSA-N 1 0 297.398 3.999 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1O)c1c(C)noc1C ZINC000186187598 1118291541 /nfs/dbraw/zinc/29/15/41/1118291541.db2.gz NTLVJJDHVCFSHH-LKFCYVNXSA-N 1 0 292.354 3.938 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H]2CSc3ccccc32)cc1 ZINC000083748777 1118359620 /nfs/dbraw/zinc/35/96/20/1118359620.db2.gz SKOBPGMNTAZTCC-INIZCTEOSA-N 1 0 284.428 3.689 20 10 CHCDRO CC[C@H](C)C[N@H+](CC)Cc1c(C)cc(OC)cc1O ZINC001663672568 1118521590 /nfs/dbraw/zinc/52/15/90/1118521590.db2.gz SYKMXEXBGFPZBV-LBPRGKRZSA-N 1 0 265.397 3.577 20 10 CHCDRO Oc1ccccc1C[NH2+]Cc1sccc1Br ZINC000082432890 1118563790 /nfs/dbraw/zinc/56/37/90/1118563790.db2.gz WIXUSLIFVKIXIU-UHFFFAOYSA-N 1 0 298.205 3.506 20 10 CHCDRO CCOc1cccc(C[N@H+]2[C@H](C)CCC[C@@H]2C)c1O ZINC000093102888 1118587936 /nfs/dbraw/zinc/58/79/36/1118587936.db2.gz SZCXIMFBQVAAOW-BETUJISGSA-N 1 0 263.381 3.554 20 10 CHCDRO CC[C@H](C)[C@H](C[NH2+][C@@H](C)c1ccc(C)c(C)c1O)OC ZINC000834856012 1118586636 /nfs/dbraw/zinc/58/66/36/1118586636.db2.gz KDWVZWSNDBWKDN-PJODQICGSA-N 1 0 279.424 3.721 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)[C@@H](OC)C1CC1)c1cc(Cl)ccc1O ZINC000834901877 1118621360 /nfs/dbraw/zinc/62/13/60/1118621360.db2.gz AGKXPCDEXUYZRW-JMPLFQLZSA-N 1 0 297.826 3.900 20 10 CHCDRO C[C@@H]1CC[C@@H](C)[N@H+](Cc2c(O)cccc2Br)C1 ZINC000707146233 1118648432 /nfs/dbraw/zinc/64/84/32/1118648432.db2.gz KLNFQHYYTWAKHP-GHMZBOCLSA-N 1 0 298.224 3.775 20 10 CHCDRO COc1cc(C)cc(C[N@@H+]2C[C@H](C)[C@@H]3CCCC[C@@H]32)c1O ZINC000782275827 1118734401 /nfs/dbraw/zinc/73/44/01/1118734401.db2.gz IUEHUMKOSNNATG-BPUTZDHNSA-N 1 0 289.419 3.720 20 10 CHCDRO CC(C)[C@H]1CCC[N@@H+]1Cc1ccc(Cl)cc1O ZINC001140464594 1118736397 /nfs/dbraw/zinc/73/63/97/1118736397.db2.gz WNUUJYMXRANEAS-CYBMUJFWSA-N 1 0 253.773 3.666 20 10 CHCDRO C[C@@H]1C[C@@H](C)C[NH+](Cc2ccc(Cl)cc2O)C1 ZINC001140465217 1118739626 /nfs/dbraw/zinc/73/96/26/1118739626.db2.gz IOKNLQFAHVTCOC-GHMZBOCLSA-N 1 0 253.773 3.524 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]C/C=C\c2ccccc2)c1 ZINC000588449439 1118791474 /nfs/dbraw/zinc/79/14/74/1118791474.db2.gz IXFYSMKRBGFGGU-PIZKADEWSA-N 1 0 283.371 3.765 20 10 CHCDRO CCC[N@H+](Cc1cnc(F)c(C)c1)Cc1ccccc1O ZINC000891853423 1118804023 /nfs/dbraw/zinc/80/40/23/1118804023.db2.gz LXQSBUBLJYPGOH-UHFFFAOYSA-N 1 0 288.366 3.647 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCc3ccccc3C2)c(O)c1 ZINC000051630737 1119061504 /nfs/dbraw/zinc/06/15/04/1119061504.db2.gz IRQWBDUFNAHYGW-RHSMWYFYSA-N 1 0 281.399 3.909 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCc3ccccc3C2)c1 ZINC000051630819 1119061560 /nfs/dbraw/zinc/06/15/60/1119061560.db2.gz DJDXTTSHSDXZLI-PBHICJAKSA-N 1 0 281.399 3.909 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)Cc2ccsc2)c1 ZINC000049154887 1119087449 /nfs/dbraw/zinc/08/74/49/1119087449.db2.gz WSSNLLDDFKOYDP-NWDGAFQWSA-N 1 0 291.416 3.744 20 10 CHCDRO CC[C@H]([NH2+]CC1(C2CC2)CC1)c1ccc(F)cc1[O-] ZINC000796841096 1119091201 /nfs/dbraw/zinc/09/12/01/1119091201.db2.gz QPFMJPLZUFUINZ-AWEZNQCLSA-N 1 0 263.356 3.762 20 10 CHCDRO C[C@@H](O)C[C@@H](C)C[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000077428682 1119195246 /nfs/dbraw/zinc/19/52/46/1119195246.db2.gz UGNCYYJWUPFHHA-HUUCEWRRSA-N 1 0 299.414 3.556 20 10 CHCDRO CC1(C)CC([NH3+])CC(C)(C)N1c1ccc(OC2CC2)cc1 ZINC001167625397 1119232558 /nfs/dbraw/zinc/23/25/58/1119232558.db2.gz RWCOWLXBITZOCV-UHFFFAOYSA-N 1 0 288.435 3.713 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2cnc(C)s2)cc1 ZINC000123660721 1119300705 /nfs/dbraw/zinc/30/07/05/1119300705.db2.gz FSPAUSNBYITNSI-GFCCVEGCSA-N 1 0 289.448 3.758 20 10 CHCDRO C[C@H]([NH2+]CC(C)(C)C(C)(F)F)c1ccccc1O ZINC000829237328 1119323306 /nfs/dbraw/zinc/32/33/06/1119323306.db2.gz UKAAWKBQMHDYCC-JTQLQIEISA-N 1 0 257.324 3.724 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(F)cn1 ZINC000161799440 1119385175 /nfs/dbraw/zinc/38/51/75/1119385175.db2.gz WXVXNTVIMPNZIM-MRXNPFEDSA-N 1 0 287.382 3.528 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CC[C@H]3CCCC[C@H]3C2)c1O ZINC000250520121 1119442099 /nfs/dbraw/zinc/44/20/99/1119442099.db2.gz RTJCURGMCJBNIQ-CABCVRRESA-N 1 0 289.419 3.803 20 10 CHCDRO CC(C)OCC[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000168882775 1119483266 /nfs/dbraw/zinc/48/32/66/1119483266.db2.gz RLLQKYFYCKYJQW-CYBMUJFWSA-N 1 0 273.376 3.621 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)o1 ZINC000053036507 1119531841 /nfs/dbraw/zinc/53/18/41/1119531841.db2.gz WCDUHWANWYXLBQ-ZDUSSCGKSA-N 1 0 258.365 3.505 20 10 CHCDRO CC(F)(F)CC[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000294201154 1119590041 /nfs/dbraw/zinc/59/00/41/1119590041.db2.gz LWDYGNAYXBQTSN-UHFFFAOYSA-N 1 0 282.378 3.812 20 10 CHCDRO C[C@H]1C[C@@H](c2ccccc2)C[N@@H+]1Cc1ccccc1O ZINC000179576770 1119751913 /nfs/dbraw/zinc/75/19/13/1119751913.db2.gz YLCRFNSYHOGBER-WMLDXEAASA-N 1 0 267.372 3.770 20 10 CHCDRO Oc1ccccc1C[NH2+]Cc1cccc2ccccc21 ZINC000052060498 1119777987 /nfs/dbraw/zinc/77/79/87/1119777987.db2.gz IIRJUXYNOVQYEY-UHFFFAOYSA-N 1 0 263.340 3.835 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)C1CCCCC1 ZINC000052334112 1119813587 /nfs/dbraw/zinc/81/35/87/1119813587.db2.gz OLWOYMMLQUTZJE-ZDUSSCGKSA-N 1 0 259.393 3.680 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1cncc(F)c1 ZINC000177975183 1119893402 /nfs/dbraw/zinc/89/34/02/1119893402.db2.gz MNJQNGSFMHURNP-AWEZNQCLSA-N 1 0 299.393 3.672 20 10 CHCDRO CC[C@@H]([NH2+]CCOCC1CCC1)c1ccc(N(C)C)cc1 ZINC000765811879 1120050768 /nfs/dbraw/zinc/05/07/68/1120050768.db2.gz VVRLAVZBEKWMNF-GOSISDBHSA-N 1 0 290.451 3.610 20 10 CHCDRO COc1ccc(C[NH2+]Cc2nccc3c2CCCC3)cc1C ZINC000921651034 1120053412 /nfs/dbraw/zinc/05/34/12/1120053412.db2.gz KKIDGMBCVRJEPP-UHFFFAOYSA-N 1 0 296.414 3.567 20 10 CHCDRO CC[C@H](CSC)[N@H+](C)Cc1cc(C)cc(C)c1O ZINC000091024535 1120055917 /nfs/dbraw/zinc/05/59/17/1120055917.db2.gz GTEAFTCTSBRZEN-CQSZACIVSA-N 1 0 267.438 3.582 20 10 CHCDRO CC(C)OCCCC[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000180458508 1120099566 /nfs/dbraw/zinc/09/95/66/1120099566.db2.gz NEGQQFAPJLAVFZ-OAHLLOKOSA-N 1 0 278.440 3.608 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCCO2)c1cccc(O)c1 ZINC000921688989 1120114067 /nfs/dbraw/zinc/11/40/67/1120114067.db2.gz NTNRWRJBDYADPU-ZDUSSCGKSA-N 1 0 283.371 3.568 20 10 CHCDRO Cc1cc(C)[nH+]c(NCc2c(O)cccc2Cl)c1 ZINC000122349761 1120147964 /nfs/dbraw/zinc/14/79/64/1120147964.db2.gz LQKIRJXRODXILG-UHFFFAOYSA-N 1 0 262.740 3.670 20 10 CHCDRO CC(C)(CC[NH2+]Cc1ccc2c(c1)CCO2)C1CC1 ZINC000328515729 1120178517 /nfs/dbraw/zinc/17/85/17/1120178517.db2.gz DRQMBSQAOHRUAO-UHFFFAOYSA-N 1 0 259.393 3.537 20 10 CHCDRO CC[C@H](C)[C@](C)(O)C[NH2+][C@@H](CC)c1ccc(N(C)C)cc1 ZINC000765948069 1120251059 /nfs/dbraw/zinc/25/10/59/1120251059.db2.gz YYNMJNQNKMWUPJ-JCGIZDLHSA-N 1 0 292.467 3.590 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](C)N(C)c2ccccc2)c(O)c1 ZINC000756419700 1120333030 /nfs/dbraw/zinc/33/30/30/1120333030.db2.gz WSSYHUMDLDDHEI-HZPDHXFCSA-N 1 0 298.430 3.876 20 10 CHCDRO COC1(C[NH2+][C@@H](C)c2ccc(C)cc2O)CCCCC1 ZINC000186505293 1120342292 /nfs/dbraw/zinc/34/22/92/1120342292.db2.gz JYRWFNNWWVWNAZ-AWEZNQCLSA-N 1 0 277.408 3.701 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCN(C)C2CCCCC2)c1 ZINC000756454460 1120353752 /nfs/dbraw/zinc/35/37/52/1120353752.db2.gz FIUWRIYGMOLOBV-OAHLLOKOSA-N 1 0 290.451 3.616 20 10 CHCDRO Cc1noc(C)c1[C@@H](C)[NH2+][C@H](C)c1ccc(C)cc1O ZINC000092327738 1120357272 /nfs/dbraw/zinc/35/72/72/1120357272.db2.gz GBFHXWGIOKBZDM-GHMZBOCLSA-N 1 0 274.364 3.717 20 10 CHCDRO CCO[C@H](CC[NH2+][C@H](C)c1cc(C)ccc1O)C(C)C ZINC000185625408 1120380924 /nfs/dbraw/zinc/38/09/24/1120380924.db2.gz HUDZKSGRNGRCIO-RHSMWYFYSA-N 1 0 279.424 3.802 20 10 CHCDRO COc1cccc(C[NH2+]Cc2ccc3c(c2)CCCO3)c1C ZINC000922267437 1120491215 /nfs/dbraw/zinc/49/12/15/1120491215.db2.gz PTAPALAUMXXVBN-UHFFFAOYSA-N 1 0 297.398 3.618 20 10 CHCDRO CN(Cc1ccccc1O)c1cc[nH+]c2ccccc21 ZINC000189999451 1120492475 /nfs/dbraw/zinc/49/24/75/1120492475.db2.gz VRRRXWRTIXGHDX-UHFFFAOYSA-N 1 0 264.328 3.577 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccccc2F)c(O)c1 ZINC000020091203 1120583319 /nfs/dbraw/zinc/58/33/19/1120583319.db2.gz ZUXSYYBGGDUNOV-GFCCVEGCSA-N 1 0 259.324 3.691 20 10 CHCDRO CSC1(C[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)CC1 ZINC000193821123 1120584311 /nfs/dbraw/zinc/58/43/11/1120584311.db2.gz LWEPPUSAACMWEJ-GFCCVEGCSA-N 1 0 291.460 3.817 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+][C@@H]1CCCc2cccnc21 ZINC000922879948 1120617524 /nfs/dbraw/zinc/61/75/24/1120617524.db2.gz BEWPYVWBQUJYSS-CQSZACIVSA-N 1 0 288.778 3.608 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(F)cn1)c1ccc2ccccc2c1O ZINC000756658553 1120673267 /nfs/dbraw/zinc/67/32/67/1120673267.db2.gz KUAISUZJNJVHGF-LBPRGKRZSA-N 1 0 296.345 3.930 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCCO[C@@H]2CC(C)C)c(O)c1 ZINC000186824225 1120674469 /nfs/dbraw/zinc/67/44/69/1120674469.db2.gz YZMQTROSMSTNHR-QILLFSRXSA-N 1 0 291.435 3.945 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCCO[C@@H]2CC(C)C)c1 ZINC000186829163 1120674957 /nfs/dbraw/zinc/67/49/57/1120674957.db2.gz WNYLAORRVYKIBP-YXJHDRRASA-N 1 0 291.435 3.945 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]Cc1ccc(C2CC2)cc1 ZINC000191681575 1128950707 /nfs/dbraw/zinc/95/07/07/1128950707.db2.gz RNYOGHDBVLWLMD-UHFFFAOYSA-N 1 0 271.335 3.699 20 10 CHCDRO COc1ccc(O)c(C[NH2+]Cc2ccc(C3CC3)cc2)c1 ZINC000191681875 1128951035 /nfs/dbraw/zinc/95/10/35/1128951035.db2.gz SOXYQDWHOCKJIL-UHFFFAOYSA-N 1 0 283.371 3.568 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](O)CC(C)(C)C)c1ccc(N(C)C)cc1 ZINC000766057789 1121063307 /nfs/dbraw/zinc/06/33/07/1121063307.db2.gz AYCXQINJIPNBLK-SJORKVTESA-N 1 0 292.467 3.590 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@H](O)CC(C)(C)C)cc1 ZINC000766060539 1121068182 /nfs/dbraw/zinc/06/81/82/1121068182.db2.gz LZNQLYKKQCUCST-RHSMWYFYSA-N 1 0 292.467 3.590 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCc2cccc(O)c21)c1ccccc1 ZINC000223238760 1121069133 /nfs/dbraw/zinc/06/91/33/1121069133.db2.gz DRFYWBXOVUIBRS-DOMZBBRYSA-N 1 0 253.345 3.730 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H](C)CC(F)F)c1 ZINC000700156049 1121086954 /nfs/dbraw/zinc/08/69/54/1121086954.db2.gz QJLZGPAMKTWBCL-QWRGUYRKSA-N 1 0 257.324 3.643 20 10 CHCDRO C[C@@H](C[NH2+]Cc1c(O)cccc1Cl)Oc1ccccc1 ZINC000700351789 1121098807 /nfs/dbraw/zinc/09/88/07/1121098807.db2.gz IAKMUEGSKQRCEP-LBPRGKRZSA-N 1 0 291.778 3.603 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1C=CCC1)c1cc(Br)ccc1O ZINC000700586050 1121107719 /nfs/dbraw/zinc/10/77/19/1121107719.db2.gz GJOPMPBYFYVUBR-WCQYABFASA-N 1 0 296.208 3.914 20 10 CHCDRO CC1CCC(C[NH2+]Cc2ccc3c(c2)CCO3)CC1 ZINC000058872434 1121166219 /nfs/dbraw/zinc/16/62/19/1121166219.db2.gz XITXABSVQKLXLM-UHFFFAOYSA-N 1 0 259.393 3.537 20 10 CHCDRO Cc1cc(C[NH2+][C@H]2CCO[C@H](C)C2)c(C)n1-c1ccccc1 ZINC000318851025 1121172072 /nfs/dbraw/zinc/17/20/72/1121172072.db2.gz NTMQSTBBODYHPO-QAPCUYQASA-N 1 0 298.430 3.751 20 10 CHCDRO CC[C@@H]1CCC[C@H]1[NH2+]CCCSc1nccs1 ZINC000766070319 1121180588 /nfs/dbraw/zinc/18/05/88/1121180588.db2.gz COADRODXEUDSOO-VXGBXAGGSA-N 1 0 270.467 3.794 20 10 CHCDRO C[C@H](F)CC[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000702625086 1121205713 /nfs/dbraw/zinc/20/57/13/1121205713.db2.gz XCGMDEOENOIJOI-RYUDHWBXSA-N 1 0 261.340 3.944 20 10 CHCDRO CC(C)O[C@H]1C[C@H]([NH2+]Cc2cc(Cl)ccc2O)C1(C)C ZINC000766088346 1121207060 /nfs/dbraw/zinc/20/70/60/1121207060.db2.gz HUXADWRRIIUVRI-GJZGRUSLSA-N 1 0 297.826 3.727 20 10 CHCDRO CCC(CC)[C@H](C[NH2+][C@H](C)c1cc(F)ccc1O)N(C)C ZINC000094617002 1121215980 /nfs/dbraw/zinc/21/59/80/1121215980.db2.gz IITVNAXMBQVUSZ-WBMJQRKESA-N 1 0 296.430 3.548 20 10 CHCDRO Oc1cc2c(cc1C[N@@H+]1CC[C@H](CC(F)(F)F)C1)CCC2 ZINC000766126105 1121288572 /nfs/dbraw/zinc/28/85/72/1121288572.db2.gz XHFZZZMKXFEMPG-LLVKDONJSA-N 1 0 299.336 3.655 20 10 CHCDRO CC(C)CC[C@](C)(O)C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000766128979 1121291340 /nfs/dbraw/zinc/29/13/40/1121291340.db2.gz NPDDBPXJPHWFQA-YJBOKZPZSA-N 1 0 292.467 3.590 20 10 CHCDRO CC[C@H]([NH2+]CC[C@H]1CCSC1)c1ccccc1O ZINC000704777412 1121368345 /nfs/dbraw/zinc/36/83/45/1121368345.db2.gz TZKPJKZLLYEKMG-JSGCOSHPSA-N 1 0 265.422 3.576 20 10 CHCDRO CC[C@H]1CCC[N@@H+]1Cc1c(O)cccc1OC(F)(F)F ZINC001237124223 1128982308 /nfs/dbraw/zinc/98/23/08/1128982308.db2.gz YPEYPMFKKIEBJT-JTQLQIEISA-N 1 0 289.297 3.665 20 10 CHCDRO C[C@@H]([NH2+]CCC1(F)CCC1)c1ccc(N(C)C)cc1 ZINC000705230143 1121393485 /nfs/dbraw/zinc/39/34/85/1121393485.db2.gz PKGIYHURQRYBFL-CYBMUJFWSA-N 1 0 264.388 3.686 20 10 CHCDRO CCOc1cccc(C[NH2+]C[C@H](C)C(C)(C)C)c1O ZINC000096610222 1121403243 /nfs/dbraw/zinc/40/32/43/1121403243.db2.gz JGWFCAMZAUNFPA-LBPRGKRZSA-N 1 0 265.397 3.563 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]C[C@H]2CCCC23CC3)c1O ZINC000706271197 1121424453 /nfs/dbraw/zinc/42/44/53/1121424453.db2.gz PRIQOVBUOXFCJD-GFCCVEGCSA-N 1 0 295.810 3.724 20 10 CHCDRO CC(=O)c1cc(Cl)cc(C[N@H+]2[C@H](C)CC[C@@H]2C)c1O ZINC000706475358 1121431078 /nfs/dbraw/zinc/43/10/78/1121431078.db2.gz HHDJBBQZQLSHFI-AOOOYVTPSA-N 1 0 281.783 3.621 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CCC[C@H](C(C)(C)C)C2)c1 ZINC000708454215 1121465192 /nfs/dbraw/zinc/46/51/92/1121465192.db2.gz NCRVNHQZFBMRLF-AWEZNQCLSA-N 1 0 277.408 3.659 20 10 CHCDRO c1cc(C[NH2+]CC2CCC3(CC3)CC2)cc2c1OCC2 ZINC000709940824 1121628078 /nfs/dbraw/zinc/62/80/78/1121628078.db2.gz CYVOIFHSNJFKFQ-UHFFFAOYSA-N 1 0 271.404 3.682 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]CCC(C)(C)SC)c1 ZINC000877532770 1121698255 /nfs/dbraw/zinc/69/82/55/1121698255.db2.gz HEWYUWYWXKYNCK-NSHDSACASA-N 1 0 283.437 3.583 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]C/C=C/c1ccccc1 ZINC000237086157 1121717427 /nfs/dbraw/zinc/71/74/27/1121717427.db2.gz RYUVGQYCWCZMGD-JXMROGBWSA-N 1 0 280.415 3.864 20 10 CHCDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]C[C@H]1CCCCO1 ZINC000727467623 1121721075 /nfs/dbraw/zinc/72/10/75/1121721075.db2.gz JDGGWNHMLSIIBX-GOSISDBHSA-N 1 0 297.398 3.718 20 10 CHCDRO COc1cc(C)cc(C[NH2+][C@H](C)c2ccc(C)s2)c1O ZINC000894201285 1121732184 /nfs/dbraw/zinc/73/21/84/1121732184.db2.gz XMJMFODOVYDHRQ-GFCCVEGCSA-N 1 0 291.416 3.930 20 10 CHCDRO C[C@@H]1CC(C)(C)C[C@H]1[NH2+]Cc1ccc2c(c1)CCCN2C ZINC001177529986 1121734833 /nfs/dbraw/zinc/73/48/33/1121734833.db2.gz XSQNAIZFCLIEHR-RHSMWYFYSA-N 1 0 286.463 3.983 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]C[C@H]2Cc3ccccc32)cc1 ZINC001177724611 1121745760 /nfs/dbraw/zinc/74/57/60/1121745760.db2.gz DGIYUYYQQRBGAW-OOFWQKGWSA-N 1 0 292.426 3.695 20 10 CHCDRO CN(C)c1ccc(C[NH2+]CCc2cccc3[nH]ccc32)cc1 ZINC000800300840 1121756632 /nfs/dbraw/zinc/75/66/32/1121756632.db2.gz QCASQNROUGSDDU-UHFFFAOYSA-N 1 0 293.414 3.566 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C[C@H]2CCC[C@@H]2C2CC2)cc1F ZINC001178950017 1121833658 /nfs/dbraw/zinc/83/36/58/1121833658.db2.gz JNMRHIOPTUYFIG-HZPDHXFCSA-N 1 0 290.426 3.808 20 10 CHCDRO CCN(C)c1ccc(C[N@H+](C)[C@@H](C)c2cccnc2)cc1 ZINC000773808356 1121861894 /nfs/dbraw/zinc/86/18/94/1121861894.db2.gz KVACVQOXAOSNHO-HNNXBMFYSA-N 1 0 283.419 3.731 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CCC[C@@H]2c2ccncc2)cc1 ZINC000773815190 1121882000 /nfs/dbraw/zinc/88/20/00/1121882000.db2.gz YLRIRSPKVPMPOQ-LJQANCHMSA-N 1 0 295.430 3.875 20 10 CHCDRO COc1cc(C)cc(C[NH2+][C@@H]2CCc3c2cccc3C)c1O ZINC000894240118 1121893192 /nfs/dbraw/zinc/89/31/92/1121893192.db2.gz OZAKCVFCUVKCAN-QGZVFWFLSA-N 1 0 297.398 3.795 20 10 CHCDRO CCN(C)c1ccc(CN[C@@H](C)c2ncc(C)s2)cc1 ZINC000773839485 1121940153 /nfs/dbraw/zinc/94/01/53/1121940153.db2.gz NQMIAIKFQJCKOI-ZDUSSCGKSA-N 1 0 289.448 3.758 20 10 CHCDRO CC[N@H+](Cc1cccs1)Cc1c(C)cc(OC)cc1O ZINC001180108720 1121952078 /nfs/dbraw/zinc/95/20/78/1121952078.db2.gz XPPHIJUFOJYTJP-UHFFFAOYSA-N 1 0 291.416 3.793 20 10 CHCDRO CC(C)CC[C@@H](C)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000733323406 1121976193 /nfs/dbraw/zinc/97/61/93/1121976193.db2.gz ZHONHRIYPGIRCB-CYBMUJFWSA-N 1 0 266.404 3.806 20 10 CHCDRO C[C@H]1CCC[C@H]([NH2+]Cc2ccc(N(C)C)c(F)c2)C1 ZINC000733323965 1121976708 /nfs/dbraw/zinc/97/67/08/1121976708.db2.gz BDBCWFFPHJTDDH-JSGCOSHPSA-N 1 0 264.388 3.560 20 10 CHCDRO Cc1ccc(CC[NH2+]Cc2c(O)cccc2Cl)c(C)c1 ZINC000733325729 1121976894 /nfs/dbraw/zinc/97/68/94/1121976894.db2.gz RCLCQRYFZJLEMZ-UHFFFAOYSA-N 1 0 289.806 3.995 20 10 CHCDRO Cc1ccc2c(CC[NH2+]Cc3cc(C)ccc3O)c[nH]c2c1 ZINC000733326922 1121977467 /nfs/dbraw/zinc/97/74/67/1121977467.db2.gz FBQIEWPJILVCAY-UHFFFAOYSA-N 1 0 294.398 3.823 20 10 CHCDRO C[C@H]([NH2+]CCCc1cccc(F)c1)c1ccccc1O ZINC000183100890 1129022770 /nfs/dbraw/zinc/02/27/70/1129022770.db2.gz XJEXBIWVLGQCNQ-ZDUSSCGKSA-N 1 0 273.351 3.815 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2CCCC[C@@H]2C)cc1Cl ZINC001180438279 1121986733 /nfs/dbraw/zinc/98/67/33/1121986733.db2.gz XGUHBEVUSHAGPB-NSHDSACASA-N 1 0 253.773 3.728 20 10 CHCDRO COc1cc(C)cc(C[NH2+]C2CC(c3ccccc3)C2)c1O ZINC000894249146 1121992134 /nfs/dbraw/zinc/99/21/34/1121992134.db2.gz NUBUNBXDYFYQEM-UHFFFAOYSA-N 1 0 297.398 3.745 20 10 CHCDRO CC(C)c1ccc(O)c(C[NH2+][C@H]2CCO[C@H](C3CC3)C2)c1 ZINC001180592365 1122002530 /nfs/dbraw/zinc/00/25/30/1122002530.db2.gz FIXVLEGWYDKNDQ-WMZOPIPTSA-N 1 0 289.419 3.563 20 10 CHCDRO CCCC[C@@](C)(CO)[NH2+]Cc1cc(C(C)C)ccc1O ZINC001206440239 1122029806 /nfs/dbraw/zinc/02/98/06/1122029806.db2.gz NFKUVLIOQUYEAV-KRWDZBQOSA-N 1 0 279.424 3.546 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CCCC23CCC3)cc1 ZINC000773893726 1122030688 /nfs/dbraw/zinc/03/06/88/1122030688.db2.gz COYIGEKLYLTUAJ-UHFFFAOYSA-N 1 0 258.409 3.661 20 10 CHCDRO CC(C)SCC[NH2+]Cc1cc(C(C)C)ccc1O ZINC001181598878 1122065517 /nfs/dbraw/zinc/06/55/17/1122065517.db2.gz HOHMZJPSWSBZQE-UHFFFAOYSA-N 1 0 267.438 3.747 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H](c2ccccc2)N(C)C)c1 ZINC000192743789 1129032861 /nfs/dbraw/zinc/03/28/61/1129032861.db2.gz PMYXJPXITCBTPV-CRAIPNDOSA-N 1 0 298.430 3.654 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2cc(F)ccc2O)CC12CCC2 ZINC000779604089 1129031966 /nfs/dbraw/zinc/03/19/66/1129031966.db2.gz FZJVDMOJJWWKRB-GFCCVEGCSA-N 1 0 263.356 3.543 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc3c(c2)OCO3)c(O)c1 ZINC000192749811 1129033605 /nfs/dbraw/zinc/03/36/05/1129033605.db2.gz AVIIXEVAVDUYQA-QWHCGFSZSA-N 1 0 299.370 3.841 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2C[C@H](C)[C@@H](C)[C@H]2C)c(Cl)c1 ZINC001182453727 1122161557 /nfs/dbraw/zinc/16/15/57/1122161557.db2.gz VREIVDASYNLTSK-QJPTWQEYSA-N 1 0 267.800 3.830 20 10 CHCDRO CC[C@@H]1C[N@@H+](Cc2cc(C(C)C)ccc2O)C[C@H](CC)O1 ZINC001182461948 1122165736 /nfs/dbraw/zinc/16/57/36/1122165736.db2.gz MREREULEKOYZOC-CALCHBBNSA-N 1 0 291.435 3.905 20 10 CHCDRO CC(C)[N@H+](Cc1ccco1)Cc1cc(F)ccc1O ZINC000272318349 1122197739 /nfs/dbraw/zinc/19/77/39/1122197739.db2.gz TVXUEIDGRNTDNY-UHFFFAOYSA-N 1 0 263.312 3.535 20 10 CHCDRO Oc1ccc(Br)cc1C[NH2+][C@H]1CC12CCCC2 ZINC000387003251 1122199766 /nfs/dbraw/zinc/19/97/66/1122199766.db2.gz MJJJKFQWCCBGOB-ZDUSSCGKSA-N 1 0 296.208 3.577 20 10 CHCDRO Oc1ccc(Br)cc1C[NH2+][C@@H]1CC12CCCC2 ZINC000387003248 1122199820 /nfs/dbraw/zinc/19/98/20/1122199820.db2.gz MJJJKFQWCCBGOB-CYBMUJFWSA-N 1 0 296.208 3.577 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCO[C@@H](C(C)(C)C)C1)c1ccccc1O ZINC000272803926 1122212045 /nfs/dbraw/zinc/21/20/45/1122212045.db2.gz BVOAYNYNDAAAAI-HEHGZKQESA-N 1 0 277.408 3.637 20 10 CHCDRO CC[C@H]1[C@H](C)CC[N@@H+]1Cc1cc2c(cc1O)CCC2 ZINC000774618488 1122218157 /nfs/dbraw/zinc/21/81/57/1122218157.db2.gz LNRUGYBZQLRVPI-WBMJQRKESA-N 1 0 259.393 3.501 20 10 CHCDRO CC[C@H]1[C@@H](C)CC[N@@H+]1Cc1cc2c(cc1O)CCC2 ZINC000774618486 1122218719 /nfs/dbraw/zinc/21/87/19/1122218719.db2.gz LNRUGYBZQLRVPI-LRDDRELGSA-N 1 0 259.393 3.501 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC[C@H](CF)C2)c(Cl)c1 ZINC001183521187 1122225752 /nfs/dbraw/zinc/22/57/52/1122225752.db2.gz VYQBLYKVADYGCZ-LLVKDONJSA-N 1 0 271.763 3.536 20 10 CHCDRO C[C@H]([NH2+]CC1(C)CCOCC1)c1cc(Cl)ccc1O ZINC000273349427 1122229381 /nfs/dbraw/zinc/22/93/81/1122229381.db2.gz BIVAZKIILASBRS-NSHDSACASA-N 1 0 283.799 3.513 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(F)cc2)c(O)c1C ZINC000273412743 1122231711 /nfs/dbraw/zinc/23/17/11/1122231711.db2.gz PZSJBQOGYJZSNO-CYBMUJFWSA-N 1 0 273.351 3.999 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccccc2)c(O)c1C ZINC000273410996 1122231836 /nfs/dbraw/zinc/23/18/36/1122231836.db2.gz POPDTOMBHSZSPE-AWEZNQCLSA-N 1 0 255.361 3.860 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCCc2ccccn2)c(O)c1C ZINC000273452874 1122233949 /nfs/dbraw/zinc/23/39/49/1122233949.db2.gz GLROVEKABIDWNG-OAHLLOKOSA-N 1 0 284.403 3.687 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCO[C@@H](C(C)C)C2)c1 ZINC000273491804 1122236444 /nfs/dbraw/zinc/23/64/44/1122236444.db2.gz OKDBLFJBAMCUFA-JJRVBVJISA-N 1 0 277.408 3.555 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccccc2N(C)C)c(O)c1C ZINC000273543042 1122237535 /nfs/dbraw/zinc/23/75/35/1122237535.db2.gz YUWMCMGPDAOBPA-HNNXBMFYSA-N 1 0 298.430 3.926 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H](CCO)c2ccccc2)c(O)c1C ZINC000273603118 1122239782 /nfs/dbraw/zinc/23/97/82/1122239782.db2.gz SJKHRYMAFBLMAP-CRAIPNDOSA-N 1 0 299.414 3.783 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CSCCS2)c(O)c1C ZINC000273617371 1122241113 /nfs/dbraw/zinc/24/11/13/1122241113.db2.gz XUFRELHLLGIYSI-QWHCGFSZSA-N 1 0 297.489 3.508 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]CC[C@@H]1CC[C@H]2C[C@H]21 ZINC001183846427 1122241856 /nfs/dbraw/zinc/24/18/56/1122241856.db2.gz SUZOCTLPYGQCLU-MPGHIAIKSA-N 1 0 272.436 3.587 20 10 CHCDRO C[C@H](CCc1ccsc1)[NH2+]Cc1c([O-])cccc1F ZINC001183920446 1122248524 /nfs/dbraw/zinc/24/85/24/1122248524.db2.gz YVZOJZKZWZFHGJ-LLVKDONJSA-N 1 0 279.380 3.704 20 10 CHCDRO Cc1ccc(C[N@@H+]2CCO[C@H](c3ccccc3)CC2)c(O)c1 ZINC001184351654 1122273395 /nfs/dbraw/zinc/27/33/95/1122273395.db2.gz RIWXNDVSDIRZJI-IBGZPJMESA-N 1 0 297.398 3.664 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](c2ccccc2)N(C)C)c(O)c1 ZINC000192907562 1129046238 /nfs/dbraw/zinc/04/62/38/1129046238.db2.gz UIRNPGWWSRBRFJ-CRAIPNDOSA-N 1 0 298.430 3.654 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2cc(Cl)ccc2O)CCC1(F)F ZINC001203650917 1122414950 /nfs/dbraw/zinc/41/49/50/1122414950.db2.gz GGXNRNZVOLMGER-SNVBAGLBSA-N 1 0 289.753 3.913 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccc(N(C)C)cc1)c1ccccc1O ZINC000155545398 1122429197 /nfs/dbraw/zinc/42/91/97/1122429197.db2.gz UDTAGQCEOGLRKF-GOSISDBHSA-N 1 0 298.430 3.742 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)Cc2cccnc2)cc1 ZINC000193144381 1129056399 /nfs/dbraw/zinc/05/63/99/1129056399.db2.gz XJYJFHOVRXSPCI-UHFFFAOYSA-N 1 0 283.419 3.560 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCCO[C@@H]1C(C)(C)C)c1ccccc1O ZINC000183519921 1129059203 /nfs/dbraw/zinc/05/92/03/1129059203.db2.gz FUYHNKXYKIWXAJ-ZQIUZPCESA-N 1 0 291.435 3.884 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]CCCOC2CCCCC2)c1 ZINC000071406746 1129060213 /nfs/dbraw/zinc/06/02/13/1129060213.db2.gz CHPHGKJPDJQIOW-UHFFFAOYSA-N 1 0 277.408 3.530 20 10 CHCDRO Cc1ccccc1O[C@@H](C)C[NH2+][C@@H](C)c1ccccc1O ZINC000183534421 1129060784 /nfs/dbraw/zinc/06/07/84/1129060784.db2.gz QBFCCSWOBVMVHP-GJZGRUSLSA-N 1 0 285.387 3.819 20 10 CHCDRO CC(C)C[C@@H]1OCCC[C@@H]1[NH2+]Cc1cc(Cl)ccc1O ZINC000775373663 1122532333 /nfs/dbraw/zinc/53/23/33/1122532333.db2.gz ZLGATGURBMWEGK-HOCLYGCPSA-N 1 0 297.826 3.729 20 10 CHCDRO Cc1ccccc1O[C@H](C)C[NH2+][C@H](C)c1ccccc1O ZINC000183534464 1129061182 /nfs/dbraw/zinc/06/11/82/1129061182.db2.gz QBFCCSWOBVMVHP-HUUCEWRRSA-N 1 0 285.387 3.819 20 10 CHCDRO CCC[C@@H]([NH2+]Cc1ccc(OC)cc1O)[C@@H]1CC1(C)C ZINC001205517485 1122539015 /nfs/dbraw/zinc/53/90/15/1122539015.db2.gz QYWAUFVBWGGTCP-LSDHHAIUSA-N 1 0 277.408 3.705 20 10 CHCDRO CC[C@@H]([NH2+]CCOc1ccccc1F)c1ccccc1O ZINC000775414523 1122557174 /nfs/dbraw/zinc/55/71/74/1122557174.db2.gz NGGANYSKZPVRSF-OAHLLOKOSA-N 1 0 289.350 3.651 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccco1)c1cc(Cl)ccc1O ZINC000775483074 1122615091 /nfs/dbraw/zinc/61/50/91/1122615091.db2.gz JQUYAYIEONBTCK-ZDUSSCGKSA-N 1 0 265.740 3.880 20 10 CHCDRO CCOCCC[NH2+][C@@H](CC)c1cc(Cl)ccc1O ZINC000775482847 1122615837 /nfs/dbraw/zinc/61/58/37/1122615837.db2.gz DFLZJAHVPOFXNN-ZDUSSCGKSA-N 1 0 271.788 3.513 20 10 CHCDRO CC[C@H]([NH2+]CCCOC(C)C)c1cc(Cl)ccc1O ZINC000775483403 1122616414 /nfs/dbraw/zinc/61/64/14/1122616414.db2.gz TYGYSHUIXMQJJI-AWEZNQCLSA-N 1 0 285.815 3.901 20 10 CHCDRO CC[C@@H]([NH2+]CCCOC(C)C)c1cc(Cl)ccc1O ZINC000775483404 1122616677 /nfs/dbraw/zinc/61/66/77/1122616677.db2.gz TYGYSHUIXMQJJI-CQSZACIVSA-N 1 0 285.815 3.901 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)[C@H]1CCOC1)c1cc(Cl)ccc1O ZINC000775510010 1122632784 /nfs/dbraw/zinc/63/27/84/1122632784.db2.gz WZMBVZLHOFAZJI-MJVIPROJSA-N 1 0 283.799 3.511 20 10 CHCDRO CC[C@@H]([NH2+]CCc1cc(F)ccc1F)c1ccccc1O ZINC000775513647 1122632802 /nfs/dbraw/zinc/63/28/02/1122632802.db2.gz QZFIFQXVFJBRSK-MRXNPFEDSA-N 1 0 291.341 3.954 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)C[C@@H]1CCOC1)c1cc(Cl)ccc1O ZINC000775514444 1122635887 /nfs/dbraw/zinc/63/58/87/1122635887.db2.gz VYIXVVXBXNGFON-HUBLWGQQSA-N 1 0 297.826 3.901 20 10 CHCDRO CC[C@@H]([NH2+]CC1(CCO)CCC1)c1cc(Cl)ccc1O ZINC000775521931 1122638744 /nfs/dbraw/zinc/63/87/44/1122638744.db2.gz FIRYYBFCPUDDAB-CQSZACIVSA-N 1 0 297.826 3.639 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CCSC1)c1cc(Cl)ccc1O ZINC000775527347 1122644819 /nfs/dbraw/zinc/64/48/19/1122644819.db2.gz QZLQYHFIEGCUBD-CMPLNLGQSA-N 1 0 271.813 3.592 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1C[C@@H]1c1ccccc1)c1ccccc1O ZINC000183600120 1129068450 /nfs/dbraw/zinc/06/84/50/1129068450.db2.gz UKWFVBPAEDYNPA-FRFSOERESA-N 1 0 267.372 3.847 20 10 CHCDRO CC[C@H]([NH2+]CCOC(C)(C)C)c1cc(Cl)ccc1O ZINC000775533226 1122649380 /nfs/dbraw/zinc/64/93/80/1122649380.db2.gz FVYOGZOWANWWMG-ZDUSSCGKSA-N 1 0 285.815 3.901 20 10 CHCDRO CC[C@@H]([NH2+]CCOC(C)C)c1cc(Cl)ccc1O ZINC000775552928 1122661923 /nfs/dbraw/zinc/66/19/23/1122661923.db2.gz ZIFQVZYLPBDKIM-CYBMUJFWSA-N 1 0 271.788 3.511 20 10 CHCDRO Cc1ncc([C@H](C)[NH2+][C@H](C)c2ccc(N(C)C)cc2)s1 ZINC000775582091 1122681744 /nfs/dbraw/zinc/68/17/44/1122681744.db2.gz LMGDGUPCSJMYEZ-NEPJUHHUSA-N 1 0 289.448 3.929 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CC(C)(C)c2ccccn2)c1 ZINC000297346143 1122793341 /nfs/dbraw/zinc/79/33/41/1122793341.db2.gz OUPQZRRYKNHLHO-CQSZACIVSA-N 1 0 284.403 3.724 20 10 CHCDRO COCC[N@H+](Cc1cccc(C)c1O)[C@@H](C)c1ccccc1 ZINC000775657117 1122871911 /nfs/dbraw/zinc/87/19/11/1122871911.db2.gz UWIAEXDLQSCZRP-INIZCTEOSA-N 1 0 299.414 3.910 20 10 CHCDRO [O-]c1c(Cl)cccc1C[N@@H+]1CCC[C@H]1C1CCC1 ZINC000775669060 1122882748 /nfs/dbraw/zinc/88/27/48/1122882748.db2.gz DECAAQSVZKRFQA-AWEZNQCLSA-N 1 0 265.784 3.810 20 10 CHCDRO CC[N@H+](Cc1cc(Cl)cc(C)c1O)C1CCC1 ZINC000775712271 1122918410 /nfs/dbraw/zinc/91/84/10/1122918410.db2.gz OILGUZNWODVHQL-UHFFFAOYSA-N 1 0 253.773 3.728 20 10 CHCDRO Cc1cccc(C[N@@H+]2CC[C@](C)(c3ccccc3)C2)c1O ZINC000775724118 1122924603 /nfs/dbraw/zinc/92/46/03/1122924603.db2.gz CVNABQDTEHBYTF-IBGZPJMESA-N 1 0 281.399 3.864 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCOC3(C2)CCCCCC3)c1O ZINC000775725621 1122925219 /nfs/dbraw/zinc/92/52/19/1122925219.db2.gz JZRBFJBQUVSBDT-UHFFFAOYSA-N 1 0 289.419 3.626 20 10 CHCDRO Cc1cccc(C[N@H+]2C[C@@H](C)[C@H]2c2ccccc2)c1O ZINC000775735565 1122928556 /nfs/dbraw/zinc/92/85/56/1122928556.db2.gz WOYZNCZOUMBWTM-PBHICJAKSA-N 1 0 267.372 3.894 20 10 CHCDRO C[C@@H]([NH2+]Cc1cc(O)ccc1Cl)c1ccccc1O ZINC001197005010 1122942466 /nfs/dbraw/zinc/94/24/66/1122942466.db2.gz WWRSNZGFIMKLPD-SNVBAGLBSA-N 1 0 277.751 3.602 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CC1(Cl)Cl)c1ccc(N(C)C)cc1 ZINC000775834052 1122986968 /nfs/dbraw/zinc/98/69/68/1122986968.db2.gz JPQGYNFYBFLFIX-JQWIXIFHSA-N 1 0 287.234 3.597 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CC1(Cl)Cl)c1ccc(N(C)C)cc1 ZINC000775834050 1122987114 /nfs/dbraw/zinc/98/71/14/1122987114.db2.gz JPQGYNFYBFLFIX-CMPLNLGQSA-N 1 0 287.234 3.597 20 10 CHCDRO C[C@H](C[NH2+]Cc1ccc2c(c1)CCO2)Cc1ccccc1 ZINC000775954939 1123028692 /nfs/dbraw/zinc/02/86/92/1123028692.db2.gz XWIGNZVQEYRSMG-HNNXBMFYSA-N 1 0 281.399 3.590 20 10 CHCDRO C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(N3CCSCC3)cc2)C1 ZINC001199376876 1123029086 /nfs/dbraw/zinc/02/90/86/1123029086.db2.gz QXIJKYGOPSBKAI-GDBMZVCRSA-N 1 0 290.476 3.518 20 10 CHCDRO Cc1ccc(O)c(C[N@H+]2CCC[C@@H](C(F)(F)F)[C@H]2C)c1 ZINC000776013693 1123036092 /nfs/dbraw/zinc/03/60/92/1123036092.db2.gz NLMAAOJOKCYSSO-DGCLKSJQSA-N 1 0 287.325 3.863 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H]2CCc3ccc(C)cc32)c1O ZINC000776174124 1123102523 /nfs/dbraw/zinc/10/25/23/1123102523.db2.gz AFYRVNZFFQDDDT-QGZVFWFLSA-N 1 0 297.398 3.876 20 10 CHCDRO Cc1cccc(C[NH2+]C(C)(C)c2cccs2)c1O ZINC000776175321 1123102593 /nfs/dbraw/zinc/10/25/93/1123102593.db2.gz PHUCKAIEODISKB-UHFFFAOYSA-N 1 0 261.390 3.787 20 10 CHCDRO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1cccc(C)c1O)CC2 ZINC000776175400 1123102625 /nfs/dbraw/zinc/10/26/25/1123102625.db2.gz YNDMXPSRPGJDTL-KRWDZBQOSA-N 1 0 267.372 3.786 20 10 CHCDRO COc1cccc(C[NH2+][C@H](C)c2ccc(C)s2)c1O ZINC000049158122 1123132235 /nfs/dbraw/zinc/13/22/35/1123132235.db2.gz HYRWLYDANCJJPF-LLVKDONJSA-N 1 0 277.389 3.622 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H]2CSc3ccccc32)c1O ZINC000776208089 1123148193 /nfs/dbraw/zinc/14/81/93/1123148193.db2.gz VSVRFGDLKPGXJF-CQSZACIVSA-N 1 0 271.385 3.637 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+]CCCC(F)(F)F)c1O ZINC000776221513 1123155853 /nfs/dbraw/zinc/15/58/53/1123155853.db2.gz SDUDZRXEDWBBQS-UHFFFAOYSA-N 1 0 281.705 3.786 20 10 CHCDRO CC[C@@H]([NH2+]C1CC(F)(F)C1)c1cc(Cl)ccc1O ZINC000760041782 1123181031 /nfs/dbraw/zinc/18/10/31/1123181031.db2.gz ZZDFRSPKGLPCFM-LLVKDONJSA-N 1 0 275.726 3.884 20 10 CHCDRO COc1cccc(C[NH2+]C[C@H](c2ccccc2)C(C)C)c1O ZINC000237205086 1123186237 /nfs/dbraw/zinc/18/62/37/1123186237.db2.gz ALRHNCCSVZMYAK-KRWDZBQOSA-N 1 0 299.414 3.930 20 10 CHCDRO C[C@@H]([NH2+]Cc1cscn1)c1ccc2ccccc2c1O ZINC000108941651 1123233990 /nfs/dbraw/zinc/23/39/90/1123233990.db2.gz JFPLWWUJAOKDIU-LLVKDONJSA-N 1 0 284.384 3.853 20 10 CHCDRO CCOc1ccc(C[NH2+]Cc2ccc(N(C)C)cc2)c(C)c1 ZINC000850011625 1123236721 /nfs/dbraw/zinc/23/67/21/1123236721.db2.gz QZWOIMOQPCHGGV-UHFFFAOYSA-N 1 0 298.430 3.750 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]CC[C@]2(C)CC2(F)F)cc1 ZINC000850380529 1123260130 /nfs/dbraw/zinc/26/01/30/1123260130.db2.gz IGRBPJHTVNKFLP-DWTRPJMMSA-N 1 0 294.389 3.791 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CC[C@]2(C)CC2(F)F)cc1C ZINC000850380123 1123260272 /nfs/dbraw/zinc/26/02/72/1123260272.db2.gz BXWMVEGVNVSBJX-CQSZACIVSA-N 1 0 269.335 3.534 20 10 CHCDRO CC[C@@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)C1CC1 ZINC000850382624 1123260892 /nfs/dbraw/zinc/26/08/92/1123260892.db2.gz ZGXNFPPPGGEYDH-KEGWNNHHSA-N 1 0 258.409 3.544 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@@H](C)c2ccccn2)cc1 ZINC000850482401 1123273127 /nfs/dbraw/zinc/27/31/27/1123273127.db2.gz OYCSIDPQPLJWLE-HZPDHXFCSA-N 1 0 297.446 3.992 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](C)c2ccccn2)c(O)c1C ZINC000850482020 1123273487 /nfs/dbraw/zinc/27/34/87/1123273487.db2.gz MAIZCGBUWFTVBX-HIFRSBDPSA-N 1 0 284.403 3.858 20 10 CHCDRO C[C@H](C[NH2+][C@@H](C)c1cc(Cl)ccc1O)c1ccccn1 ZINC000850482342 1123273663 /nfs/dbraw/zinc/27/36/63/1123273663.db2.gz OSTMTGOYHZUXGY-NEPJUHHUSA-N 1 0 290.794 3.895 20 10 CHCDRO C[C@@H]([NH2+]C[C@H](C)c1ccccn1)c1ccc(N(C)C)cc1 ZINC000850481498 1123273696 /nfs/dbraw/zinc/27/36/96/1123273696.db2.gz HJKFRANJFGJNHC-LSDHHAIUSA-N 1 0 283.419 3.602 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCN2C(C)(C)C)c(O)c1C ZINC000850480540 1123273793 /nfs/dbraw/zinc/27/37/93/1123273793.db2.gz BXCNYDXUWSLXBF-GJZGRUSLSA-N 1 0 290.451 3.532 20 10 CHCDRO CC[C@H](COCC1CC1)[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000850492286 1123274595 /nfs/dbraw/zinc/27/45/95/1123274595.db2.gz CRFGHLNVFOZGOG-DZGCQCFKSA-N 1 0 277.408 3.556 20 10 CHCDRO C[C@@H]([NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F)c1cscn1 ZINC000850511484 1123278309 /nfs/dbraw/zinc/27/83/09/1123278309.db2.gz GELYEKZPUOCOAT-KKZNHRDASA-N 1 0 292.379 3.887 20 10 CHCDRO CCO[C@H]1C[C@H]([NH2+][C@H](C)c2ccc3ccccc3c2O)C1 ZINC000850515575 1123278690 /nfs/dbraw/zinc/27/86/90/1123278690.db2.gz YYHHPDNHMSKDQC-BPLDGKMQSA-N 1 0 285.387 3.764 20 10 CHCDRO CCO[C@H]1C[C@H]([NH2+][C@H](CC)c2cc(Cl)ccc2O)C1 ZINC000850515531 1123278879 /nfs/dbraw/zinc/27/88/79/1123278879.db2.gz YBLKXNMEQURLDY-YRGRVCCFSA-N 1 0 283.799 3.654 20 10 CHCDRO C[C@H]([NH2+][C@@H]1Cc2ccccc2[C@@H]1C)c1ccccc1O ZINC000850518336 1123279139 /nfs/dbraw/zinc/27/91/39/1123279139.db2.gz OWUJENHAVNFCKJ-GDZNZVCISA-N 1 0 267.372 3.771 20 10 CHCDRO C[C@H]([NH2+][C@H]1COC2(CCC2)C1)c1ccc2ccccc2c1O ZINC000850525079 1123281169 /nfs/dbraw/zinc/28/11/69/1123281169.db2.gz KYGCOUWPAYIGCM-DZGCQCFKSA-N 1 0 297.398 3.908 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2C[C@@H](O)c3ccccc32)c(O)c1 ZINC000850526969 1123282312 /nfs/dbraw/zinc/28/23/12/1123282312.db2.gz DHKSXDYRNMWKJG-ULFGMLNVSA-N 1 0 283.371 3.530 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H]2CCC[C@@H](C)O2)c(O)c1 ZINC000850534424 1123286011 /nfs/dbraw/zinc/28/60/11/1123286011.db2.gz JIMDWRPREUHKOV-ILXRZTDVSA-N 1 0 277.408 3.617 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCC[C@@H](C)O1)c1cc(Cl)ccc1O ZINC000850535313 1123286969 /nfs/dbraw/zinc/28/69/69/1123286969.db2.gz UWDPDLVNEVRBLC-WZRBSPASSA-N 1 0 283.799 3.654 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@]1(C)CC1(F)F)c1ccc(C)cc1O ZINC000850535731 1123287107 /nfs/dbraw/zinc/28/71/07/1123287107.db2.gz AFBAEYWOHQXQPY-TZMCWYRMSA-N 1 0 269.335 3.787 20 10 CHCDRO C[C@@H]([NH2+]C[C@@]1(C)CC1(F)F)c1cc2c(cc1O)CCCC2 ZINC000850536624 1123287385 /nfs/dbraw/zinc/28/73/85/1123287385.db2.gz MCSXFIKLQBGFPJ-BDJLRTHQSA-N 1 0 295.373 3.967 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CC[C@]2(C)CC2(F)F)c1 ZINC000850537579 1123287735 /nfs/dbraw/zinc/28/77/35/1123287735.db2.gz WBXRGXRTVIHKFM-BXUZGUMPSA-N 1 0 269.335 3.787 20 10 CHCDRO C[C@H]([NH2+]CC[C@@]1(C)CC1(F)F)c1cc(F)ccc1O ZINC000850537676 1123288358 /nfs/dbraw/zinc/28/83/58/1123288358.db2.gz WYNBJRCTVCRKBD-ZANVPECISA-N 1 0 273.298 3.617 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCc2ccc(O)cc21)c1cc(F)ccc1O ZINC000850543410 1123288842 /nfs/dbraw/zinc/28/88/42/1123288842.db2.gz JDBCWIMBXZHERL-QLJPJBMISA-N 1 0 287.334 3.575 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CCc2ccc(O)cc21)c1ccccc1O ZINC000850543762 1123289028 /nfs/dbraw/zinc/28/90/28/1123289028.db2.gz PNLHBYGTCDTURU-SJORKVTESA-N 1 0 283.371 3.826 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]C1CCC3(CC3(F)F)CC1)CC2 ZINC000850549356 1123289316 /nfs/dbraw/zinc/28/93/16/1123289316.db2.gz GBSNDZOHNMCLPN-MFOWVQHXSA-N 1 0 293.357 3.937 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+]C[C@@H]2C(C)(C)C2(F)F)c2c1c(F)ccc2O ZINC000850552674 1123290002 /nfs/dbraw/zinc/29/00/02/1123290002.db2.gz PJDRAUJCGFZEMJ-UBHAPETDSA-N 1 0 299.336 3.961 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H]2C(C)(C)C2(F)F)c(O)c1 ZINC000850552824 1123290102 /nfs/dbraw/zinc/29/01/02/1123290102.db2.gz QBTWUZDTDQGWNK-DGCLKSJQSA-N 1 0 283.362 3.951 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCCc2ccco2)c(O)c1C ZINC000850570541 1123294291 /nfs/dbraw/zinc/29/42/91/1123294291.db2.gz VSBBEOPVGXLXEM-CQSZACIVSA-N 1 0 273.376 3.885 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCCc2ccco2)c1 ZINC000850569685 1123294387 /nfs/dbraw/zinc/29/43/87/1123294387.db2.gz MKJWVCCGHFOULI-ZDUSSCGKSA-N 1 0 259.349 3.577 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+]CCCc2ccco2)c2c1c(F)ccc2O ZINC000850570553 1123294524 /nfs/dbraw/zinc/29/45/24/1123294524.db2.gz WDXUNHXUMDJPEC-RISCZKNCSA-N 1 0 289.350 3.895 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cccc(OC)c1C)c1ccccc1O ZINC000850578323 1123296274 /nfs/dbraw/zinc/29/62/74/1123296274.db2.gz KRRBSCUJQTVYHW-MRXNPFEDSA-N 1 0 285.387 3.950 20 10 CHCDRO CSC1(C[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)CC1 ZINC000193821110 1129115430 /nfs/dbraw/zinc/11/54/30/1129115430.db2.gz LWEPPUSAACMWEJ-LBPRGKRZSA-N 1 0 291.460 3.817 20 10 CHCDRO C[C@H](c1cc(F)ccc1F)[N@H+](C)Cc1ccccc1O ZINC000111236017 1123432414 /nfs/dbraw/zinc/43/24/14/1123432414.db2.gz VAVIKVXSYZLKAC-LLVKDONJSA-N 1 0 277.314 3.863 20 10 CHCDRO CC[N@@H+](Cc1cc(C(C)(C)C)cc(O)c1O)CC1CC1 ZINC000112200273 1123483751 /nfs/dbraw/zinc/48/37/51/1123483751.db2.gz WSEGTGKTDNNDBT-UHFFFAOYSA-N 1 0 277.408 3.627 20 10 CHCDRO Cc1ccc(C[NH2+]C[C@@]2(C)CCOC3(CCC3)C2)c(O)c1 ZINC000895824427 1123518730 /nfs/dbraw/zinc/51/87/30/1123518730.db2.gz YVGRBCWSEPQAFE-KRWDZBQOSA-N 1 0 289.419 3.530 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1O)[C@@H]1COc2ccccc2C1 ZINC000895851045 1123521444 /nfs/dbraw/zinc/52/14/44/1123521444.db2.gz IIJUPZQVTPKIFR-YCPHGPKFSA-N 1 0 297.398 3.683 20 10 CHCDRO CC(C)Cc1ccc(C[NH2+][C@@H](C)c2ccccc2O)cn1 ZINC000895850991 1123521850 /nfs/dbraw/zinc/52/18/50/1123521850.db2.gz HVNCWPDMDQCNDC-AWEZNQCLSA-N 1 0 284.403 3.837 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C[C@@H]2CCc3ccccc32)c1 ZINC000113340934 1123521817 /nfs/dbraw/zinc/52/18/17/1123521817.db2.gz ALPLYARYPBPHAQ-HNNXBMFYSA-N 1 0 267.372 3.520 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H](C)C2(C)CC2)cc1 ZINC000776882974 1123559225 /nfs/dbraw/zinc/55/92/25/1123559225.db2.gz LJBILOKLEJJSST-ZIAGYGMSSA-N 1 0 260.425 3.982 20 10 CHCDRO FC1(F)C[C@@H]1CC[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000856804333 1123568812 /nfs/dbraw/zinc/56/88/12/1123568812.db2.gz SYSQHWOHPZGTIO-HNNXBMFYSA-N 1 0 294.389 3.812 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC[C@@H]2CC2(F)F)c(O)c1C ZINC000857080587 1123584706 /nfs/dbraw/zinc/58/47/06/1123584706.db2.gz IWLLKJUIVFJUSM-VXGBXAGGSA-N 1 0 269.335 3.705 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CC[C@H]2CC2(Cl)Cl)c1 ZINC000857081608 1123585628 /nfs/dbraw/zinc/58/56/28/1123585628.db2.gz HDYZMGXXDVSLLZ-MNOVXSKESA-N 1 0 288.218 3.935 20 10 CHCDRO CC(C)C[C@@H]1C[C@H]([NH2+]Cc2cc(Cl)ccc2O)CCO1 ZINC000776951624 1123612558 /nfs/dbraw/zinc/61/25/58/1123612558.db2.gz XRQKULFJMKHMPA-HUUCEWRRSA-N 1 0 297.826 3.729 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2ccccc2C2CC2)c1 ZINC000858238107 1123639466 /nfs/dbraw/zinc/63/94/66/1123639466.db2.gz UWOMFDLYMMCSBV-UHFFFAOYSA-N 1 0 267.372 3.868 20 10 CHCDRO Cc1cccnc1[C@H]1CCC[C@H]([NH2+]Cc2ccccc2O)C1 ZINC000281126582 1123683018 /nfs/dbraw/zinc/68/30/18/1123683018.db2.gz DPNDKZATHHMAKY-RDJZCZTQSA-N 1 0 296.414 3.912 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C2(C3CC3)CC2)cc1 ZINC000777149444 1123747404 /nfs/dbraw/zinc/74/74/04/1123747404.db2.gz NPOGKINLQORJNS-ZDUSSCGKSA-N 1 0 258.409 3.736 20 10 CHCDRO Cc1ncc(CN(C)Cc2ccc(N3CCCCC3)cc2)o1 ZINC000862210731 1123792161 /nfs/dbraw/zinc/79/21/61/1123792161.db2.gz UQIBMLOTLSHFNF-UHFFFAOYSA-N 1 0 299.418 3.605 20 10 CHCDRO Oc1c(C[NH2+][C@@H]2CC[C@H]3C[C@H]3C2)ccc2ccccc21 ZINC000862439107 1123810334 /nfs/dbraw/zinc/81/03/34/1123810334.db2.gz HZWNLSXJHVGUSP-CWRNSKLLSA-N 1 0 267.372 3.824 20 10 CHCDRO COC1CCC([NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)CC1 ZINC000840793400 1123811098 /nfs/dbraw/zinc/81/10/98/1123811098.db2.gz ZOOQBBCIBGBOCJ-BBCYWQGDSA-N 1 0 293.382 3.627 20 10 CHCDRO CC[C@@H](Cc1cccs1)[NH2+]Cc1cc(C)ccc1O ZINC000862476128 1123812631 /nfs/dbraw/zinc/81/26/31/1123812631.db2.gz JVUVQMKJNLQEAX-AWEZNQCLSA-N 1 0 275.417 3.873 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H]2CS[C@H](C(C)(C)C)C2)c1 ZINC000862478481 1123813003 /nfs/dbraw/zinc/81/30/03/1123813003.db2.gz HYWJDXHLJJPRMC-ZFWWWQNUSA-N 1 0 279.449 3.710 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2CC[C@H]3CC[C@@H](C2)S3)c1O ZINC000862473087 1123813438 /nfs/dbraw/zinc/81/34/38/1123813438.db2.gz DQZBQPSJTHMLEX-KGLIPLIRSA-N 1 0 297.851 3.824 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H](C)c2ccns2)cc1Cl ZINC000862539192 1123818554 /nfs/dbraw/zinc/81/85/54/1123818554.db2.gz JBSBBIKWVKDQLT-SECBINFHSA-N 1 0 282.796 3.661 20 10 CHCDRO CC1(C[NH2+]Cc2c(O)cccc2Cl)CCCC1 ZINC000083552519 1129151021 /nfs/dbraw/zinc/15/10/21/1129151021.db2.gz JXZVNHSRRWPZGS-UHFFFAOYSA-N 1 0 253.773 3.716 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@H+]2CC[C@H](C(F)(F)F)[C@@H]2C)c1 ZINC000794654504 1123925494 /nfs/dbraw/zinc/92/54/94/1123925494.db2.gz CSDUHSSWUPNHKO-AAEUAGOBSA-N 1 0 287.325 3.782 20 10 CHCDRO CC[C@@H]([NH2+]CCN(C)c1ccccc1)c1ccc(C)cc1O ZINC000794790936 1123949111 /nfs/dbraw/zinc/94/91/11/1123949111.db2.gz GKORLCDGVHPGCS-GOSISDBHSA-N 1 0 298.430 3.878 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccccc1OC)c1ccc(C)cc1O ZINC000794796939 1123949354 /nfs/dbraw/zinc/94/93/54/1123949354.db2.gz WBLFWSHTOQTVBK-QGZVFWFLSA-N 1 0 299.414 3.993 20 10 CHCDRO CC[C@@H](C[NH2+][C@@H](CC)c1ccc(C)cc1O)N1CCCC1 ZINC000794797030 1123949777 /nfs/dbraw/zinc/94/97/77/1123949777.db2.gz LPKLNEDHEKQQBB-RDJZCZTQSA-N 1 0 290.451 3.616 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](CC(C)C)N(C)C)c1ccc(C)cc1O ZINC000794798556 1123949869 /nfs/dbraw/zinc/94/98/69/1123949869.db2.gz WFRPMZBNQDXAGW-NVXWUHKLSA-N 1 0 292.467 3.718 20 10 CHCDRO CC[C@H]([NH2+]CCC(F)(F)F)c1ccc(C)cc1O ZINC000794812564 1123958934 /nfs/dbraw/zinc/95/89/34/1123958934.db2.gz XFOIDRJLYNCUEZ-NSHDSACASA-N 1 0 261.287 3.694 20 10 CHCDRO CC[C@H]([NH2+]CC1([C@@H](O)C(C)C)CC1)c1ccc(C)cc1O ZINC000794817109 1123959815 /nfs/dbraw/zinc/95/98/15/1123959815.db2.gz MYHXOYXZTZMCPZ-RDJZCZTQSA-N 1 0 291.435 3.538 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](C)N(CC)CC)c1ccc(N(C)C)cc1 ZINC000794828502 1123962349 /nfs/dbraw/zinc/96/23/49/1123962349.db2.gz BLPGRWKXCXUURD-QAPCUYQASA-N 1 0 291.483 3.524 20 10 CHCDRO Cc1cc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2)oc1C ZINC000282005959 1124008884 /nfs/dbraw/zinc/00/88/84/1124008884.db2.gz DGEFPBHDAQJRTA-ZDUSSCGKSA-N 1 0 272.392 3.813 20 10 CHCDRO COc1cccc(O)c1C[NH2+]Cc1ccc(C(C)(C)C)o1 ZINC000865813976 1124016106 /nfs/dbraw/zinc/01/61/06/1124016106.db2.gz DDGBPGXTTQSHQC-UHFFFAOYSA-N 1 0 289.375 3.581 20 10 CHCDRO C[C@H]1C[C@H]([NH2+]Cc2ccc3ccccc3c2O)CS1 ZINC000840958944 1124041623 /nfs/dbraw/zinc/04/16/23/1124041623.db2.gz POTYWRHVJNRHKI-FZMZJTMJSA-N 1 0 273.401 3.529 20 10 CHCDRO CC[C@H]([NH2+]CC[C@H]1CCSC1)c1ccc(C)cc1O ZINC000866401598 1124062666 /nfs/dbraw/zinc/06/26/66/1124062666.db2.gz BEDWOIYKYSKALX-ZFWWWQNUSA-N 1 0 279.449 3.885 20 10 CHCDRO C[C@H]([NH2+]CC(C)(C)F)c1ccc2ccccc2c1O ZINC000866408153 1124063552 /nfs/dbraw/zinc/06/35/52/1124063552.db2.gz HACXBEAUGVYMSO-NSHDSACASA-N 1 0 261.340 3.944 20 10 CHCDRO Cc1ncc([C@@H](C)[NH2+][C@H](C)c2cc(C)ccc2O)s1 ZINC000866455695 1124068187 /nfs/dbraw/zinc/06/81/87/1124068187.db2.gz OSXLWHWPFACPCH-GHMZBOCLSA-N 1 0 276.405 3.877 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2cnc(C)s2)c1 ZINC000866456499 1124069054 /nfs/dbraw/zinc/06/90/54/1124069054.db2.gz ZUPUHXMVGRKISH-ZJUUUORDSA-N 1 0 292.404 3.578 20 10 CHCDRO C[C@@H]([NH2+]CC1([C@@H]2CCCCO2)CCC1)c1ccccc1O ZINC000866480624 1124070868 /nfs/dbraw/zinc/07/08/68/1124070868.db2.gz GNJYAKDBQHCUQL-PBHICJAKSA-N 1 0 289.419 3.782 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1C[C@H]1C(F)(F)F)c1cc(Cl)ccc1O ZINC000866498876 1124073592 /nfs/dbraw/zinc/07/35/92/1124073592.db2.gz BXQFZEIBLLRVJQ-BDODKLCJSA-N 1 0 279.689 3.647 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1ccccc1O ZINC000121102538 1124077475 /nfs/dbraw/zinc/07/74/75/1124077475.db2.gz QKOOMTJWGAKXIS-KRWDZBQOSA-N 1 0 299.418 3.945 20 10 CHCDRO CC[C@H]([NH2+]C1([C@H]2CCCCO2)CCC1)c1ccccc1O ZINC000866622787 1124091395 /nfs/dbraw/zinc/09/13/95/1124091395.db2.gz JBUFCHGMBOALLB-DOTOQJQBSA-N 1 0 289.419 3.925 20 10 CHCDRO CC[C@H](C[C@@H](C)O)[NH2+][C@H](C)c1cc(Cl)cc(C)c1O ZINC000866632682 1124091823 /nfs/dbraw/zinc/09/18/23/1124091823.db2.gz BDAJYNPXXVYDTC-NQBHXWOUSA-N 1 0 285.815 3.554 20 10 CHCDRO CC[C@H](C[C@@H](C)O)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000866635052 1124093194 /nfs/dbraw/zinc/09/31/94/1124093194.db2.gz MHYZCLYWMPPIED-VNHYZAJKSA-N 1 0 287.403 3.746 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CCC2(CCC2)C1 ZINC000121919074 1124105481 /nfs/dbraw/zinc/10/54/81/1124105481.db2.gz BPOZZMFWSQSFLZ-UHFFFAOYSA-N 1 0 267.372 3.921 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]C2CCC=CCC2)c1 ZINC000718083055 1129170788 /nfs/dbraw/zinc/17/07/88/1129170788.db2.gz PRQSAMMDMXZZNZ-LBPRGKRZSA-N 1 0 261.365 3.550 20 10 CHCDRO Oc1ccccc1C[NH2+]Cc1ccccc1C1CC1 ZINC000121992649 1124455487 /nfs/dbraw/zinc/45/54/87/1124455487.db2.gz HOAGGJNUXYSKFT-UHFFFAOYSA-N 1 0 253.345 3.559 20 10 CHCDRO CC(C)CCC[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1 ZINC000122130018 1124468642 /nfs/dbraw/zinc/46/86/42/1124468642.db2.gz KGUCMADHNPCWHI-INIZCTEOSA-N 1 0 290.451 3.610 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H]2C[C@@H]3CCC[C@H]3O2)c(O)c1 ZINC000872106854 1124684955 /nfs/dbraw/zinc/68/49/55/1124684955.db2.gz IKRHMVKEMNOEDC-QBYUYEEZSA-N 1 0 289.419 3.617 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2ncc(Cl)s2)c(O)c1 ZINC000872113731 1124687471 /nfs/dbraw/zinc/68/74/71/1124687471.db2.gz RXOXXSJKKOTEGV-JTQLQIEISA-N 1 0 296.823 3.970 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1nccnc1C)c1ccc(C)cc1O ZINC000872135107 1124693749 /nfs/dbraw/zinc/69/37/49/1124693749.db2.gz VFTHQEHJUVCDNG-UKRRQHHQSA-N 1 0 285.391 3.601 20 10 CHCDRO CSC1CC[NH+](Cc2c(O)ccc3ccccc32)CC1 ZINC000872627911 1124723390 /nfs/dbraw/zinc/72/33/90/1124723390.db2.gz WTTRTTIJIGCABW-UHFFFAOYSA-N 1 0 287.428 3.873 20 10 CHCDRO CCCOc1ccc(C[NH2+]Cc2ccc(F)cn2)cc1C ZINC000873080674 1124736354 /nfs/dbraw/zinc/73/63/54/1124736354.db2.gz RKCUJZGIHQQAFV-UHFFFAOYSA-N 1 0 288.366 3.608 20 10 CHCDRO CCCOc1ccc(C[NH2+]CCCC2(O)CCC2)cc1C ZINC000873132178 1124739766 /nfs/dbraw/zinc/73/97/66/1124739766.db2.gz KJVZBGHCDDEWFO-UHFFFAOYSA-N 1 0 291.435 3.569 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]CCC2=CCCCC2)c1 ZINC000020093708 1124804720 /nfs/dbraw/zinc/80/47/20/1124804720.db2.gz UJXIEZZLHCAQOB-ZDUSSCGKSA-N 1 0 275.392 3.942 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@H](C)CCc2ccccc2)c1 ZINC000020138566 1124808394 /nfs/dbraw/zinc/80/83/94/1124808394.db2.gz LGPAZZBRGIKVFA-CQSZACIVSA-N 1 0 285.387 3.512 20 10 CHCDRO COc1cc(C[N@H+](C)[C@H](C)C2CC2)c(O)c(C(C)(C)C)c1 ZINC000874090095 1124817655 /nfs/dbraw/zinc/81/76/55/1124817655.db2.gz OPOGDIXDMRYXCH-GFCCVEGCSA-N 1 0 291.435 3.929 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C2(c3ccccc3)CCC2)cc1 ZINC000125968611 1124955536 /nfs/dbraw/zinc/95/55/36/1124955536.db2.gz VNTVZIYCNNLCBO-UHFFFAOYSA-N 1 0 280.415 3.922 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)CCC[C@H]2CCO2)cc1 ZINC000876550871 1124958432 /nfs/dbraw/zinc/95/84/32/1124958432.db2.gz FDODVEVPIOFNJC-SFHVURJKSA-N 1 0 290.451 3.534 20 10 CHCDRO Cc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(O)cc2)c(O)c1 ZINC000876637038 1124965381 /nfs/dbraw/zinc/96/53/81/1124965381.db2.gz PANJZIYPPAOXKI-KRWDZBQOSA-N 1 0 283.371 3.743 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(C)cc1O)c1ccc(OC)cc1 ZINC000876883701 1124986887 /nfs/dbraw/zinc/98/68/87/1124986887.db2.gz FVZWOGMJCOCMHJ-KRWDZBQOSA-N 1 0 285.387 3.950 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]Cc1ccc(OC(F)F)cc1 ZINC000876883729 1124987233 /nfs/dbraw/zinc/98/72/33/1124987233.db2.gz GMIXJTIXAKWLPT-UHFFFAOYSA-N 1 0 293.313 3.592 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2F)c(O)c1 ZINC000876905834 1124988256 /nfs/dbraw/zinc/98/82/56/1124988256.db2.gz LKNOQFQEIHBLEG-NSHDSACASA-N 1 0 277.314 3.830 20 10 CHCDRO CCOCc1ccccc1C[NH2+]Cc1ccc(C)cc1O ZINC000876915230 1124990208 /nfs/dbraw/zinc/99/02/08/1124990208.db2.gz NVBSPOYOFGZBQV-UHFFFAOYSA-N 1 0 285.387 3.527 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2ccc([C@@H]3C[C@H]3C)o2)c(O)c1 ZINC000876946428 1124991145 /nfs/dbraw/zinc/99/11/45/1124991145.db2.gz QYMUWTZBQIPMTM-IUODEOHRSA-N 1 0 271.360 3.707 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)Cc2ccc(O)cc2)cc1Cl ZINC000825927892 1124994982 /nfs/dbraw/zinc/99/49/82/1124994982.db2.gz JJWHCZPRZGRREG-UHFFFAOYSA-N 1 0 291.778 3.692 20 10 CHCDRO CCC[C@H]([NH2+]Cc1ccc(C)cc1O)c1ccccn1 ZINC000877013637 1124997748 /nfs/dbraw/zinc/99/77/48/1124997748.db2.gz UPBAYSJOCCNGIW-HNNXBMFYSA-N 1 0 270.376 3.727 20 10 CHCDRO CC[C@](C)([NH2+]Cc1ccc(C)cc1O)c1nccs1 ZINC000877048958 1125004232 /nfs/dbraw/zinc/00/42/32/1125004232.db2.gz QOZQTWKPGMKGSO-HNNXBMFYSA-N 1 0 276.405 3.572 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H]2CCOC3(CCCCC3)C2)c(O)c1 ZINC000877087648 1125008308 /nfs/dbraw/zinc/00/83/08/1125008308.db2.gz OIQJQSAEGBHYHD-MRXNPFEDSA-N 1 0 289.419 3.672 20 10 CHCDRO Cc1cccc(O)c1C[NH2+][C@H]1CCCc2cn(C(C)C)nc21 ZINC000877376440 1125024692 /nfs/dbraw/zinc/02/46/92/1125024692.db2.gz SMFBNEUSTHUTRD-INIZCTEOSA-N 1 0 299.418 3.645 20 10 CHCDRO Cc1ccc(C[NH2+]CCC2CC(OC(C)(C)C)C2)c(O)c1 ZINC000877479964 1125033220 /nfs/dbraw/zinc/03/32/20/1125033220.db2.gz ZENQYTDQJHDOJM-UHFFFAOYSA-N 1 0 291.435 3.774 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]C[C@H]1CSc2ccccc21 ZINC000877557518 1125043982 /nfs/dbraw/zinc/04/39/82/1125043982.db2.gz NFKGFTPGYVHLBW-ZDUSSCGKSA-N 1 0 285.412 3.680 20 10 CHCDRO CC[C@H](C[NH2+]Cc1ccc(C)cc1O)CC(F)(F)F ZINC000877589456 1125050155 /nfs/dbraw/zinc/05/01/55/1125050155.db2.gz NOULABBIQBCXBU-NSHDSACASA-N 1 0 275.314 3.769 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000877595196 1125051931 /nfs/dbraw/zinc/05/19/31/1125051931.db2.gz UVZHDGNDARDRDN-GFCCVEGCSA-N 1 0 287.325 3.865 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(C(F)F)nc1)c1ccccc1O ZINC000877755915 1125072491 /nfs/dbraw/zinc/07/24/91/1125072491.db2.gz SLZJKSNACLCVPF-SNVBAGLBSA-N 1 0 278.302 3.576 20 10 CHCDRO CCO[P@](C)(=O)CC[C@@H](C)[NH2+][C@@H](C)c1ccccc1O ZINC000877758324 1125075206 /nfs/dbraw/zinc/07/52/06/1125075206.db2.gz SVSVRXSGVQCLMY-UVARLRKDSA-N 1 0 299.351 3.766 20 10 CHCDRO CSC(C)(C)CC[NH2+][C@@H](C)c1ccccc1O ZINC000877758392 1125075639 /nfs/dbraw/zinc/07/56/39/1125075639.db2.gz XVTGEGHQFRGJLF-NSHDSACASA-N 1 0 253.411 3.575 20 10 CHCDRO CC(=O)C[N@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000878325835 1125142116 /nfs/dbraw/zinc/14/21/16/1125142116.db2.gz MHFDOGSVRDREFA-OAHLLOKOSA-N 1 0 283.371 3.544 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@H]2CCCC2(F)F)cc1Cl ZINC000826061867 1125167274 /nfs/dbraw/zinc/16/72/74/1125167274.db2.gz FAQJAVXXQNCMMZ-LLVKDONJSA-N 1 0 289.753 3.879 20 10 CHCDRO C[C@@H]([NH2+]CCCc1ccsc1)c1ccccc1O ZINC000879649328 1125223313 /nfs/dbraw/zinc/22/33/13/1125223313.db2.gz NNYHSMIWRMPGJC-GFCCVEGCSA-N 1 0 261.390 3.737 20 10 CHCDRO CC[C@H](C[NH2+][C@H](C)c1ccccc1O)CC(F)F ZINC000879650181 1125224231 /nfs/dbraw/zinc/22/42/31/1125224231.db2.gz NJOOWTNSLUIKRK-MNOVXSKESA-N 1 0 257.324 3.724 20 10 CHCDRO CO[C@@](C)([C@@H](C)[NH2+]Cc1cc(Cl)c(C)cc1O)C1CC1 ZINC000826120894 1125225316 /nfs/dbraw/zinc/22/53/16/1125225316.db2.gz LAHXFNZIENBLQA-BZNIZROVSA-N 1 0 297.826 3.647 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)Cc1cccc2cccnc21 ZINC001137178070 1125345571 /nfs/dbraw/zinc/34/55/71/1125345571.db2.gz QLUGQHPQKUKDDF-UHFFFAOYSA-N 1 0 292.382 3.963 20 10 CHCDRO Cc1ccc(O)c(C[N@H+](C)Cc2ccc(F)c(F)c2)c1 ZINC000130468138 1125361464 /nfs/dbraw/zinc/36/14/64/1125361464.db2.gz NICPCXVEELGITH-UHFFFAOYSA-N 1 0 277.314 3.611 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CCCCSC)cc1 ZINC000130491214 1125362553 /nfs/dbraw/zinc/36/25/53/1125362553.db2.gz DRQUZBPJWVGZAK-UHFFFAOYSA-N 1 0 280.481 3.766 20 10 CHCDRO C[N@H+](Cc1ccc(N2CCCCC2)cc1)[C@H]1CCSC1 ZINC000130498088 1125362756 /nfs/dbraw/zinc/36/27/56/1125362756.db2.gz OPEAPTLKVNFOOU-KRWDZBQOSA-N 1 0 290.476 3.614 20 10 CHCDRO CC(C)(C[NH2+]Cc1c(O)cccc1Cl)CC(F)F ZINC000883252164 1125385328 /nfs/dbraw/zinc/38/53/28/1125385328.db2.gz VBFBCBGQLNRFPE-UHFFFAOYSA-N 1 0 277.742 3.817 20 10 CHCDRO CC(C)(C[NH2+][C@H]1CCc2cccc(O)c21)CC(F)F ZINC000883259888 1125387156 /nfs/dbraw/zinc/38/71/56/1125387156.db2.gz CFIKRHHGPCJDJK-NSHDSACASA-N 1 0 269.335 3.651 20 10 CHCDRO CCOc1cccc(C[NH2+]CC[C@H]2CCCC2(F)F)c1O ZINC000883267017 1125389087 /nfs/dbraw/zinc/38/90/87/1125389087.db2.gz QOXINASCFCCOMK-CYBMUJFWSA-N 1 0 299.361 3.706 20 10 CHCDRO Cc1cc(O)c(C[NH2+]Cc2cc(O)ccc2Cl)cc1C ZINC000883324916 1125396891 /nfs/dbraw/zinc/39/68/91/1125396891.db2.gz ITLZGBORSKAGRO-UHFFFAOYSA-N 1 0 291.778 3.658 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2cc(O)ccc2Cl)c1 ZINC000883326192 1125397102 /nfs/dbraw/zinc/39/71/02/1125397102.db2.gz VDLBGXXUYWGEPV-LLVKDONJSA-N 1 0 291.778 3.910 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCC2(CCC2)O1)c1ccc(Cl)cc1O ZINC000883357466 1125401196 /nfs/dbraw/zinc/40/11/96/1125401196.db2.gz LYMJEQPSAJQNRW-AAEUAGOBSA-N 1 0 295.810 3.798 20 10 CHCDRO CC[C@H](CSC)[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2C ZINC000168863849 1125416368 /nfs/dbraw/zinc/41/63/68/1125416368.db2.gz PKYKKUPNVHNHAU-XQQFMLRXSA-N 1 0 279.449 3.980 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2scnc2C)cc1 ZINC000132366289 1125417457 /nfs/dbraw/zinc/41/74/57/1125417457.db2.gz VOGKRIYZDAIPOO-GFCCVEGCSA-N 1 0 289.448 3.758 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCCC23CCOCC3)c(O)c1 ZINC000282855487 1125446325 /nfs/dbraw/zinc/44/63/25/1125446325.db2.gz UJDROZVKIQLNKS-YOEHRIQHSA-N 1 0 289.419 3.701 20 10 CHCDRO C[C@@H](CCCCO)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000296604035 1129223334 /nfs/dbraw/zinc/22/33/34/1129223334.db2.gz VVSZALOXXDCXEV-KBPBESRZSA-N 1 0 287.403 3.747 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccccc1COC)c1ccccc1O ZINC000037762632 1129266307 /nfs/dbraw/zinc/26/63/07/1129266307.db2.gz ACCJYCABULBEAM-QGZVFWFLSA-N 1 0 285.387 3.780 20 10 CHCDRO Cc1ccccc1C[C@H](C)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000037777186 1129268869 /nfs/dbraw/zinc/26/88/69/1129268869.db2.gz FIICRXHHKMDPQI-HNNXBMFYSA-N 1 0 281.399 3.651 20 10 CHCDRO COc1ccccc1C[C@@H](C)[NH2+][C@H](C)c1ccccc1O ZINC000037778494 1129268951 /nfs/dbraw/zinc/26/89/51/1129268951.db2.gz GZXMEGGQOASMSX-ZIAGYGMSSA-N 1 0 285.387 3.683 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](C)CC(C)(C)OC)cc1 ZINC000766191216 1129282175 /nfs/dbraw/zinc/28/21/75/1129282175.db2.gz LKRZQCCFBDJITF-GJZGRUSLSA-N 1 0 292.467 3.997 20 10 CHCDRO C[C@@H](C[NH2+]Cc1ccc(N(C)C)c(F)c1)C(C)(C)C ZINC000734509824 1129310534 /nfs/dbraw/zinc/31/05/34/1129310534.db2.gz MGHJDSQWWMUPQN-LBPRGKRZSA-N 1 0 266.404 3.664 20 10 CHCDRO C[C@H](NCc1ncc(Cl)s1)c1ccc(N(C)C)cc1 ZINC000719428236 1129332670 /nfs/dbraw/zinc/33/26/70/1129332670.db2.gz BZDKXWKDWJVDSH-JTQLQIEISA-N 1 0 295.839 3.713 20 10 CHCDRO CC1(C[NH2+]Cc2ccc(N3CCSCC3)cc2)CCC1 ZINC000766213770 1129339552 /nfs/dbraw/zinc/33/95/52/1129339552.db2.gz JWRYZKIKNWDMKM-UHFFFAOYSA-N 1 0 290.476 3.520 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+][C@@H]1CSc2ccccc21 ZINC000735508587 1129348675 /nfs/dbraw/zinc/34/86/75/1129348675.db2.gz GQGZCVNKZZSCDU-CYBMUJFWSA-N 1 0 291.803 3.982 20 10 CHCDRO C[C@H]1SCC[N@H+](Cc2c(O)ccc3ccccc32)[C@@H]1C ZINC000735668128 1129356358 /nfs/dbraw/zinc/35/63/58/1129356358.db2.gz POLZXCWPNSQWGK-CHWSQXEVSA-N 1 0 287.428 3.871 20 10 CHCDRO CC[N@H+](Cc1cc(C)ccc1O)[C@H](C)c1cccc(O)c1 ZINC000091975241 1129376049 /nfs/dbraw/zinc/37/60/49/1129376049.db2.gz PGBWCQVGPKGWCV-CQSZACIVSA-N 1 0 285.387 3.989 20 10 CHCDRO COc1cccc(C[NH2+]C[C@@H]2CCC[C@H](C)[C@H]2C)c1O ZINC000795588907 1129378373 /nfs/dbraw/zinc/37/83/73/1129378373.db2.gz QOELZYHBXBSQKR-MJBXVCDLSA-N 1 0 277.408 3.563 20 10 CHCDRO CC[N@H+](CCC(F)(F)F)Cc1cc(Cl)ccc1O ZINC000092753755 1129405928 /nfs/dbraw/zinc/40/59/28/1129405928.db2.gz RRINFGBIROHCGE-UHFFFAOYSA-N 1 0 281.705 3.820 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CC=CCC2)cc1F ZINC000740006282 1129408633 /nfs/dbraw/zinc/40/86/33/1129408633.db2.gz JJQOEAQIAOKLGS-OAHLLOKOSA-N 1 0 276.399 3.870 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C(C)(C)CC)cc1F ZINC000740004562 1129409109 /nfs/dbraw/zinc/40/91/09/1129409109.db2.gz QQKBLZBEMHMHLG-UHFFFAOYSA-N 1 0 266.404 3.950 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2[C@@H]3Cc4ccccc4[C@H]23)c1 ZINC000248489120 1129419221 /nfs/dbraw/zinc/41/92/21/1129419221.db2.gz HFPGCDOMSXEOKJ-NTCOEUGSSA-N 1 0 293.410 3.937 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCC[C@@H](O)C1)c1ccc2ccccc2c1O ZINC000248487976 1129419340 /nfs/dbraw/zinc/41/93/40/1129419340.db2.gz GLQRBBFBPZODTN-OFQRWUPVSA-N 1 0 299.414 3.747 20 10 CHCDRO C[C@@H]1C[C@@H](C)[N@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C1 ZINC000740860284 1129421206 /nfs/dbraw/zinc/42/12/06/1129421206.db2.gz CMXMZNZOJUXAMD-VXGBXAGGSA-N 1 0 277.408 3.626 20 10 CHCDRO CCS[C@@H]1CC[C@@H]([N@H+](C)Cc2cc(C)ccc2O)C1 ZINC000093868899 1129428622 /nfs/dbraw/zinc/42/86/22/1129428622.db2.gz PTYRMXCXPXMXPZ-HUUCEWRRSA-N 1 0 279.449 3.807 20 10 CHCDRO CN(C)c1ccc(C[NH2+]Cc2ccc(C3CC3)cc2)cc1 ZINC000094518117 1129446741 /nfs/dbraw/zinc/44/67/41/1129446741.db2.gz GAJVSZUHHYQSRQ-UHFFFAOYSA-N 1 0 280.415 3.920 20 10 CHCDRO Cc1csc([C@@H](C)[NH2+][C@@H](C)c2cc(F)ccc2O)n1 ZINC000094618313 1129448173 /nfs/dbraw/zinc/44/81/73/1129448173.db2.gz DIBZUVJEYXYVOX-VHSXEESVSA-N 1 0 280.368 3.708 20 10 CHCDRO Cc1csc([C@H](C)[NH2+][C@H](C)c2cc(F)ccc2O)n1 ZINC000094618316 1129448257 /nfs/dbraw/zinc/44/82/57/1129448257.db2.gz DIBZUVJEYXYVOX-ZJUUUORDSA-N 1 0 280.368 3.708 20 10 CHCDRO Cc1ccccc1CC[NH2+][C@H](C)c1cc(F)ccc1O ZINC000094618519 1129448352 /nfs/dbraw/zinc/44/83/52/1129448352.db2.gz FNKCFQDSZSJKMA-CYBMUJFWSA-N 1 0 273.351 3.733 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccccc1F)c1cc(F)ccc1O ZINC000094616650 1129448365 /nfs/dbraw/zinc/44/83/65/1129448365.db2.gz PRVXQHDIYYEHDM-LLVKDONJSA-N 1 0 277.314 3.564 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2Cc3ccccc3C[C@@H]2C)cc1C ZINC000742159870 1129468827 /nfs/dbraw/zinc/46/88/27/1129468827.db2.gz UHBSSGMTUMXIFP-HNNXBMFYSA-N 1 0 281.399 3.956 20 10 CHCDRO CCCCC[C@@H](CCC)[NH2+]CCc1cc(O)c(O)cc1O ZINC001258662246 1129468904 /nfs/dbraw/zinc/46/89/04/1129468904.db2.gz NVLVXEYEAZLAPB-CQSZACIVSA-N 1 0 295.423 3.685 20 10 CHCDRO Cc1cc(F)cc(C[N@@H+](C)Cc2ccc(N(C)C)cc2)c1 ZINC001143619467 1129471814 /nfs/dbraw/zinc/47/18/14/1129471814.db2.gz QSTCDOTZWMEEST-UHFFFAOYSA-N 1 0 286.394 3.832 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H]2CC[C@@H]3CCC[C@@H]3C2)c1 ZINC000742378343 1129476288 /nfs/dbraw/zinc/47/62/88/1129476288.db2.gz FJKFOLPTJVICCW-SQWLQELKSA-N 1 0 259.393 3.759 20 10 CHCDRO c1cc2cc(C[NH2+]Cc3ccc4c(c3)CCO4)ccc2o1 ZINC000796285424 1129514469 /nfs/dbraw/zinc/51/44/69/1129514469.db2.gz ZBAYZYAMCADZLD-UHFFFAOYSA-N 1 0 279.339 3.658 20 10 CHCDRO C[C@@H]1C[NH+](Cc2c(O)ccc3ccccc32)C[C@@H](C)S1 ZINC000743376954 1129523036 /nfs/dbraw/zinc/52/30/36/1129523036.db2.gz WKDGFBZJVFWRFP-CHWSQXEVSA-N 1 0 287.428 3.871 20 10 CHCDRO CCN(CC)c1ccc(C[NH+]2CC(CC(F)F)C2)cc1 ZINC000822521002 1131385129 /nfs/dbraw/zinc/38/51/29/1131385129.db2.gz VCTDJOPOCLHMBW-UHFFFAOYSA-N 1 0 282.378 3.620 20 10 CHCDRO Oc1ccccc1C[N@@H+](Cc1ccco1)CC1CCC1 ZINC000744398394 1129575239 /nfs/dbraw/zinc/57/52/39/1129575239.db2.gz QGKHOLHGZUHCCP-UHFFFAOYSA-N 1 0 271.360 3.788 20 10 CHCDRO CC[C@H]1C[N@H+](Cc2c(O)ccc3ccccc32)C[C@@H](C)O1 ZINC000252442487 1129576673 /nfs/dbraw/zinc/57/66/73/1129576673.db2.gz ACNKTYNDCMHGMV-HIFRSBDPSA-N 1 0 285.387 3.545 20 10 CHCDRO CC[C@@H]1C[C@@H](C)C[N@@H+]1Cc1cc2c(cc1O)CCC2 ZINC000744444604 1129577747 /nfs/dbraw/zinc/57/77/47/1129577747.db2.gz XQCDMCCTQKBEOF-MLGOLLRUSA-N 1 0 259.393 3.501 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C[C@@H]2SCCc3ccccc32)c1 ZINC000749300289 1129660313 /nfs/dbraw/zinc/66/03/13/1129660313.db2.gz YFJRBZFIJYBXGC-SFHVURJKSA-N 1 0 299.439 3.821 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1ccc(N(C)C)cc1)C1CCOCC1 ZINC000766387790 1129663776 /nfs/dbraw/zinc/66/37/76/1129663776.db2.gz HZSYELASHQEISW-RDTXWAMCSA-N 1 0 290.451 3.608 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](C)c1ccncc1)c1ccc(N(C)C)cc1 ZINC000766487765 1129669688 /nfs/dbraw/zinc/66/96/88/1129669688.db2.gz KDTPGLNDDNOZMD-HNAYVOBHSA-N 1 0 297.446 3.992 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(F)cn1)c1ccc(N(C)C)cc1 ZINC000766607013 1129703582 /nfs/dbraw/zinc/70/35/82/1129703582.db2.gz FVPWNFYLNYLYGK-QGZVFWFLSA-N 1 0 287.382 3.528 20 10 CHCDRO COc1cc(Cl)ccc1C[N@H+](C)Cc1ccccc1O ZINC000796449984 1129728148 /nfs/dbraw/zinc/72/81/48/1129728148.db2.gz OBYBEOFZGHKCRF-UHFFFAOYSA-N 1 0 291.778 3.686 20 10 CHCDRO C[C@H]1CSC[C@H]1[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000796481221 1129741860 /nfs/dbraw/zinc/74/18/60/1129741860.db2.gz CPDZBNWHUZWOHS-SUMWQHHRSA-N 1 0 299.439 3.900 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)[C@H](O)c2ccc(C)cc2)cc1C ZINC000796490660 1129755273 /nfs/dbraw/zinc/75/52/73/1129755273.db2.gz WHXMTMDYGJUIJS-KXBFYZLASA-N 1 0 299.414 3.524 20 10 CHCDRO CC/C=C\CC[N@@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000767325850 1129786150 /nfs/dbraw/zinc/78/61/50/1129786150.db2.gz XYCLZMNLCPGVFO-LIMHQNJXSA-N 1 0 289.419 3.730 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccncc1 ZINC000742372693 1129817136 /nfs/dbraw/zinc/81/71/36/1129817136.db2.gz TYJOSASAXNNVSU-LJQANCHMSA-N 1 0 295.430 3.923 20 10 CHCDRO Oc1cc2c(cc1C[N@@H+]1CCc3cccc(F)c3C1)CCC2 ZINC000767990177 1129824342 /nfs/dbraw/zinc/82/43/42/1129824342.db2.gz UHEJRMLECTZFIF-UHFFFAOYSA-N 1 0 297.373 3.578 20 10 CHCDRO CC[N@H+](Cc1ccccc1)Cc1cc(C)ccc1O ZINC000768141225 1129836405 /nfs/dbraw/zinc/83/64/05/1129836405.db2.gz UBNMPKCJCXTNHA-UHFFFAOYSA-N 1 0 255.361 3.723 20 10 CHCDRO CCOc1ccc(C[N@H+](C)Cc2ccc(F)cc2)c(O)c1 ZINC000768176063 1129839212 /nfs/dbraw/zinc/83/92/12/1129839212.db2.gz YOKBAKYGUSYCIO-UHFFFAOYSA-N 1 0 289.350 3.562 20 10 CHCDRO COc1cccc(O)c1C[N@@H+]1CCc2sccc2[C@H]1C ZINC000768208045 1129840540 /nfs/dbraw/zinc/84/05/40/1129840540.db2.gz MDJHGTBKTXLPOG-LLVKDONJSA-N 1 0 289.400 3.582 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)Cc2ccco2)cc1 ZINC000768186209 1129840752 /nfs/dbraw/zinc/84/07/52/1129840752.db2.gz OLPLLUNLKXPDMI-UHFFFAOYSA-N 1 0 272.392 3.758 20 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297.398 3.829 20 10 CHCDRO COc1cc(C[N@@H+]2CCc3c(C)cccc3C2)c(O)cc1C ZINC000768452836 1129858309 /nfs/dbraw/zinc/85/83/09/1129858309.db2.gz SWPNVRDCZXQABA-UHFFFAOYSA-N 1 0 297.398 3.576 20 10 CHCDRO COc1cc(C[N@@H+]2CCC[C@H]2C2CCCC2)c(O)cc1C ZINC000768444422 1129858366 /nfs/dbraw/zinc/85/83/66/1129858366.db2.gz YIEOPASCHRSNBR-INIZCTEOSA-N 1 0 289.419 3.864 20 10 CHCDRO COc1cc(C[N@@H+]2Cc3ccccc3C[C@H]2C)c(O)cc1C ZINC000768466147 1129858785 /nfs/dbraw/zinc/85/87/85/1129858785.db2.gz MUJWQBHYXNJMPQ-CQSZACIVSA-N 1 0 297.398 3.656 20 10 CHCDRO COc1cc(C[NH+]2CCC(C(C)C)CC2)c(O)cc1C ZINC000768466202 1129859265 /nfs/dbraw/zinc/85/92/65/1129859265.db2.gz OFILDIAYWAVHQJ-UHFFFAOYSA-N 1 0 277.408 3.577 20 10 CHCDRO CCc1cccc(C[NH2+]Cc2cc(F)ccc2F)c1O ZINC000691463384 1129862113 /nfs/dbraw/zinc/86/21/13/1129862113.db2.gz FVSBHTQDCRXKPG-UHFFFAOYSA-N 1 0 277.314 3.523 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](CC(C)C)C(C)C)c1 ZINC000768779586 1129873870 /nfs/dbraw/zinc/87/38/70/1129873870.db2.gz FRTHVHXPBODQJI-UHFFFAOYSA-N 1 0 265.397 3.657 20 10 CHCDRO CCSCCC[NH2+][C@H](CC)c1ccc(C)cc1O ZINC000800492702 1129879149 /nfs/dbraw/zinc/87/91/49/1129879149.db2.gz NAOPLFFQZQAVMN-CQSZACIVSA-N 1 0 267.438 3.885 20 10 CHCDRO Cc1ccccc1[C@]1(F)CC[N@H+](Cc2ccccc2O)C1 ZINC000800537167 1129882193 /nfs/dbraw/zinc/88/21/93/1129882193.db2.gz ZTWLKLYBPQRLCJ-SFHVURJKSA-N 1 0 285.362 3.771 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CCC[C@@H]3CCC[C@@H]32)c(O)c1 ZINC000769102523 1129889111 /nfs/dbraw/zinc/88/91/11/1129889111.db2.gz OLAOKXHOLFKVDL-BBRMVZONSA-N 1 0 275.392 3.555 20 10 CHCDRO CCC[N@H+](Cc1[nH]nc2ccccc21)Cc1ccccc1O ZINC000769201297 1129895880 /nfs/dbraw/zinc/89/58/80/1129895880.db2.gz RERPMMIZYWFNLO-UHFFFAOYSA-N 1 0 295.386 3.681 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CC(C)(C)C(F)(F)F)cc1C ZINC000800888391 1129896257 /nfs/dbraw/zinc/89/62/57/1129896257.db2.gz AVAQBHKEOIDRCD-UHFFFAOYSA-N 1 0 275.314 3.687 20 10 CHCDRO CCC[N@H+](Cc1cccc2c1OCO2)Cc1ccccc1O ZINC000769201508 1129896502 /nfs/dbraw/zinc/89/65/02/1129896502.db2.gz VUJNXABVQZIZFV-UHFFFAOYSA-N 1 0 299.370 3.533 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C(CC)(CC)CCO)cc1 ZINC000800894634 1129896827 /nfs/dbraw/zinc/89/68/27/1129896827.db2.gz DIVMFYBPNZPWLW-UHFFFAOYSA-N 1 0 292.467 3.564 20 10 CHCDRO CCC[N@H+](Cc1ccc(N(CC)CC)cc1)CC(C)(C)O ZINC000769327338 1129902326 /nfs/dbraw/zinc/90/23/26/1129902326.db2.gz XFJVOBKSSKXALA-UHFFFAOYSA-N 1 0 292.467 3.516 20 10 CHCDRO CC[C@H]1c2ccccc2CC[N@H+]1Cc1c(O)cccc1OC ZINC000769428369 1129908277 /nfs/dbraw/zinc/90/82/77/1129908277.db2.gz QSAGFZQVFCETSV-KRWDZBQOSA-N 1 0 297.398 3.910 20 10 CHCDRO Cc1ccc(O)c(C[N@H+]2Cc3ccccc3C[C@@H]2C)c1 ZINC000769483643 1129909490 /nfs/dbraw/zinc/90/94/90/1129909490.db2.gz RJTGLTWOECIRGS-AWEZNQCLSA-N 1 0 267.372 3.647 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)C2CCC2)cc1F ZINC001461418256 1129917374 /nfs/dbraw/zinc/91/73/74/1129917374.db2.gz RMYKARRNJSMJOP-ZDUSSCGKSA-N 1 0 278.415 3.950 20 10 CHCDRO CCCC[N@H+](CC[C@@H]1CCCO1)Cc1ccccc1O ZINC000801594598 1129930802 /nfs/dbraw/zinc/93/08/02/1129930802.db2.gz HIQOCWAIWIRZPG-INIZCTEOSA-N 1 0 277.408 3.563 20 10 CHCDRO CCCC[N@H+](Cc1cnc(C)s1)Cc1ccccc1O ZINC000801596491 1129930952 /nfs/dbraw/zinc/93/09/52/1129930952.db2.gz BLJHWOLZIXFHCB-UHFFFAOYSA-N 1 0 290.432 3.959 20 10 CHCDRO COc1cccc(C[NH2+]CC2CC(c3ccccc3)C2)c1O ZINC000801730796 1129940845 /nfs/dbraw/zinc/94/08/45/1129940845.db2.gz NLCKUMTWLUTYEJ-UHFFFAOYSA-N 1 0 297.398 3.684 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)CC(C)(C)OC)cc1F ZINC000770320934 1129944635 /nfs/dbraw/zinc/94/46/35/1129944635.db2.gz VTRKNRFEHAQOJH-UHFFFAOYSA-N 1 0 296.430 3.529 20 10 CHCDRO CS[C@H]1CCCC[N@H+](Cc2cc(C)c(C)cc2O)C1 ZINC000770348483 1129945860 /nfs/dbraw/zinc/94/58/60/1129945860.db2.gz JRVICFVQGHKDFA-HNNXBMFYSA-N 1 0 279.449 3.727 20 10 CHCDRO C[C@@H]1c2cc(F)cc(F)c2CC[N@H+]1Cc1ccccc1O ZINC000770504535 1129948320 /nfs/dbraw/zinc/94/83/20/1129948320.db2.gz IKULQSMJYLAOST-LLVKDONJSA-N 1 0 289.325 3.790 20 10 CHCDRO CC(C)[N@H+](Cc1ccccc1O)Cc1ccccc1F ZINC000770508772 1129948341 /nfs/dbraw/zinc/94/83/41/1129948341.db2.gz HGMXFJPAQNQBBD-UHFFFAOYSA-N 1 0 273.351 3.942 20 10 CHCDRO Cc1ccc([C@@H]2CSCC[N@@H+]2Cc2ccccc2O)cc1 ZINC000770509532 1129948968 /nfs/dbraw/zinc/94/89/68/1129948968.db2.gz DAMNZOYDYJVQSX-KRWDZBQOSA-N 1 0 299.439 3.991 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCc3ccc(F)cc3C2)cc1C ZINC000771175566 1129973949 /nfs/dbraw/zinc/97/39/49/1129973949.db2.gz PXBDEOOPOUVIAM-UHFFFAOYSA-N 1 0 285.362 3.706 20 10 CHCDRO C[C@H](C[NH2+]CCCSc1nccs1)C(C)(C)C ZINC000802647076 1130024531 /nfs/dbraw/zinc/02/45/31/1130024531.db2.gz XDJMURMJUBMWJG-LLVKDONJSA-N 1 0 272.483 3.897 20 10 CHCDRO CCCC[N@H+](Cc1cccn1C)Cc1ccccc1O ZINC000802657966 1130027411 /nfs/dbraw/zinc/02/74/11/1130027411.db2.gz XMEWWPGSZYDJIT-UHFFFAOYSA-N 1 0 272.392 3.533 20 10 CHCDRO CNc1ccc(C)cc1C[NH2+][C@H](C)c1ccccc1O ZINC000902642830 1130033184 /nfs/dbraw/zinc/03/31/84/1130033184.db2.gz JBIHQBKXYUDGRF-CYBMUJFWSA-N 1 0 270.376 3.593 20 10 CHCDRO CCOc1ccc(C[NH2+][C@@H]2CCCC(C)(C)C2)c(O)c1 ZINC000785548091 1130038844 /nfs/dbraw/zinc/03/88/44/1130038844.db2.gz JLYQSEAKMDBTAX-CQSZACIVSA-N 1 0 277.408 3.849 20 10 CHCDRO Cc1cccc(OCCC[NH2+]Cc2ccccc2O)c1C ZINC000785577868 1130043775 /nfs/dbraw/zinc/04/37/75/1130043775.db2.gz QXGQXFDZIVJZOB-UHFFFAOYSA-N 1 0 285.387 3.568 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCC2(CCCCC2)O1)c1ccccc1O ZINC000786431594 1130093174 /nfs/dbraw/zinc/09/31/74/1130093174.db2.gz ROZQWNAZRIALGN-CABCVRRESA-N 1 0 289.419 3.925 20 10 CHCDRO C[C@H]([NH2+]CC[C@@H]1CCCC[C@@H]1O)c1cc(Cl)ccc1O ZINC000903262953 1130139761 /nfs/dbraw/zinc/13/97/61/1130139761.db2.gz HTPSHOLTVUXEBC-HUBLWGQQSA-N 1 0 297.826 3.637 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C2CC3(C2)CO[C@H](C)C3)c(O)c1 ZINC000903281160 1130145267 /nfs/dbraw/zinc/14/52/67/1130145267.db2.gz FOBRYHLTXIUXES-CZSZNVFWSA-N 1 0 289.419 3.617 20 10 CHCDRO COC(C)(C)[C@H](C)[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000903329956 1130157474 /nfs/dbraw/zinc/15/74/74/1130157474.db2.gz 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/nfs/dbraw/zinc/19/71/08/1130197108.db2.gz GTSWUPXLCLDRFP-GFCCVEGCSA-N 1 0 285.840 3.982 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@H]2CCCS2)c(O)c1 ZINC000788629592 1130198605 /nfs/dbraw/zinc/19/86/05/1130198605.db2.gz WMGJVYKXBXHWHL-CHWSQXEVSA-N 1 0 265.422 3.555 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCC[C@@H](OC)C2)cc1 ZINC000746753336 1130199209 /nfs/dbraw/zinc/19/92/09/1130199209.db2.gz FEZNESDQJWDKFJ-FUHWJXTLSA-N 1 0 290.451 3.580 20 10 CHCDRO CCC(CC)[C@@H](CC[NH2+]Cc1cc(C)ccc1O)OC ZINC000746760180 1130205426 /nfs/dbraw/zinc/20/54/26/1130205426.db2.gz GHQGYPGKVQVJDD-QGZVFWFLSA-N 1 0 279.424 3.632 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2cc(Cl)cc(C)c2O)nc1 ZINC000789595824 1130264124 /nfs/dbraw/zinc/26/41/24/1130264124.db2.gz XCRDRJHDCQOLKO-UHFFFAOYSA-N 1 0 290.794 3.689 20 10 CHCDRO C[N@H+](CCSCc1ccccc1)Cc1ccccc1O ZINC000790315200 1130305937 /nfs/dbraw/zinc/30/59/37/1130305937.db2.gz UDNMHCVEUXVTQJ-UHFFFAOYSA-N 1 0 287.428 3.757 20 10 CHCDRO COCC[N@H+](Cc1cc(C)cc(C)c1O)[C@H]1CC[C@@H](C)C1 ZINC000790480599 1130315020 /nfs/dbraw/zinc/31/50/20/1130315020.db2.gz SNPRJYXNZMWEJL-DYVFJYSZSA-N 1 0 291.435 3.646 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C[C@H]2CCC3(CCCCC3)O2)c1 ZINC000790995073 1130342970 /nfs/dbraw/zinc/34/29/70/1130342970.db2.gz JLKFCRJMXXBTRJ-MRXNPFEDSA-N 1 0 289.419 3.672 20 10 CHCDRO C[C@@H]([NH2+]CCCCCF)c1ccc(N(C)C)cc1 ZINC000792879990 1130504542 /nfs/dbraw/zinc/50/45/42/1130504542.db2.gz NJRWTPZIFDPNMB-CYBMUJFWSA-N 1 0 252.377 3.543 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@@](C)(OC)C2)cc1 ZINC000793215585 1130530189 /nfs/dbraw/zinc/53/01/89/1130530189.db2.gz CDTJALPZASBKRF-GOSISDBHSA-N 1 0 290.451 3.534 20 10 CHCDRO C[C@@H]1C[C@H](C)[N@H+]1Cc1ccc(OCc2ccccc2)cc1O ZINC000793220977 1130530683 /nfs/dbraw/zinc/53/06/83/1130530683.db2.gz SQGHDGHBEMGUHD-GASCZTMLSA-N 1 0 297.398 3.954 20 10 CHCDRO COc1ccc2ccc(O)c(C[N@@H+]3CCC4(CC4)C3)c2c1 ZINC001234525418 1130653781 /nfs/dbraw/zinc/65/37/81/1130653781.db2.gz GQGNURGTZLULFJ-UHFFFAOYSA-N 1 0 283.371 3.540 20 10 CHCDRO COc1ccc2ccc(O)c(C[N@@H+]3CCC[C@@H]4C[C@@H]43)c2c1 ZINC001234569100 1130656797 /nfs/dbraw/zinc/65/67/97/1130656797.db2.gz JLRATOMLBNDMDK-DYVFJYSZSA-N 1 0 283.371 3.538 20 10 CHCDRO CC[C@@H](C)[C@@H](C)Oc1ccc(N2CC[NH+](CC)CC2)cc1 ZINC001234658209 1130669820 /nfs/dbraw/zinc/66/98/20/1130669820.db2.gz XOQPXDNRAUHMBL-HZPDHXFCSA-N 1 0 290.451 3.642 20 10 CHCDRO Cc1cccc(C[N@@H+]2CC[C@H](COc3ccccc3)C2)c1O ZINC000780788825 1130692652 /nfs/dbraw/zinc/69/26/52/1130692652.db2.gz DATWYTVLTOXSPS-INIZCTEOSA-N 1 0 297.398 3.602 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2cccc(-c3ccccc3)c2O)C1 ZINC001234998999 1130700579 /nfs/dbraw/zinc/70/05/79/1130700579.db2.gz PTIPRBDOLXBUTA-CQSZACIVSA-N 1 0 267.372 3.901 20 10 CHCDRO C[C@H](Nc1cc2c(c[nH+]1)CCCC2)c1ccc(F)cc1O ZINC000812739504 1130710604 /nfs/dbraw/zinc/71/06/04/1130710604.db2.gz SGFNMSTUMUAZTP-NSHDSACASA-N 1 0 286.350 3.978 20 10 CHCDRO COc1cc(C[N@@H+]2CC[C@@]3(CC[C@@H](C)C3)C2)c(O)cc1C ZINC000781587663 1130728765 /nfs/dbraw/zinc/72/87/65/1130728765.db2.gz RANHMXZFQDTQKD-FZKQIMNGSA-N 1 0 289.419 3.721 20 10 CHCDRO CC(C)(C)c1ccc(C[N@@H+]2CC[C@](C)(CF)C2)c(O)c1 ZINC001235676307 1130766354 /nfs/dbraw/zinc/76/63/54/1130766354.db2.gz PTEFUMAADBLEHK-QGZVFWFLSA-N 1 0 279.399 3.871 20 10 CHCDRO CC(C)(C)c1ccc(C[N@@H+]2CCC[C@@H]3C[C@@H]32)c(O)c1 ZINC001235679308 1130768734 /nfs/dbraw/zinc/76/87/34/1130768734.db2.gz DYZWVLDTQMMMOE-DOMZBBRYSA-N 1 0 259.393 3.674 20 10 CHCDRO CC(C)([NH2+]Cc1ccc2c(c1)CCO2)c1ccccc1F ZINC000813792307 1130784495 /nfs/dbraw/zinc/78/44/95/1130784495.db2.gz MZPLAFQOWIZKMS-UHFFFAOYSA-N 1 0 285.362 3.786 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)c2ccccc2O)c(C)c1 ZINC000783517086 1130832539 /nfs/dbraw/zinc/83/25/39/1130832539.db2.gz FYUIVBZKBQBJBD-ZDUSSCGKSA-N 1 0 271.360 3.560 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)c2ccccc2O)c(C)c1 ZINC000783517081 1130832793 /nfs/dbraw/zinc/83/27/93/1130832793.db2.gz FYUIVBZKBQBJBD-CYBMUJFWSA-N 1 0 271.360 3.560 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1O)[C@@H]1Oc2ccccc2[C@H]1C ZINC000783515993 1130832992 /nfs/dbraw/zinc/83/29/92/1130832992.db2.gz AHIPACQAKYBJRD-ZYKCCNLVSA-N 1 0 297.398 3.996 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CSc2ccccc21)c1ccccc1O ZINC000783513734 1130833207 /nfs/dbraw/zinc/83/32/07/1130833207.db2.gz MNPIGHDDIWBXAY-BXUZGUMPSA-N 1 0 271.385 3.890 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@@H]2CCCc3ccc(C)cc32)c1 ZINC000814175401 1130834574 /nfs/dbraw/zinc/83/45/74/1130834574.db2.gz UTBSTDBHIKAHGS-GOSISDBHSA-N 1 0 297.398 3.876 20 10 CHCDRO CC[C@H]1CC[N@@H+]1Cc1ccc(OCc2ccccc2)cc1O ZINC000814178764 1130834950 /nfs/dbraw/zinc/83/49/50/1130834950.db2.gz CKGWFPKXNVKITP-KRWDZBQOSA-N 1 0 297.398 3.956 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CC3(CCC3)[C@@H]2C(C)C)c(O)c1 ZINC000814170856 1130837672 /nfs/dbraw/zinc/83/76/72/1130837672.db2.gz FLZIGDCTOVFDCM-KRWDZBQOSA-N 1 0 289.419 3.801 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)C2CC(OC(C)(C)C)C2)cc1 ZINC000783645910 1130844405 /nfs/dbraw/zinc/84/44/05/1130844405.db2.gz VMWSYIRGXIGJSX-UHFFFAOYSA-N 1 0 290.451 3.531 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H](CC(F)(F)F)C(C)C)c1O ZINC000783740399 1130851960 /nfs/dbraw/zinc/85/19/60/1130851960.db2.gz IRHUWDTXXHXLPK-LBPRGKRZSA-N 1 0 275.314 3.767 20 10 CHCDRO CC(C)[C@@H](CC(F)(F)F)[NH2+]Cc1cc(F)ccc1O ZINC000783741547 1130853053 /nfs/dbraw/zinc/85/30/53/1130853053.db2.gz RFQJYXFMWOAXQL-LLVKDONJSA-N 1 0 279.277 3.598 20 10 CHCDRO COCc1ccccc1/C=C(\C)C[NH2+]Cc1ccccc1O ZINC000814292092 1130859372 /nfs/dbraw/zinc/85/93/72/1130859372.db2.gz MXAVSBJRPMVKSH-RVDMUPIBSA-N 1 0 297.398 3.732 20 10 CHCDRO CN(C)c1ccc(CNc2cc[nH+]c3c(O)cccc23)cc1 ZINC000784559628 1130911018 /nfs/dbraw/zinc/91/10/18/1130911018.db2.gz FDKUAFJIJFWBGB-UHFFFAOYSA-N 1 0 293.370 3.619 20 10 CHCDRO CC[N@H+](Cc1ccc(NC)cc1)Cc1ccc(N(C)C)cc1 ZINC001236280557 1130911305 /nfs/dbraw/zinc/91/13/05/1130911305.db2.gz WEDAIZMSVNKYET-UHFFFAOYSA-N 1 0 297.446 3.816 20 10 CHCDRO CC(C)[C@H]1CC[C@@H]1[NH2+]CCCSc1nccs1 ZINC000796772082 1130931456 /nfs/dbraw/zinc/93/14/56/1130931456.db2.gz PIYQWJBBIVYFQQ-NEPJUHHUSA-N 1 0 270.467 3.650 20 10 CHCDRO CSC(C)(C)C[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2C ZINC000168813721 1130937718 /nfs/dbraw/zinc/93/77/18/1130937718.db2.gz VSZAXQYQNBZJPM-RYUDHWBXSA-N 1 0 279.449 3.980 20 10 CHCDRO CC1(c2ccccc2)CC[NH+](Cc2ccc(N)cc2)CC1 ZINC001236433377 1130940687 /nfs/dbraw/zinc/94/06/87/1130940687.db2.gz HOJZOHIATPUSLU-UHFFFAOYSA-N 1 0 280.415 3.823 20 10 CHCDRO Cc1cc(C[N@H+](C)CCc2cccs2)ccc1N(C)C ZINC000815055202 1130952541 /nfs/dbraw/zinc/95/25/41/1130952541.db2.gz XOCZEAYCEIBPNI-UHFFFAOYSA-N 1 0 288.460 3.797 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CSC[C@@H]1C)c1cc2c(cc1O)CCCC2 ZINC000797066664 1130958329 /nfs/dbraw/zinc/95/83/29/1130958329.db2.gz UIRDSXAKLJYBLE-MQIPJXDCSA-N 1 0 291.460 3.673 20 10 CHCDRO CCS[C@H]1CCC[C@H]1[NH2+]Cc1ccc(N(C)CC)cc1 ZINC000815116288 1130958514 /nfs/dbraw/zinc/95/85/14/1130958514.db2.gz HTUCZQBKITULBK-SJORKVTESA-N 1 0 292.492 3.907 20 10 CHCDRO CSC[C@H]1CCC[N@H+](Cc2ccc(N(C)C)c(C)c2)C1 ZINC000815120164 1130959787 /nfs/dbraw/zinc/95/97/87/1130959787.db2.gz CWOJHFOIPUPIBI-INIZCTEOSA-N 1 0 292.492 3.636 20 10 CHCDRO COCCC[NH2+][C@@H](CCc1ccccc1)c1ccccc1O ZINC000815552801 1130998646 /nfs/dbraw/zinc/99/86/46/1130998646.db2.gz KMLPKRIAHDVCLI-SFHVURJKSA-N 1 0 299.414 3.692 20 10 CHCDRO CC[C@H](C[NH2+][C@@H](C)c1c(C)cc(C)cc1O)N1CCCC1 ZINC000815559032 1130999302 /nfs/dbraw/zinc/99/93/02/1130999302.db2.gz VLUIMONXODHCLU-JKSUJKDBSA-N 1 0 290.451 3.534 20 10 CHCDRO Cc1ccc(CC[NH2+][C@H](C)c2c(C)cc(C)cc2O)o1 ZINC000815558769 1130999889 /nfs/dbraw/zinc/99/98/89/1130999889.db2.gz NLQJFUYHJMQINJ-CQSZACIVSA-N 1 0 273.376 3.804 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@]2(C)CCCC[C@H]2O)c(O)c1 ZINC000815585903 1131003824 /nfs/dbraw/zinc/00/38/24/1131003824.db2.gz VEWCKJQDXQSDRF-YXJHDRRASA-N 1 0 291.435 3.601 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@]2(C)CCCC[C@@H]2O)c(O)c1 ZINC000815585904 1131003937 /nfs/dbraw/zinc/00/39/37/1131003937.db2.gz 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/nfs/dbraw/zinc/01/22/76/1131012276.db2.gz ZSDDBGWYRFRFFA-UHFFFAOYSA-N 1 0 281.783 3.573 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@H]2COc3ccccc32)c(O)c1 ZINC000815626726 1131012191 /nfs/dbraw/zinc/01/21/91/1131012191.db2.gz KQPQXRXGVCQNCC-CABCVRRESA-N 1 0 297.398 3.836 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](CO)C2CCCCC2)c(O)c1 ZINC000815648134 1131017042 /nfs/dbraw/zinc/01/70/42/1131017042.db2.gz FKTGCNKSYMXWRN-HOCLYGCPSA-N 1 0 291.435 3.540 20 10 CHCDRO C[N@H+](CCc1ccncc1)Cc1cc2ccccc2cc1O ZINC001236841459 1131021227 /nfs/dbraw/zinc/02/12/27/1131021227.db2.gz KTMFKUWMJINEPX-UHFFFAOYSA-N 1 0 292.382 3.615 20 10 CHCDRO CCOc1ccc(C[NH+]2CCC3(CCCC3)CC2)c(O)c1 ZINC001237049019 1131039369 /nfs/dbraw/zinc/03/93/69/1131039369.db2.gz CGUFFYARFDVEOR-UHFFFAOYSA-N 1 0 289.419 3.947 20 10 CHCDRO CC(C)c1ccc(C[N@@H+]2C[C@H](C)CC23CC3)c(O)c1 ZINC001237054627 1131042875 /nfs/dbraw/zinc/04/28/75/1131042875.db2.gz DKCKECPGOFXPHK-CYBMUJFWSA-N 1 0 259.393 3.890 20 10 CHCDRO COC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccc(C(C)C)cc1O ZINC001237054535 1131043462 /nfs/dbraw/zinc/04/34/62/1131043462.db2.gz CAHIDDRKIWTJFQ-SJPCQFCGSA-N 1 0 289.419 3.657 20 10 CHCDRO CC(C)c1ccc(C[N@@H+]2CC[C@H](c3cccnc3)C2)c(O)c1 ZINC001237053534 1131044249 /nfs/dbraw/zinc/04/42/49/1131044249.db2.gz MIIMBCDIRVZAHA-KRWDZBQOSA-N 1 0 296.414 3.900 20 10 CHCDRO Oc1ccc(C(F)(F)F)cc1C[NH+]1CC2(C1)CCCC2 ZINC001237135603 1131055754 /nfs/dbraw/zinc/05/57/54/1131055754.db2.gz KPIRWCHWOXLVCU-UHFFFAOYSA-N 1 0 285.309 3.787 20 10 CHCDRO CC1CC([N@H+](C)Cc2cc(C(F)(F)F)ccc2O)C1 ZINC001237137890 1131056327 /nfs/dbraw/zinc/05/63/27/1131056327.db2.gz QNLVWIJTTKFWPB-UHFFFAOYSA-N 1 0 273.298 3.641 20 10 CHCDRO Oc1ccc(C(F)(F)F)cc1C[N@@H+]1CCC[C@@H](CF)C1 ZINC001237141018 1131057637 /nfs/dbraw/zinc/05/76/37/1131057637.db2.gz RUVASTWBUACSGU-JTQLQIEISA-N 1 0 291.288 3.593 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCCc2cccnc21 ZINC000798928665 1131062120 /nfs/dbraw/zinc/06/21/20/1131062120.db2.gz CHTOUXGQOSKQCR-SFHVURJKSA-N 1 0 295.430 3.623 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](CO)CC2CCCC2)c(O)c1 ZINC000798938538 1131063123 /nfs/dbraw/zinc/06/31/23/1131063123.db2.gz YQEKCCGPTWOUDK-GDBMZVCRSA-N 1 0 291.435 3.540 20 10 CHCDRO CC[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1ccc2ccccc2c1O ZINC000816480989 1131099138 /nfs/dbraw/zinc/09/91/38/1131099138.db2.gz DIEQCCLEXRYXLF-XJKSGUPXSA-N 1 0 285.387 3.545 20 10 CHCDRO CCOC1CC[NH+](Cc2ccc3ccccc3c2O)CC1 ZINC000816489094 1131100888 /nfs/dbraw/zinc/10/08/88/1131100888.db2.gz MAOCTCZYGHXQDZ-UHFFFAOYSA-N 1 0 285.387 3.546 20 10 CHCDRO Oc1c(C[N@@H+]2CCC3(C2)CCOCC3)ccc2ccccc21 ZINC000816519676 1131101845 /nfs/dbraw/zinc/10/18/45/1131101845.db2.gz RGWUCZJKIXSEKA-UHFFFAOYSA-N 1 0 297.398 3.548 20 10 CHCDRO CCOC[C@@H]1CCC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816512059 1131103314 /nfs/dbraw/zinc/10/33/14/1131103314.db2.gz WKJRZRKYGLADNZ-OAHLLOKOSA-N 1 0 299.414 3.794 20 10 CHCDRO C[N@H+](Cc1ccc[nH]1)Cc1ccc2ccccc2c1O ZINC000816519258 1131104132 /nfs/dbraw/zinc/10/41/32/1131104132.db2.gz DGAKPKOALQZPDJ-UHFFFAOYSA-N 1 0 266.344 3.506 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+]1CC[C@H](c2ccc(F)cc2)C1 ZINC001237486659 1131104449 /nfs/dbraw/zinc/10/44/49/1131104449.db2.gz AHGXKKYYXRLMFO-HNNXBMFYSA-N 1 0 285.362 3.829 20 10 CHCDRO Cc1cccc(O)c1C[N@H+](C)Cc1ccccc1Cl ZINC001237488899 1131105077 /nfs/dbraw/zinc/10/50/77/1131105077.db2.gz AHFDPQMFHVUUDG-UHFFFAOYSA-N 1 0 275.779 3.986 20 10 CHCDRO Oc1ccc(CC[NH2+]Cc2ccc3ccccc3c2O)cc1 ZINC000816542657 1131106496 /nfs/dbraw/zinc/10/64/96/1131106496.db2.gz XFDSILPWHPUMEC-UHFFFAOYSA-N 1 0 293.366 3.583 20 10 CHCDRO Oc1c(C[NH2+]CCOC2CCCCC2)ccc2ccccc21 ZINC000816542580 1131107054 /nfs/dbraw/zinc/10/70/54/1131107054.db2.gz UUQRONNTRIVTOZ-UHFFFAOYSA-N 1 0 299.414 3.984 20 10 CHCDRO CO[C@]1(C)C[C@@H]([NH2+]Cc2ccc3ccccc3c2O)C1(C)C ZINC000816554071 1131110122 /nfs/dbraw/zinc/11/01/22/1131110122.db2.gz NWORGCSMAKPUFO-VQIMIIECSA-N 1 0 299.414 3.839 20 10 CHCDRO C[C@@H]1CC([NH2+]Cc2ccc3ccccc3c2O)C[C@@H](C)O1 ZINC000816559553 1131111443 /nfs/dbraw/zinc/11/14/43/1131111443.db2.gz NLJTUGVYZXFQBJ-CHWSQXEVSA-N 1 0 285.387 3.591 20 10 CHCDRO CO[C@H]1CCC[N@H+](Cc2ccc3ccccc3c2O)CC1 ZINC000816567235 1131113041 /nfs/dbraw/zinc/11/30/41/1131113041.db2.gz VLNNLSVWRRZMJJ-INIZCTEOSA-N 1 0 285.387 3.546 20 10 CHCDRO COc1ccc(C[NH2+]Cc2cc(C)cc(Cl)c2)c(O)c1 ZINC000816597254 1131113713 /nfs/dbraw/zinc/11/37/13/1131113713.db2.gz KYRWVNKBFOMYCN-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCC[C@@H](c2ccccc2)C1 ZINC000816619357 1131116512 /nfs/dbraw/zinc/11/65/12/1131116512.db2.gz CDDGMSZZGDWBBH-MRXNPFEDSA-N 1 0 267.372 3.772 20 10 CHCDRO COCC1(CC[NH2+]Cc2ccc3ccccc3c2O)CCC1 ZINC000816638736 1131117062 /nfs/dbraw/zinc/11/70/62/1131117062.db2.gz WGAQIGWBTQAJFQ-UHFFFAOYSA-N 1 0 299.414 3.842 20 10 CHCDRO CCOC1(C[NH2+]Cc2cc(Cl)cc(C)c2O)CCCC1 ZINC000816642808 1131117521 /nfs/dbraw/zinc/11/75/21/1131117521.db2.gz LVJPRCVMIKBTOI-UHFFFAOYSA-N 1 0 297.826 3.793 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2ccc(N3CCCCC3)cc2)[C@H]1C ZINC000816648339 1131119618 /nfs/dbraw/zinc/11/96/18/1131119618.db2.gz IZCHZJKZDGFWOI-CABCVRRESA-N 1 0 258.409 3.517 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2cc(-c3ccccc3)ccc2O)[C@H]1C ZINC000816649340 1131120697 /nfs/dbraw/zinc/12/06/97/1131120697.db2.gz XQGNQJYCKWRUOH-KGLIPLIRSA-N 1 0 267.372 3.899 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+]2CCCC[C@@H](C)C2)c1O ZINC001237682051 1131126477 /nfs/dbraw/zinc/12/64/77/1131126477.db2.gz VTBCNJJYVWIKHY-LLVKDONJSA-N 1 0 267.800 3.976 20 10 CHCDRO Cc1cc(Cl)cc(C[NH+](C(C)C)C(C)C)c1O ZINC001237680566 1131127107 /nfs/dbraw/zinc/12/71/07/1131127107.db2.gz DNHFCTWRUJVWGR-UHFFFAOYSA-N 1 0 255.789 3.973 20 10 CHCDRO CC[C@H]1CCC[N@@H+]1Cc1cc(Br)c(C)cc1O ZINC001237678564 1131127171 /nfs/dbraw/zinc/12/71/71/1131127171.db2.gz JITCQOHYKIVBJE-LBPRGKRZSA-N 1 0 298.224 3.838 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2cc(Cl)cc(C)c2O)cn1 ZINC001237688915 1131128146 /nfs/dbraw/zinc/12/81/46/1131128146.db2.gz KKVLYYCOFVZTSS-UHFFFAOYSA-N 1 0 290.794 3.689 20 10 CHCDRO C[N@H+](Cc1cccc(F)c1)Cc1cc(F)cc(Cl)c1[O-] ZINC001237808660 1131142672 /nfs/dbraw/zinc/14/26/72/1131142672.db2.gz VRUSHTJAVUTMFE-UHFFFAOYSA-N 1 0 297.732 3.956 20 10 CHCDRO CC[N@H+](Cc1ccccc1F)Cc1cc(C)ccc1O ZINC001116439446 1131145889 /nfs/dbraw/zinc/14/58/89/1131145889.db2.gz AJNVKRFSWDLUKT-UHFFFAOYSA-N 1 0 273.351 3.862 20 10 CHCDRO C[C@@]1(F)CCCCN(Cc2cc(F)c(Cl)cc2O)C1 ZINC001237934199 1131153502 /nfs/dbraw/zinc/15/35/02/1131153502.db2.gz IWXMRNGSVWRJOR-CQSZACIVSA-N 1 0 289.753 3.899 20 10 CHCDRO Cc1ccc2c(c1)C[N@@H+](Cc1cc(F)cc(C)c1O)CC2 ZINC001238057776 1131164701 /nfs/dbraw/zinc/16/47/01/1131164701.db2.gz MUIYHZFJSCEOTF-UHFFFAOYSA-N 1 0 285.362 3.706 20 10 CHCDRO Cc1ccc(C[C@@H]([NH2+]CCc2ccc(N)cc2)C2CC2)cc1 ZINC000817955426 1131190093 /nfs/dbraw/zinc/19/00/93/1131190093.db2.gz AKNKJUBNBCABSH-HXUWFJFHSA-N 1 0 294.442 3.731 20 10 CHCDRO CCOc1ccccc1[C@H](C)[NH2+]CCc1ccc(N)cc1 ZINC000817955760 1131190408 /nfs/dbraw/zinc/19/04/08/1131190408.db2.gz HCTKKUBDEJZFAZ-AWEZNQCLSA-N 1 0 284.403 3.561 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccc(N)cc1)c1cccs1 ZINC000817955886 1131190437 /nfs/dbraw/zinc/19/04/37/1131190437.db2.gz KEBFGKVWTOBSLF-CQSZACIVSA-N 1 0 260.406 3.614 20 10 CHCDRO CCc1ccc([C@H](C)[NH2+]CCc2ccc(N)cc2)cc1 ZINC000817956012 1131190726 /nfs/dbraw/zinc/19/07/26/1131190726.db2.gz NOUQOQJXPYSEIX-AWEZNQCLSA-N 1 0 268.404 3.725 20 10 CHCDRO Nc1ccc(CC[NH2+][C@@H]2CCCCc3ccccc32)cc1 ZINC000817956265 1131190922 /nfs/dbraw/zinc/19/09/22/1131190922.db2.gz VFBQKMAZRWBQPL-LJQANCHMSA-N 1 0 280.415 3.869 20 10 CHCDRO Cc1cc([C@@H](C)[NH2+]CCc2ccc(N)cc2)cs1 ZINC000817958756 1131191441 /nfs/dbraw/zinc/19/14/41/1131191441.db2.gz XUSVOGLHJJLRFD-GFCCVEGCSA-N 1 0 260.406 3.532 20 10 CHCDRO Cc1cccc2c1[C@H](C)C[C@@H]2[NH2+]CCc1ccc(N)cc1 ZINC000817958171 1131191475 /nfs/dbraw/zinc/19/14/75/1131191475.db2.gz SQRNGPVLPYJPCX-KDOFPFPSSA-N 1 0 280.415 3.958 20 10 CHCDRO C[C@H]([NH2+]CCc1ccc(N)cc1)[C@@H]1CCCC[C@H]1C ZINC000817957822 1131191539 /nfs/dbraw/zinc/19/15/39/1131191539.db2.gz PIEYGWXOWVJBPK-JKIFEVAISA-N 1 0 260.425 3.616 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCCC[C@@H]1C[NH3+])c1cccc(Cl)c1[O-] ZINC000817960643 1131192328 /nfs/dbraw/zinc/19/23/28/1131192328.db2.gz ONGWKWJENMMPBO-UGFHNGPFSA-N 1 0 296.842 3.604 20 10 CHCDRO CCCC[C@@H](CN)[NH2+][C@H](C)c1cc(Cl)cc(C)c1O ZINC000817963422 1131192741 /nfs/dbraw/zinc/19/27/41/1131192741.db2.gz UTMMSFSZUUUCAR-YPMHNXCESA-N 1 0 284.831 3.522 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2cc(C)cc(N)c2)cc1 ZINC000817981364 1131194783 /nfs/dbraw/zinc/19/47/83/1131194783.db2.gz RLJYPUHFZXVBOS-HNNXBMFYSA-N 1 0 297.446 3.884 20 10 CHCDRO CCCC[C@@H](C)[NH2+]C[C@H]1CCN(c2ccc(OC)cc2)C1 ZINC000818344326 1131209785 /nfs/dbraw/zinc/20/97/85/1131209785.db2.gz LDOWUCRAAFSWRE-HZPDHXFCSA-N 1 0 290.451 3.690 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@@H]1C[C@@]1(F)c1ccccc1)CC2 ZINC000818356847 1131211617 /nfs/dbraw/zinc/21/16/17/1131211617.db2.gz RMNOQENYWYGTRX-QGPMSJSTSA-N 1 0 283.346 3.606 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CC12CC2)c1cc(Cl)ccc1O ZINC000818356926 1131211652 /nfs/dbraw/zinc/21/16/52/1131211652.db2.gz SPXYNVMWOQKRDY-YPMHNXCESA-N 1 0 251.757 3.639 20 10 CHCDRO C[C@H]([NH2+][C@H]1C[C@@]1(F)c1ccccc1)c1ccccc1O ZINC000818357240 1131211726 /nfs/dbraw/zinc/21/17/26/1131211726.db2.gz XEBLUOHDLWSGJN-AFAVFJNCSA-N 1 0 271.335 3.680 20 10 CHCDRO CCC[N@H+](Cc1cc2cccnc2o1)Cc1ccccc1O ZINC000823424031 1131428148 /nfs/dbraw/zinc/42/81/48/1131428148.db2.gz RIWUNTTXKOUOLO-UHFFFAOYSA-N 1 0 296.370 3.946 20 10 CHCDRO COc1ccccc1C1([NH2+]Cc2ccc(N(C)C)cc2)CC1 ZINC000829702502 1131430372 /nfs/dbraw/zinc/43/03/72/1131430372.db2.gz QIBWFJIDKRWDQP-UHFFFAOYSA-N 1 0 296.414 3.540 20 10 CHCDRO CCCC[N@H+](Cc1ccncc1C)Cc1ccccc1O ZINC000824344295 1131465046 /nfs/dbraw/zinc/46/50/46/1131465046.db2.gz IUJOGQHLPIXLDS-UHFFFAOYSA-N 1 0 284.403 3.898 20 10 CHCDRO C[C@@]1(F)CCC[N@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000824472580 1131470532 /nfs/dbraw/zinc/47/05/32/1131470532.db2.gz VLPIONJSEGHCPV-QGZVFWFLSA-N 1 0 273.351 3.869 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](Cc1ccccc1)OC)c1ccccc1O ZINC000824590757 1131476620 /nfs/dbraw/zinc/47/66/20/1131476620.db2.gz PJDMMTMOMWCRHD-FUHWJXTLSA-N 1 0 299.414 3.691 20 10 CHCDRO Cc1cccc(C[N@H+]2CC[C@@H](C(F)(F)F)C[C@@H]2C)c1O ZINC000824714729 1131480607 /nfs/dbraw/zinc/48/06/07/1131480607.db2.gz FGGQWGCJNZODJY-WCQYABFASA-N 1 0 287.325 3.863 20 10 CHCDRO Cc1c(C[N@@H+]2CC[C@@]3(C2)CCCCO3)c2ccccc2n1C ZINC001138252797 1131482057 /nfs/dbraw/zinc/48/20/57/1131482057.db2.gz VBNLKYPKZNYTEL-LJQANCHMSA-N 1 0 298.430 3.632 20 10 CHCDRO Cc1c(C[N@H+](C)CCc2ccccn2)c2ccccc2n1C ZINC001138252608 1131482124 /nfs/dbraw/zinc/48/21/24/1131482124.db2.gz NIOIXILWGNDPLU-UHFFFAOYSA-N 1 0 293.414 3.556 20 10 CHCDRO Cc1c(C[N@@H+]2CC[C@]3(C2)CCCCO3)c2ccccc2n1C ZINC001138252796 1131482533 /nfs/dbraw/zinc/48/25/33/1131482533.db2.gz VBNLKYPKZNYTEL-IBGZPJMESA-N 1 0 298.430 3.632 20 10 CHCDRO Cc1c(C[N@@H+]2CCC[C@H](CF)C2)c2ccccc2n1C ZINC001138257074 1131483351 /nfs/dbraw/zinc/48/33/51/1131483351.db2.gz USRSKNIZKFSAJO-CQSZACIVSA-N 1 0 274.383 3.668 20 10 CHCDRO CC(C)[C@@H]1C[C@@H](C[NH2+]Cc2c(O)cccc2Cl)CCO1 ZINC000824799622 1131485152 /nfs/dbraw/zinc/48/51/52/1131485152.db2.gz PEKNGWUQPGICPG-LRDDRELGSA-N 1 0 297.826 3.586 20 10 CHCDRO CN1CCCc2cc(C[N@@H+]3CCC[C@H](C(F)F)C3)ccc21 ZINC001138358679 1131493551 /nfs/dbraw/zinc/49/35/51/1131493551.db2.gz XKJAKPSTQNHCOX-HNNXBMFYSA-N 1 0 294.389 3.546 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C2(Cc3ccc(F)cc3)CC2)c1 ZINC000825017546 1131494731 /nfs/dbraw/zinc/49/47/31/1131494731.db2.gz UILYLZUXLVOWEE-UHFFFAOYSA-N 1 0 285.362 3.705 20 10 CHCDRO CCC[N@H+](CC)Cc1ccc(N(CC)CC)cc1OC ZINC001138388622 1131497658 /nfs/dbraw/zinc/49/76/58/1131497658.db2.gz ZNZBODIJTYSMOT-UHFFFAOYSA-N 1 0 278.440 3.773 20 10 CHCDRO CCC1(C[NH2+]Cc2cc(-c3ccccc3)ccc2O)COC1 ZINC000825072612 1131498277 /nfs/dbraw/zinc/49/82/77/1131498277.db2.gz JYGBLOPXZJIHOL-UHFFFAOYSA-N 1 0 297.398 3.575 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@H](C)c2ccncc2)cc1Cl ZINC000825326053 1131506315 /nfs/dbraw/zinc/50/63/15/1131506315.db2.gz MAYKSLZMDASICT-LBPRGKRZSA-N 1 0 290.794 3.642 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CCCCOC(C)C)cc1Cl ZINC000825489950 1131513291 /nfs/dbraw/zinc/51/32/91/1131513291.db2.gz RXDPSTFVSGSAOU-UHFFFAOYSA-N 1 0 285.815 3.649 20 10 CHCDRO CCC[N@H+](Cc1ccc(N2CCOCC2)cc1)[C@H](C)CC ZINC001138495625 1131513372 /nfs/dbraw/zinc/51/33/72/1131513372.db2.gz ZWKUDZSAGLWMMQ-MRXNPFEDSA-N 1 0 290.451 3.534 20 10 CHCDRO COc1ccc2c(C[N@H+](C)Cc3ccccc3O)c[nH]c2c1 ZINC001138590581 1131524315 /nfs/dbraw/zinc/52/43/15/1131524315.db2.gz SYKJLRXEOOXVFP-UHFFFAOYSA-N 1 0 296.370 3.514 20 10 CHCDRO CCn1ccc2c1cccc2C[N@H+](C)Cc1ccccc1O ZINC001139158120 1131588318 /nfs/dbraw/zinc/58/83/18/1131588318.db2.gz CVXMHEOXWRUUFP-UHFFFAOYSA-N 1 0 294.398 3.999 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC[C@]3(CC3(F)F)C2)cc1C ZINC000844746394 1131596646 /nfs/dbraw/zinc/59/66/46/1131596646.db2.gz LJFNMARCSIMEMB-HNNXBMFYSA-N 1 0 281.346 3.630 20 10 CHCDRO Cc1cc(C[N@@H+]2CCC23CCCCC3)ccc1N(C)C ZINC001139670383 1131626642 /nfs/dbraw/zinc/62/66/42/1131626642.db2.gz LUJSAJWQQOFINP-UHFFFAOYSA-N 1 0 272.436 3.970 20 10 CHCDRO Cc1cc(C[N@H+](C)C[C@@H]2CC2(C)C)ccc1N(C)C ZINC001139672977 1131627686 /nfs/dbraw/zinc/62/76/86/1131627686.db2.gz MGUDZHFKSPKFNV-HNNXBMFYSA-N 1 0 260.425 3.539 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)c(C)c1)Cc1ccccc1O ZINC001139673208 1131628170 /nfs/dbraw/zinc/62/81/70/1131628170.db2.gz CPBJYMKZCANBNL-UHFFFAOYSA-N 1 0 298.430 3.789 20 10 CHCDRO CCCCC[NH+](CCCCC)Cc1c(O)cc(O)cc1O ZINC001144514691 1131651210 /nfs/dbraw/zinc/65/12/10/1131651210.db2.gz OVXBRSIJWWQDBO-UHFFFAOYSA-N 1 0 295.423 3.986 20 10 CHCDRO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(F)ccc2O)cn1 ZINC001140058568 1131659711 /nfs/dbraw/zinc/65/97/11/1131659711.db2.gz HISSIRULGLYZGB-INIZCTEOSA-N 1 0 286.350 3.572 20 10 CHCDRO COc1ccccc1[C@@H](C)[N@H+](C)Cc1cc(F)ccc1O ZINC001140058454 1131659900 /nfs/dbraw/zinc/65/99/00/1131659900.db2.gz AGFSNIGZOLFVMB-GFCCVEGCSA-N 1 0 289.350 3.733 20 10 CHCDRO Oc1ccc(F)cc1C[N@H+]1CC=C(c2ccccc2)CC1 ZINC001140058745 1131660110 /nfs/dbraw/zinc/66/01/10/1131660110.db2.gz KLVWQDCDPTZWIZ-UHFFFAOYSA-N 1 0 283.346 3.821 20 10 CHCDRO C[N@H+](Cc1cc(F)ccc1O)C(C)(C)Cc1ccccc1 ZINC001140060432 1131660307 /nfs/dbraw/zinc/66/03/07/1131660307.db2.gz VSHPCNVCQUCGRC-UHFFFAOYSA-N 1 0 287.378 3.984 20 10 CHCDRO C[C@H]([NH2+]Cc1cc2cnccc2o1)c1ccc(N(C)C)cc1 ZINC000845956126 1131671222 /nfs/dbraw/zinc/67/12/22/1131671222.db2.gz JIBHVAUIIYQLAX-ZDUSSCGKSA-N 1 0 295.386 3.745 20 10 CHCDRO Cc1ccc(C)c(C[N@H+](C)CCOc2ccccc2)c1O ZINC001140178906 1131673325 /nfs/dbraw/zinc/67/33/25/1131673325.db2.gz BYFHKDQYPMXROJ-UHFFFAOYSA-N 1 0 285.387 3.520 20 10 CHCDRO Cc1ccc(C)c(C[N@H+](C)CC/C=C/c2cccnc2)c1O ZINC001140184446 1131674451 /nfs/dbraw/zinc/67/44/51/1131674451.db2.gz UPJFYVTTWCEEEN-QPJJXVBHSA-N 1 0 296.414 3.939 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCC[C@H]3CCC[C@@H]32)c1O ZINC001140182554 1131674594 /nfs/dbraw/zinc/67/45/94/1131674594.db2.gz VDNOVTYOURTYFE-ZBFHGGJFSA-N 1 0 259.393 3.774 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)ncn2C)c1ccccc1O ZINC000845991527 1131675430 /nfs/dbraw/zinc/67/54/30/1131675430.db2.gz BIMSGRNKMYNCRN-OAHLLOKOSA-N 1 0 295.386 3.520 20 10 CHCDRO CC(C)O[C@@H]1CCC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC000846014698 1131677910 /nfs/dbraw/zinc/67/79/10/1131677910.db2.gz UMAQKUARENTXCK-QGZVFWFLSA-N 1 0 299.414 3.935 20 10 CHCDRO CC[C@@H](OCC[NH2+]Cc1ccccc1O)c1ccccc1 ZINC000846017246 1131678488 /nfs/dbraw/zinc/67/84/88/1131678488.db2.gz BQHGKHXKSVCBHW-GOSISDBHSA-N 1 0 285.387 3.650 20 10 CHCDRO COc1ccc(O)c(C[NH2+]C2(c3ccccc3C)CCC2)c1 ZINC000845994879 1131679520 /nfs/dbraw/zinc/67/95/20/1131679520.db2.gz MAUATOGWBIDRFC-UHFFFAOYSA-N 1 0 297.398 3.878 20 10 CHCDRO COc1ccc(CCC[NH2+][C@@H]2CCc3cccc(O)c32)cc1 ZINC000834526794 1131682139 /nfs/dbraw/zinc/68/21/39/1131682139.db2.gz PEWSVRVWTWLPTJ-QGZVFWFLSA-N 1 0 297.398 3.611 20 10 CHCDRO Cc1cccc2c1OCC[C@H]2[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000834552191 1131682765 /nfs/dbraw/zinc/68/27/65/1131682765.db2.gz XIFVTQRTDMLPFL-HZPDHXFCSA-N 1 0 295.382 3.801 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H]2CCCC(F)(F)C2)c1O ZINC000846157004 1131692199 /nfs/dbraw/zinc/69/21/99/1131692199.db2.gz RISDDHMSSRJNIS-QWRGUYRKSA-N 1 0 285.334 3.629 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CC(C)(C)C(C)C)c1O ZINC000846163446 1131692961 /nfs/dbraw/zinc/69/29/61/1131692961.db2.gz HRPYDYLKIFWLEW-LBPRGKRZSA-N 1 0 265.397 3.734 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]C[C@@H](SC)C(C)(C)C)c1O ZINC000846166556 1131693179 /nfs/dbraw/zinc/69/31/79/1131693179.db2.gz ZEFLOADQTGBTOV-SMDDNHRTSA-N 1 0 297.464 3.829 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CC(C)(C)C2CCC2)c1O ZINC000846169736 1131693718 /nfs/dbraw/zinc/69/37/18/1131693718.db2.gz SJUBYDUAJPICLQ-GFCCVEGCSA-N 1 0 277.408 3.878 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]Cc2ccc(F)c(C)c2)c1O ZINC000846137038 1131693732 /nfs/dbraw/zinc/69/37/32/1131693732.db2.gz QQINVPFHNBBKRM-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]Cc2ccc(C)cc2)c1O ZINC000846135506 1131693808 /nfs/dbraw/zinc/69/38/08/1131693808.db2.gz DCTHFUKWBJFFMJ-ZDUSSCGKSA-N 1 0 271.360 3.560 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]Cc2ccc(C)c(F)c2)c1O ZINC000846136192 1131693848 /nfs/dbraw/zinc/69/38/48/1131693848.db2.gz JIQQXLJSQCXAQW-LBPRGKRZSA-N 1 0 289.350 3.699 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]C[C@H]2CCCCC2(F)F)c1O ZINC000846169357 1131693928 /nfs/dbraw/zinc/69/39/28/1131693928.db2.gz HEONUXDPSVWXKC-VXGBXAGGSA-N 1 0 299.361 3.877 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]Cc2cccc(C)c2)c1O ZINC000846135669 1131694168 /nfs/dbraw/zinc/69/41/68/1131694168.db2.gz FUVWDTASQYHOQA-ZDUSSCGKSA-N 1 0 271.360 3.560 20 10 CHCDRO CC[C@@H]1CCC[C@H]1[NH2+][C@H](C)c1cccc(OC)c1O ZINC000846143870 1131694656 /nfs/dbraw/zinc/69/46/56/1131694656.db2.gz AGGOVKXCOJZXTC-YRGRVCCFSA-N 1 0 263.381 3.630 20 10 CHCDRO CC[C@@H]1CCC[C@@H]1[NH2+][C@@H](C)c1cccc(OC)c1O ZINC000846143869 1131695104 /nfs/dbraw/zinc/69/51/04/1131695104.db2.gz AGGOVKXCOJZXTC-SCRDCRAPSA-N 1 0 263.381 3.630 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H](C)[C@](C)(O)c2ccccc2)c(O)c1 ZINC000846187845 1131697724 /nfs/dbraw/zinc/69/77/24/1131697724.db2.gz LPSNANGIFPGXFU-KHYOSLBOSA-N 1 0 299.414 3.647 20 10 CHCDRO C[C@H](COCC1CC1)[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000846203770 1131699818 /nfs/dbraw/zinc/69/98/18/1131699818.db2.gz BDCYZPKMHMFSAV-GHMZBOCLSA-N 1 0 283.799 3.511 20 10 CHCDRO COC1CCC(CC[NH2+][C@@H]2CCc3cccc(O)c32)CC1 ZINC000834766647 1131703903 /nfs/dbraw/zinc/70/39/03/1131703903.db2.gz WDRPVAJTBWRCGG-AVVWSFFYSA-N 1 0 289.419 3.564 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@H]1Cc3ccc(Cl)cc3C1)CC2 ZINC000834793991 1131706560 /nfs/dbraw/zinc/70/65/60/1131706560.db2.gz LOGGGDUKXSVCHI-JKSUJKDBSA-N 1 0 299.801 3.790 20 10 CHCDRO C[C@@H]1C[C@@H](CC[NH2+][C@H]2CCc3cccc(O)c32)C[C@H](C)O1 ZINC000834794117 1131706687 /nfs/dbraw/zinc/70/66/87/1131706687.db2.gz ORLFOERHPUEFIF-FQLMCAECSA-N 1 0 289.419 3.563 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCCC2CCOCC2)c(O)c1 ZINC000834817902 1131707710 /nfs/dbraw/zinc/70/77/10/1131707710.db2.gz FJHXFMPYKYNMBR-AWEZNQCLSA-N 1 0 277.408 3.558 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]C[C@@H]1CSc3ccccc31)CC2 ZINC000834819098 1131707753 /nfs/dbraw/zinc/70/77/53/1131707753.db2.gz SFDLLRXFJCKYJS-UKRRQHHQSA-N 1 0 297.423 3.859 20 10 CHCDRO C[C@@H]([NH2+]CC(C)(C)c1ccccn1)c1ccc(N(C)C)cc1 ZINC000834857057 1131713205 /nfs/dbraw/zinc/71/32/05/1131713205.db2.gz YMHIVWHLWFUVCV-OAHLLOKOSA-N 1 0 297.446 3.776 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCOC3(CCC3)C2)c(O)c1 ZINC000834882391 1131716836 /nfs/dbraw/zinc/71/68/36/1131716836.db2.gz JVXMDQORWLRIAK-CABCVRRESA-N 1 0 289.419 3.701 20 10 CHCDRO CC[C@H]([NH2+]C[C@@](C)(CC)OC)c1ccc(C)cc1O ZINC000834883176 1131717502 /nfs/dbraw/zinc/71/75/02/1131717502.db2.gz ZQWUEEBDEVZVNO-GOEBONIOSA-N 1 0 265.397 3.556 20 10 CHCDRO CCc1nc(C[NH2+][C@@H](C)c2ccc3ccccc3c2O)co1 ZINC000834896974 1131722136 /nfs/dbraw/zinc/72/21/36/1131722136.db2.gz DSODDPWPUWTCNJ-LBPRGKRZSA-N 1 0 296.370 3.947 20 10 CHCDRO CCCc1ncc(C[NH2+][C@H](CC)c2ccc(C)cc2O)o1 ZINC000834900956 1131725222 /nfs/dbraw/zinc/72/52/22/1131725222.db2.gz USDWPEUOJBZHNM-OAHLLOKOSA-N 1 0 288.391 3.882 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)[C@H](OC)C1CC1)c1ccc(C)cc1O ZINC000834901923 1131726759 /nfs/dbraw/zinc/72/67/59/1131726759.db2.gz BSFOUGOWXTXEIJ-PVUWLOKVSA-N 1 0 277.408 3.555 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]CCC[C@@H]2CCOC2)c1O ZINC000834906618 1131728703 /nfs/dbraw/zinc/72/87/03/1131728703.db2.gz YOVRQTABWLWIMD-CHWSQXEVSA-N 1 0 297.826 3.821 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCOC(C)(C)C2)c(O)c1 ZINC000834909107 1131730575 /nfs/dbraw/zinc/73/05/75/1131730575.db2.gz JBPSHAPAQXDNIO-UONOGXRCSA-N 1 0 277.408 3.556 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1C[C@H]1C1CC1)c1cc(Cl)ccc1O ZINC000834907174 1131730917 /nfs/dbraw/zinc/73/09/17/1131730917.db2.gz XZIQCZBQJZRAGW-CHIMOYNISA-N 1 0 265.784 3.742 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@H]2CC[C@H](C)O2)c1O ZINC000834913936 1131733983 /nfs/dbraw/zinc/73/39/83/1131733983.db2.gz JNIAMEKCYDCKGT-GVXVVHGQSA-N 1 0 283.799 3.572 20 10 CHCDRO CC[C@H]([NH2+]CCc1noc2ccccc12)c1ccccc1O ZINC000846844814 1131750538 /nfs/dbraw/zinc/75/05/38/1131750538.db2.gz PWBVIMIMUGLICL-HNNXBMFYSA-N 1 0 296.370 3.817 20 10 CHCDRO C[C@@H]1CCCCC[N@@H+]1Cc1ccc(Cl)cc1O ZINC001140465266 1131750633 /nfs/dbraw/zinc/75/06/33/1131750633.db2.gz LZSLHUZGJPRPKT-LLVKDONJSA-N 1 0 253.773 3.810 20 10 CHCDRO C[N@H+](Cc1ccc(Cl)cc1O)Cc1ccc(F)cc1F ZINC001140466166 1131751027 /nfs/dbraw/zinc/75/10/27/1131751027.db2.gz ZOAQETYHVLFTEY-UHFFFAOYSA-N 1 0 297.732 3.956 20 10 CHCDRO C[C@@H](CCc1ccco1)[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC000835033688 1131760448 /nfs/dbraw/zinc/76/04/48/1131760448.db2.gz WRALLKSOLTXLLK-NBUZRDOWSA-N 1 0 298.430 3.970 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]Cc2ccc(Cl)o2)cc1 ZINC000835033345 1131760776 /nfs/dbraw/zinc/76/07/76/1131760776.db2.gz SKRIHLPAMOWHBQ-ONEGZZNKSA-N 1 0 290.794 3.802 20 10 CHCDRO C[C@@H]1CC[N@H+](C/C=C\c2ccc(N(C)C)cc2)CCS1 ZINC000835049785 1131764990 /nfs/dbraw/zinc/76/49/90/1131764990.db2.gz STKOCIBOBBUGLU-FOSCPCJNSA-N 1 0 290.476 3.593 20 10 CHCDRO CCC(C)(C)OCC[NH2+]Cc1ccc2ccccc2c1O ZINC000835083770 1131769667 /nfs/dbraw/zinc/76/96/67/1131769667.db2.gz AFIRSWDANIDYNH-UHFFFAOYSA-N 1 0 287.403 3.840 20 10 CHCDRO Cc1ccc(O)c(C[N@H+]2CC[C@@H](C)C(F)(F)CC2)c1 ZINC001140617481 1131829721 /nfs/dbraw/zinc/82/97/21/1131829721.db2.gz QTOSULVHHTXPKN-GFCCVEGCSA-N 1 0 269.335 3.568 20 10 CHCDRO Cc1ccc(O)c(C[N@H+](C)Cc2ccc(C)c(C)c2)c1 ZINC001140623834 1131832667 /nfs/dbraw/zinc/83/26/67/1131832667.db2.gz UEBIBFAVUNQKPH-UHFFFAOYSA-N 1 0 269.388 3.949 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCCC(F)(F)C2)c1 ZINC000282786015 1131899886 /nfs/dbraw/zinc/89/98/86/1131899886.db2.gz PVJIKVVCQOGHQM-RYUDHWBXSA-N 1 0 299.361 3.877 20 10 CHCDRO CCCC[NH+](CCCC)Cc1ccc(O)c(C)c1O ZINC001140749209 1131906474 /nfs/dbraw/zinc/90/64/74/1131906474.db2.gz RNZYRNGOPSQDON-UHFFFAOYSA-N 1 0 265.397 3.808 20 10 CHCDRO CN(C)c1ccc(C[N@H+](CC2CC2)C2CC2)c(Cl)c1 ZINC001140926381 1131966310 /nfs/dbraw/zinc/96/63/10/1131966310.db2.gz LGTKOLJVNQVQDJ-UHFFFAOYSA-N 1 0 278.827 3.780 20 10 CHCDRO Cc1ccc(C[N@@H+]2CCc3ccc(C)cc3C2)c(O)c1 ZINC001140948028 1131968738 /nfs/dbraw/zinc/96/87/38/1131968738.db2.gz QCZHARJZXDNLDX-UHFFFAOYSA-N 1 0 267.372 3.567 20 10 CHCDRO Cc1ccc(C[N@@H+]2CC[C@@H](c3ccccc3)C2)c(O)c1 ZINC001140947987 1131969159 /nfs/dbraw/zinc/96/91/59/1131969159.db2.gz OKFVHVPMWVQRPC-MRXNPFEDSA-N 1 0 267.372 3.690 20 10 CHCDRO Cc1ccc(C[NH+]2CCC3(CCCC3)CC2)c(O)c1 ZINC001140947768 1131970557 /nfs/dbraw/zinc/97/05/57/1131970557.db2.gz FEAIJDYDPYKRKV-UHFFFAOYSA-N 1 0 259.393 3.857 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCc2c(F)cccc2C1)c1ccccc1O ZINC001171404105 1131971209 /nfs/dbraw/zinc/97/12/09/1131971209.db2.gz FPHQRZAMGKXTJS-JSGCOSHPSA-N 1 0 285.362 3.739 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCc2cccc(F)c2)c(O)c1 ZINC000036778587 1131975304 /nfs/dbraw/zinc/97/53/04/1131975304.db2.gz SUYBTLPGMRMGRV-ZDUSSCGKSA-N 1 0 273.351 3.733 20 10 CHCDRO Cc1cc(C)c(C[NH2+][C@@H]2CCc3c(F)cccc3C2)c(O)c1 ZINC001171412063 1131981537 /nfs/dbraw/zinc/98/15/37/1131981537.db2.gz RSJPNSSCIAURCS-OAHLLOKOSA-N 1 0 299.389 3.795 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)c1ccccc1O)c1ccc2c(c1)OCO2 ZINC000036982038 1131985485 /nfs/dbraw/zinc/98/54/85/1131985485.db2.gz MZXIFUIRUKYDSY-VXGBXAGGSA-N 1 0 285.343 3.533 20 10 CHCDRO C[C@H]([NH2+]CC1C[C@H]2CC[C@@H](C1)S2)c1cc(F)ccc1O ZINC000716073879 1132005115 /nfs/dbraw/zinc/00/51/15/1132005115.db2.gz VVNXLLBQVQYPBF-CRMUJIHISA-N 1 0 295.423 3.856 20 10 CHCDRO c1c(C[N@@H+]2CCCCC23CC3)cc2c3c1CCCN3CCC2 ZINC001141078509 1132007774 /nfs/dbraw/zinc/00/77/74/1132007774.db2.gz YRUSIGKZPHBOBU-UHFFFAOYSA-N 1 0 296.458 3.904 20 10 CHCDRO C[C@@H]([NH2+]C1CC(OCc2ccccc2)C1)c1ccccc1O ZINC000716210938 1132021740 /nfs/dbraw/zinc/02/17/40/1132021740.db2.gz CQXWORACCANJTI-ODIFPOPNSA-N 1 0 297.398 3.791 20 10 CHCDRO CN1CCOc2cc(C[N@H+](C)CC3CCCCC3)ccc21 ZINC001141143965 1132028088 /nfs/dbraw/zinc/02/80/88/1132028088.db2.gz QDUNYJYXMRCDCD-UHFFFAOYSA-N 1 0 288.435 3.527 20 10 CHCDRO C[N@H+](Cc1cc(O)ccc1O)C(C)(C)Cc1ccccc1 ZINC001141162662 1132031705 /nfs/dbraw/zinc/03/17/05/1132031705.db2.gz ZEVJTYFFJUEEPT-UHFFFAOYSA-N 1 0 285.387 3.551 20 10 CHCDRO Cc1csc(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)n1 ZINC000038090555 1132113190 /nfs/dbraw/zinc/11/31/90/1132113190.db2.gz OAFMBJHKTPYCLL-PWSUYJOCSA-N 1 0 288.416 3.804 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CSc2ccccc2C1)c1ccccc1O ZINC001172188750 1132136908 /nfs/dbraw/zinc/13/69/08/1132136908.db2.gz WDEDXLPGOVMSFL-TZMCWYRMSA-N 1 0 285.412 3.760 20 10 CHCDRO Cc1cccc(C[NH2+][C@H]2CSc3ccccc3C2)c1O ZINC001172205389 1132141290 /nfs/dbraw/zinc/14/12/90/1132141290.db2.gz VUKUCIRDFFRXIY-OAHLLOKOSA-N 1 0 285.412 3.507 20 10 CHCDRO Cc1cc(C)c(C[NH2+][C@@H]2CSc3ccccc3C2)c(O)c1 ZINC001172201552 1132148673 /nfs/dbraw/zinc/14/86/73/1132148673.db2.gz OESFYAPEYICDDE-HNNXBMFYSA-N 1 0 299.439 3.816 20 10 CHCDRO CCC[N@H+](Cc1ccc2c(n1)CCC2)Cc1ccccc1O ZINC000838810732 1132148950 /nfs/dbraw/zinc/14/89/50/1132148950.db2.gz YPNCGLWFHVHXQA-UHFFFAOYSA-N 1 0 296.414 3.688 20 10 CHCDRO CCOCC[C@H](C)[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001172428524 1132205551 /nfs/dbraw/zinc/20/55/51/1132205551.db2.gz ITABEQJDBWUYGG-INIZCTEOSA-N 1 0 290.451 3.534 20 10 CHCDRO C[C@H](c1ccccc1)[N@H+](CCCCO)Cc1ccccc1O ZINC000839532689 1132220988 /nfs/dbraw/zinc/22/09/88/1132220988.db2.gz ZKHFMUSLTKJDRE-MRXNPFEDSA-N 1 0 299.414 3.728 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)[C@H](C)CCOCC(C)C ZINC001172485279 1132230585 /nfs/dbraw/zinc/23/05/85/1132230585.db2.gz VRAQFZFIQGKPSE-OAHLLOKOSA-N 1 0 279.424 3.665 20 10 CHCDRO Oc1ccc2ccncc2c1C[N@@H+]1CC[C@H](C2CCC2)C1 ZINC000840187171 1132249111 /nfs/dbraw/zinc/24/91/11/1132249111.db2.gz ACFOLSZCFIFSGA-HNNXBMFYSA-N 1 0 282.387 3.562 20 10 CHCDRO Oc1cccc(C[NH2+][C@H]2CCC[C@@H](c3ccccc3)C2)c1O ZINC001172541157 1132277687 /nfs/dbraw/zinc/27/76/87/1132277687.db2.gz UJMGORGLAIDEMT-WBVHZDCISA-N 1 0 297.398 3.914 20 10 CHCDRO CO[C@@H]1C[C@H]([NH2+][C@@H](C)c2cc(Cl)ccc2O)C12CCC2 ZINC000840807283 1132290250 /nfs/dbraw/zinc/29/02/50/1132290250.db2.gz SCCZATCKSRTBJJ-NZVBXONLSA-N 1 0 295.810 3.654 20 10 CHCDRO COCC[C@H](C)C[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O ZINC000840836236 1132292017 /nfs/dbraw/zinc/29/20/17/1132292017.db2.gz WFBKPPHNFMLGSI-JQWIXIFHSA-N 1 0 285.815 3.677 20 10 CHCDRO COCC[C@H](C)C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000840834923 1132292570 /nfs/dbraw/zinc/29/25/70/1132292570.db2.gz BXORWWTVASCCNA-KBPBESRZSA-N 1 0 287.403 3.869 20 10 CHCDRO Oc1cccc(C[NH2+]C2CCC3(CCCC3)CC2)c1O ZINC001172724254 1132297264 /nfs/dbraw/zinc/29/72/64/1132297264.db2.gz PAPBBNPFVJPPIF-UHFFFAOYSA-N 1 0 275.392 3.690 20 10 CHCDRO C[C@H]([NH2+]CC(C)(C)c1cccnc1)c1ccc(N(C)C)cc1 ZINC000840892432 1132304188 /nfs/dbraw/zinc/30/41/88/1132304188.db2.gz SCXTXAUHPWAIHC-HNNXBMFYSA-N 1 0 297.446 3.776 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H](C)c1ccccn1 ZINC000840895347 1132305712 /nfs/dbraw/zinc/30/57/12/1132305712.db2.gz XFVGRPURPRTPSJ-HOTGVXAUSA-N 1 0 297.446 3.738 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H]2CC=CCC2)c(Cl)c1 ZINC000840899216 1132306269 /nfs/dbraw/zinc/30/62/69/1132306269.db2.gz MBIGZSCGXUBCGR-LLVKDONJSA-N 1 0 251.757 3.552 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H]2CCO[C@@H](C(C)C)C2)c(Cl)c1 ZINC000840908859 1132307131 /nfs/dbraw/zinc/30/71/31/1132307131.db2.gz YLZDAPYLVGZNDS-MLGOLLRUSA-N 1 0 297.826 3.647 20 10 CHCDRO COC1CCC([N@H+](C)Cc2c(O)cc(C)cc2Cl)CC1 ZINC000840915389 1132308654 /nfs/dbraw/zinc/30/86/54/1132308654.db2.gz QFRJFQHFQAAYDA-UHFFFAOYSA-N 1 0 297.826 3.743 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)cc1C)c1nccs1 ZINC000840934400 1132309394 /nfs/dbraw/zinc/30/93/94/1132309394.db2.gz POOQIWCUUQJIBR-OAHLLOKOSA-N 1 0 289.448 3.758 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](c1cccnc1)C1CC1 ZINC000840936957 1132310437 /nfs/dbraw/zinc/31/04/37/1132310437.db2.gz OUDREDJBGJIDOU-LJQANCHMSA-N 1 0 295.430 3.697 20 10 CHCDRO CCn1ccc(C[N@H+](C)Cc2ccc(N(C)C)cc2C)c1 ZINC000840942282 1132311320 /nfs/dbraw/zinc/31/13/20/1132311320.db2.gz XWLSQGAJYPFBCX-UHFFFAOYSA-N 1 0 285.435 3.514 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@@H]1c1cccnc1 ZINC000840947033 1132312264 /nfs/dbraw/zinc/31/22/64/1132312264.db2.gz ZPMXARXMJZQBCC-LJQANCHMSA-N 1 0 295.430 3.793 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@H]2CCOC(C)(C)C2)c(Cl)c1 ZINC000840953816 1132313667 /nfs/dbraw/zinc/31/36/67/1132313667.db2.gz ZPDXVCMNYQCWOQ-LBPRGKRZSA-N 1 0 297.826 3.649 20 10 CHCDRO CC(C)(C[NH2+]Cc1cc(Cl)ccc1O)c1cccnc1 ZINC000840974517 1132316700 /nfs/dbraw/zinc/31/67/00/1132316700.db2.gz CDDMYOJCVFSPHG-UHFFFAOYSA-N 1 0 290.794 3.508 20 10 CHCDRO CCCCOC1C[NH+](Cc2c(O)ccc3ccccc32)C1 ZINC001231589379 1132319098 /nfs/dbraw/zinc/31/90/98/1132319098.db2.gz DRPMFTSJKWSKEZ-UHFFFAOYSA-N 1 0 285.387 3.546 20 10 CHCDRO Cc1cc(Cl)cc(CNc2ccc([C@@H](C)[NH3+])cc2)c1O ZINC000841027354 1132321041 /nfs/dbraw/zinc/32/10/41/1132321041.db2.gz ABMZYBOOMJUWBP-LLVKDONJSA-N 1 0 290.794 3.986 20 10 CHCDRO C[C@H](Cc1ccc(Cl)cc1)[NH2+]CCc1ccc(N)cc1 ZINC000841036976 1132321171 /nfs/dbraw/zinc/32/11/71/1132321171.db2.gz XREWLKWLSXGCKJ-CYBMUJFWSA-N 1 0 288.822 3.686 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCc3cccc(Cl)c3C2)c1O ZINC001231594159 1132321775 /nfs/dbraw/zinc/32/17/75/1132321775.db2.gz UNRNMWDUVCPSKP-UHFFFAOYSA-N 1 0 287.790 3.912 20 10 CHCDRO C[NH2+]Cc1ccccc1NC/C=C/c1ccc(N(C)C)cc1 ZINC000841043834 1132324856 /nfs/dbraw/zinc/32/48/56/1132324856.db2.gz VTGRJXFACSYEBN-VOTSOKGWSA-N 1 0 295.430 3.597 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]Cc2cc(C)cc(N)c2)cc1 ZINC000841072945 1132326604 /nfs/dbraw/zinc/32/66/04/1132326604.db2.gz OBHFHJJMXGLTJV-UHFFFAOYSA-N 1 0 297.446 3.713 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCC[C@H](c3ccccn3)C2)c(O)c1 ZINC001231845636 1132378134 /nfs/dbraw/zinc/37/81/34/1132378134.db2.gz DVYXICYBVHSDRM-INIZCTEOSA-N 1 0 296.414 3.784 20 10 CHCDRO CCC[N@H+](CCc1ccccn1)Cc1c(C)cc(C)cc1O ZINC001231849670 1132378534 /nfs/dbraw/zinc/37/85/34/1132378534.db2.gz UMQOPSFUSZAXCF-UHFFFAOYSA-N 1 0 298.430 3.859 20 10 CHCDRO COc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@H](C)[C@@H](C)C1 ZINC001231849411 1132378562 /nfs/dbraw/zinc/37/85/62/1132378562.db2.gz SGSBCSGXVOAHJA-GJZGRUSLSA-N 1 0 290.451 3.629 20 10 CHCDRO Cc1cc(C)c(C[N@@H+](C)Cc2ccc(N(C)C)cc2)c(O)c1 ZINC001231849643 1132378903 /nfs/dbraw/zinc/37/89/03/1132378903.db2.gz TYZZFAWKEBYMHN-UHFFFAOYSA-N 1 0 298.430 3.707 20 10 CHCDRO COc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@@H](C)[C@H](C)C1 ZINC001231849412 1132379754 /nfs/dbraw/zinc/37/97/54/1132379754.db2.gz SGSBCSGXVOAHJA-HUUCEWRRSA-N 1 0 290.451 3.629 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](C(C)C)C2CCOCC2)cc1Cl ZINC001231870918 1132383538 /nfs/dbraw/zinc/38/35/38/1132383538.db2.gz DLDBNIZLDPURBV-UHFFFAOYSA-N 1 0 297.826 3.743 20 10 CHCDRO Cc1cc(O)c(C[NH+]2CCC(CF)CC2)cc1Cl ZINC001231870515 1132384483 /nfs/dbraw/zinc/38/44/83/1132384483.db2.gz HDWJICWDACCCHW-UHFFFAOYSA-N 1 0 271.763 3.536 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)CCC2CC2)cc1Cl ZINC001231870397 1132385577 /nfs/dbraw/zinc/38/55/77/1132385577.db2.gz YHQVEWKUPWNEJL-UHFFFAOYSA-N 1 0 253.773 3.586 20 10 CHCDRO C[C@H](C[NH2+][C@H](C)c1ccc(Cl)cc1O)c1nccs1 ZINC000841751601 1132389390 /nfs/dbraw/zinc/38/93/90/1132389390.db2.gz IFJHOUFAEYDTQL-NXEZZACHSA-N 1 0 296.823 3.956 20 10 CHCDRO C[C@@H]([NH2+]CCOC1CCCC1)c1ccc(Cl)cc1O ZINC000841748685 1132389505 /nfs/dbraw/zinc/38/95/05/1132389505.db2.gz YDTFVSUMUCOLRA-LLVKDONJSA-N 1 0 283.799 3.655 20 10 CHCDRO CCCOC1CCC([N@H+](C)Cc2ccccc2O)CC1 ZINC001173100497 1132390900 /nfs/dbraw/zinc/39/09/00/1132390900.db2.gz GQWYARGAKJEVLC-UHFFFAOYSA-N 1 0 277.408 3.562 20 10 CHCDRO Oc1c(C[NH+]2CCC3(CCOC3)CC2)ccc2ccccc21 ZINC001231879710 1132391420 /nfs/dbraw/zinc/39/14/20/1132391420.db2.gz PGMHQDCZFKXCLV-UHFFFAOYSA-N 1 0 297.398 3.548 20 10 CHCDRO C[C@@]1(CO)CCC[N@H+](Cc2ccc3ccccc3c2O)CC1 ZINC001231879587 1132391805 /nfs/dbraw/zinc/39/18/05/1132391805.db2.gz JCLRLWCMZGVFGS-LJQANCHMSA-N 1 0 299.414 3.530 20 10 CHCDRO CC[C@H]([NH2+][C@H]1COCc2ccccc21)c1ccccc1O ZINC000841758368 1132393461 /nfs/dbraw/zinc/39/34/61/1132393461.db2.gz AOTZWCWURABLGJ-IRXDYDNUSA-N 1 0 283.371 3.704 20 10 CHCDRO C[C@@H]([NH2+]CCCC[N@H+](C)C1CC1)c1ccc(Cl)cc1[O-] ZINC000841757992 1132393619 /nfs/dbraw/zinc/39/36/19/1132393619.db2.gz QXFGYOUZLWNKKE-GFCCVEGCSA-N 1 0 296.842 3.571 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2COCc3ccccc32)c(O)c1 ZINC000841759844 1132394005 /nfs/dbraw/zinc/39/40/05/1132394005.db2.gz IUVMASVQXHQDOB-SUMWQHHRSA-N 1 0 283.371 3.623 20 10 CHCDRO CC(C)n1ccc(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)n1 ZINC000841764541 1132395925 /nfs/dbraw/zinc/39/59/25/1132395925.db2.gz QDHGGQJZMNMKGK-NSHDSACASA-N 1 0 293.798 3.674 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2COCc3ccccc32)c(O)c1C ZINC000841761632 1132396654 /nfs/dbraw/zinc/39/66/54/1132396654.db2.gz QAFQHHWYRIUSIK-KSSFIOAISA-N 1 0 297.398 3.931 20 10 CHCDRO CCc1ccc(C[C@H](C)[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC001173236444 1132412666 /nfs/dbraw/zinc/41/26/66/1132412666.db2.gz XGTDWVFPULGKSU-HNNXBMFYSA-N 1 0 295.426 3.905 20 10 CHCDRO CCCC[C@@H](CC(C)C)[NH2+]CCc1cc(O)c(O)cc1O ZINC001173249777 1132420361 /nfs/dbraw/zinc/42/03/61/1132420361.db2.gz JZZVQNICZVBXFW-AWEZNQCLSA-N 1 0 295.423 3.540 20 10 CHCDRO CCCC[C@@H](CC(C)C)[NH2+]Cc1ccc(O)c(O)c1 ZINC001173253091 1132422492 /nfs/dbraw/zinc/42/24/92/1132422492.db2.gz MMEXBHKMVPSUFU-AWEZNQCLSA-N 1 0 265.397 3.792 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CC[C@H]3C[C@H]3C2)c(O)c1 ZINC000842929586 1132478185 /nfs/dbraw/zinc/47/81/85/1132478185.db2.gz PFLDLTFKZIZWEK-ZQDZILKHSA-N 1 0 259.393 3.848 20 10 CHCDRO CCC[N@H+](CCOC)Cc1cccc(C(C)(C)C)c1O ZINC001143104045 1132502350 /nfs/dbraw/zinc/50/23/50/1132502350.db2.gz ONCPGZPDYWNHGK-UHFFFAOYSA-N 1 0 279.424 3.548 20 10 CHCDRO CC(C)(C)c1cccc(C[N@@H+]2CCc3cccnc3C2)c1O ZINC001143111311 1132503956 /nfs/dbraw/zinc/50/39/56/1132503956.db2.gz ARJDWYRHTPEWOD-UHFFFAOYSA-N 1 0 296.414 3.643 20 10 CHCDRO CC(C)(C)c1cccc(C[N@@H+]2CC[C@]3(CC3(F)F)C2)c1O ZINC001143111133 1132504702 /nfs/dbraw/zinc/50/47/02/1132504702.db2.gz YUVNJEDCUPDIMT-INIZCTEOSA-N 1 0 295.373 3.921 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCCC3(CCCC3)C2)c(O)c1 ZINC001232835332 1132529152 /nfs/dbraw/zinc/52/91/52/1132529152.db2.gz ATERRXZQSOFWQO-UHFFFAOYSA-N 1 0 288.435 3.614 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CC3(CC=CC3)[C@@H]2C(C)C)c1 ZINC000843432103 1132531662 /nfs/dbraw/zinc/53/16/62/1132531662.db2.gz QOOXWHZGGYRVEU-KRWDZBQOSA-N 1 0 287.403 3.577 20 10 CHCDRO CC(C)CC[NH+](CCC(C)C)Cc1cc(O)c(O)c(O)c1 ZINC001233015406 1132562557 /nfs/dbraw/zinc/56/25/57/1132562557.db2.gz MLWNMYNRRLFVHH-UHFFFAOYSA-N 1 0 295.423 3.698 20 10 CHCDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CCC[C@@H](CF)C2)c1 ZINC001233286340 1132594240 /nfs/dbraw/zinc/59/42/40/1132594240.db2.gz PJIMALZNUMJWSE-ZDUSSCGKSA-N 1 0 279.399 3.871 20 10 CHCDRO Oc1cc(C(F)(F)F)ccc1C[N@@H+]1CCCC[C@H](F)C1 ZINC001233452519 1132626040 /nfs/dbraw/zinc/62/60/40/1132626040.db2.gz ZLNCXKCVUHBERY-LBPRGKRZSA-N 1 0 291.288 3.735 20 10 CHCDRO CC[C@@H](C)[N@H+](C)Cc1ccc(C(F)(F)F)cc1O ZINC001233452537 1132626301 /nfs/dbraw/zinc/62/63/01/1132626301.db2.gz AICKHVOWAKINIQ-SECBINFHSA-N 1 0 261.287 3.641 20 10 CHCDRO C[C@@H]1CCCC[N@@H+]1Cc1cccc(OC(F)(F)F)c1O ZINC001233727136 1132671736 /nfs/dbraw/zinc/67/17/36/1132671736.db2.gz JCGGTAQEDBPQIP-SNVBAGLBSA-N 1 0 289.297 3.665 20 10 CHCDRO Nc1ccc(Cc2ccc(NC=C3CC[NH2+]CC3)cc2)cc1 ZINC001159703417 1132895347 /nfs/dbraw/zinc/89/53/47/1132895347.db2.gz JQIFTUAQIIDEPB-UHFFFAOYSA-N 1 0 293.414 3.539 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)C[C@H]2C[C@@H]2c2ccccc2)cc1 ZINC001204146077 1132953009 /nfs/dbraw/zinc/95/30/09/1132953009.db2.gz RRUOZWZVGDKTRE-UYAOXDASSA-N 1 0 294.442 3.988 20 10 CHCDRO CCOc1cccc(C[N@H+](C)CCc2cccc(C)c2)c1O ZINC001203609015 1133344510 /nfs/dbraw/zinc/34/45/10/1133344510.db2.gz GDTVNNOMAGHWDT-UHFFFAOYSA-N 1 0 299.414 3.774 20 10 CHCDRO COc1ccc(C[N@@H+]2CC[C@H](C3CCCCC3)C2)c(O)c1 ZINC001203629330 1133346097 /nfs/dbraw/zinc/34/60/97/1133346097.db2.gz WOQDGARIUNGGFF-HNNXBMFYSA-N 1 0 289.419 3.803 20 10 CHCDRO CC[N@H+](Cc1ccc(F)cc1)Cc1ccc(OC)cc1O ZINC001203628911 1133346253 /nfs/dbraw/zinc/34/62/53/1133346253.db2.gz KQRDHDMLJLRYIY-UHFFFAOYSA-N 1 0 289.350 3.562 20 10 CHCDRO CN(c1ccc(N)cc1)c1ccc(C[NH+]2CCCC2)cc1 ZINC001203827018 1133374283 /nfs/dbraw/zinc/37/42/83/1133374283.db2.gz SKYIALYONWQCPH-UHFFFAOYSA-N 1 0 281.403 3.633 20 10 CHCDRO Oc1ccc(C[N@@H+]2CCCC[C@@H]2c2ccccc2)cc1O ZINC001203875378 1133378148 /nfs/dbraw/zinc/37/81/48/1133378148.db2.gz MZTFVVTZOXDFTQ-MRXNPFEDSA-N 1 0 283.371 3.825 20 10 CHCDRO Oc1ccc(C[NH+]2CCC(Cc3ccccc3)CC2)cc1O ZINC001203874449 1133378678 /nfs/dbraw/zinc/37/86/78/1133378678.db2.gz YMXOZLWHHXAQFV-UHFFFAOYSA-N 1 0 297.398 3.553 20 10 CHCDRO CC[N@H+](Cc1ccc(F)cc1)Cc1ccc(N(C)C)cc1 ZINC001203915368 1133384809 /nfs/dbraw/zinc/38/48/09/1133384809.db2.gz REMXGSAENFOFCC-UHFFFAOYSA-N 1 0 286.394 3.914 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCCC[C@H]2C)cc1 ZINC001203936227 1133385979 /nfs/dbraw/zinc/38/59/79/1133385979.db2.gz KRDKDKCKLDQFOH-OAHLLOKOSA-N 1 0 260.425 3.907 20 10 CHCDRO CCC[C@@H]1CCCC[N@@H+]1Cc1ccc(N(C)C)cc1 ZINC001203933698 1133387125 /nfs/dbraw/zinc/38/71/25/1133387125.db2.gz GIYGQLGFHGMLOQ-QGZVFWFLSA-N 1 0 260.425 3.907 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)CCC2CC2)cc1 ZINC001203942118 1133387403 /nfs/dbraw/zinc/38/74/03/1133387403.db2.gz LJQGUZVIRCNKQV-UHFFFAOYSA-N 1 0 260.425 3.765 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2C[C@@H]3C[C@@H]3[C@@H](F)C2)c2ccccc21 ZINC001204236977 1133422885 /nfs/dbraw/zinc/42/28/85/1133422885.db2.gz ZATNEDKKHYKRLF-WBAXXEDZSA-N 1 0 298.405 3.696 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[N@@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC001204319846 1133437224 /nfs/dbraw/zinc/43/72/24/1133437224.db2.gz HTAFZEACNRAANY-CALCHBBNSA-N 1 0 270.420 3.519 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2ccc(N3CCCC3)cc2)C2(CC2)C1 ZINC001204328814 1133438838 /nfs/dbraw/zinc/43/88/38/1133438838.db2.gz OHWBFCGMFCITFI-HNNXBMFYSA-N 1 0 270.420 3.661 20 10 CHCDRO Cc1ccc(C[N@@H+]2CCCc3cc(O)c(O)cc3C2)cc1C ZINC001204355665 1133439150 /nfs/dbraw/zinc/43/91/50/1133439150.db2.gz RFFRVCWETGDGLC-UHFFFAOYSA-N 1 0 297.398 3.663 20 10 CHCDRO CCc1cccc(C[N@@H+]2CCS[C@H]3CCCC[C@H]32)c1O ZINC001204542808 1133461551 /nfs/dbraw/zinc/46/15/51/1133461551.db2.gz IOVUFLHBEHDGKE-CVEARBPZSA-N 1 0 291.460 3.815 20 10 CHCDRO CC[N@H+](C/C=C/c1ccc(N(C)C)cc1)CC(C)C ZINC001204880867 1133494994 /nfs/dbraw/zinc/49/49/94/1133494994.db2.gz JJZCKFBBGMDQGX-BQYQJAHWSA-N 1 0 260.425 3.744 20 10 CHCDRO Cc1ccc(C[NH2+]CCCc2ccccc2F)c(O)c1 ZINC001205621488 1133596212 /nfs/dbraw/zinc/59/62/12/1133596212.db2.gz LHFSMDNOHSLAFU-UHFFFAOYSA-N 1 0 273.351 3.562 20 10 CHCDRO C[C@@H]1CC[C@@H](C)[C@H]([NH2+]Cc2cc(Cl)ccc2O)C1 ZINC001206517426 1133712892 /nfs/dbraw/zinc/71/28/92/1133712892.db2.gz SYJPATMLBHDLKH-JTNHKYCSSA-N 1 0 267.800 3.960 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H]2[C@H]3Cc4cc(Cl)ccc4[C@@H]23)c(O)c1 ZINC001206743478 1133740528 /nfs/dbraw/zinc/74/05/28/1133740528.db2.gz TZCWOHCBGJTLEE-CGTJXYLNSA-N 1 0 299.801 3.782 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)cc1Cl ZINC001206762798 1133745019 /nfs/dbraw/zinc/74/50/19/1133745019.db2.gz PWJBYROYURDSFG-FRRDWIJNSA-N 1 0 279.811 3.880 20 10 CHCDRO Oc1cc2c(cc1O)C[N@H+](CCC1CCCCC1)CCC2 ZINC001207261281 1133784369 /nfs/dbraw/zinc/78/43/69/1133784369.db2.gz RIWYDRZDNCUNJW-UHFFFAOYSA-N 1 0 289.419 3.816 20 10 CHCDRO C[N@@H+](Cc1ccc(N2CCCC2)cc1)C[C@H]1C[C@H]2C=C[C@@H]1C2 ZINC001207626753 1133832118 /nfs/dbraw/zinc/83/21/18/1133832118.db2.gz KZSPEFAPBJYXPB-IPMKNSEASA-N 1 0 296.458 3.931 20 10 CHCDRO CC(C)c1ccc(O)c(C[N@@H+]2C[C@H]3CSC[C@@]3(C)C2)c1 ZINC001207739114 1133843244 /nfs/dbraw/zinc/84/32/44/1133843244.db2.gz XQRJKZOZNFKRSX-DOTOQJQBSA-N 1 0 291.460 3.701 20 10 CHCDRO CC[N@H+](Cc1ccc2cc[nH]c2c1)Cc1ccccc1O ZINC001209515618 1134032690 /nfs/dbraw/zinc/03/26/90/1134032690.db2.gz XDBMVQVCOXVISE-UHFFFAOYSA-N 1 0 280.371 3.896 20 10 CHCDRO C[C@H]1C[N@H+](Cc2cc(F)ccc2O)CCc2ccccc21 ZINC000404789710 1134949745 /nfs/dbraw/zinc/94/97/45/1134949745.db2.gz NOXKOGMAILICOW-ZDUSSCGKSA-N 1 0 285.362 3.693 20 10 CHCDRO C[C@@H]1C[NH2+]C[C@@H]1OC1=CC(=O)C=CC1=NNc1ccccc1 ZINC001217967951 1135032713 /nfs/dbraw/zinc/03/27/13/1135032713.db2.gz KQLCJIXNSZKVBE-KHUIJWLCSA-N 1 0 297.358 3.794 20 10 CHCDRO C[C@H](OC1=CC(=O)C=CC1=NNc1ccccc1)C1C[NH2+]C1 ZINC001218198238 1135068407 /nfs/dbraw/zinc/06/84/07/1135068407.db2.gz FJAVEXPMXFPIEY-IVGVGDLQSA-N 1 0 297.358 3.794 20 10 CHCDRO C[C@H]1[NH2+]C[C@H]1OC1=CC(=O)C=CC1=NNc1ccccc1 ZINC001218394509 1135098500 /nfs/dbraw/zinc/09/85/00/1135098500.db2.gz YGNUQSIOTLQSOH-SSRVBLDWSA-N 1 0 283.331 3.547 20 10 CHCDRO FC1(F)CC[C@@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000315066510 1135151093 /nfs/dbraw/zinc/15/10/93/1135151093.db2.gz DYTDOVGJUCDGGR-OAHLLOKOSA-N 1 0 294.389 3.954 20 10 CHCDRO COC1(CC[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)CCC1 ZINC000315246653 1135151716 /nfs/dbraw/zinc/15/17/16/1135151716.db2.gz RGNRUPFHJYLOAP-KBPBESRZSA-N 1 0 289.419 3.798 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]CCCOC1CCCCC1)CC2 ZINC000315450344 1135154711 /nfs/dbraw/zinc/15/47/11/1135154711.db2.gz KFMXZHCHFQVGIW-MRXNPFEDSA-N 1 0 289.419 3.709 20 10 CHCDRO CC1(C[NH2+]Cc2cc(Cl)ccc2O)CCCC1 ZINC000104438723 186002291 /nfs/dbraw/zinc/00/22/91/186002291.db2.gz BOLXCSASKCBZGK-UHFFFAOYSA-N 1 0 253.773 3.716 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cccs1 ZINC000020146052 171031811 /nfs/dbraw/zinc/03/18/11/171031811.db2.gz WOKDIDPIOMPFDO-LBPRGKRZSA-N 1 0 260.406 3.665 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2)c(O)c1 ZINC000020146140 171032040 /nfs/dbraw/zinc/03/20/40/171032040.db2.gz ARAUMDVEEUJMAJ-CQSZACIVSA-N 1 0 284.403 3.617 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2ccccn2)c1 ZINC000035628780 172307776 /nfs/dbraw/zinc/30/77/76/172307776.db2.gz JIVMJJFNBNQFQW-STQMWFEESA-N 1 0 256.349 3.507 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)C1CC1)c1ccc2ccccc2c1O ZINC000035733327 172385015 /nfs/dbraw/zinc/38/50/15/172385015.db2.gz KISHOLLKQCIINH-NWDGAFQWSA-N 1 0 255.361 3.995 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCCOC1)c1ccc2ccccc2c1O ZINC000038044032 174051699 /nfs/dbraw/zinc/05/16/99/174051699.db2.gz DCWDXJCFMJODSX-UONOGXRCSA-N 1 0 285.387 3.623 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2ccc(F)c(Cl)c2)c1 ZINC000071409252 176156699 /nfs/dbraw/zinc/15/66/99/176156699.db2.gz XYAODNCHLNLSKE-UHFFFAOYSA-N 1 0 279.742 3.783 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccccc1O)c1cccc(OC(F)F)c1 ZINC000036935076 260053839 /nfs/dbraw/zinc/05/38/39/260053839.db2.gz CYXOSNWYTHFQGO-LLVKDONJSA-N 1 0 293.313 3.844 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@H](C)c2ccc(F)cc2F)c1 ZINC000036952684 260056468 /nfs/dbraw/zinc/05/64/68/260056468.db2.gz AJKCRCUWRLIEGR-SNVBAGLBSA-N 1 0 293.313 3.530 20 10 CHCDRO c1ccc2c(c1)SCC[C@@H]2[NH2+]Cc1ccc2c(c1)CCO2 ZINC000037363502 260094858 /nfs/dbraw/zinc/09/48/58/260094858.db2.gz CMZOFDYNZVEARU-INIZCTEOSA-N 1 0 297.423 3.948 20 10 CHCDRO CC[C@H](COC)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000079737414 260176925 /nfs/dbraw/zinc/17/69/25/260176925.db2.gz AXJILDIAQNQPLA-TZMCWYRMSA-N 1 0 273.376 3.621 20 10 CHCDRO Oc1ccccc1C[NH2+]C1(c2cccc(Cl)c2)CC1 ZINC000077467855 260297134 /nfs/dbraw/zinc/29/71/34/260297134.db2.gz MYSUMABQJFGXLL-UHFFFAOYSA-N 1 0 273.763 3.825 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(C)c(OC)c1)c1ccccc1O ZINC000155385765 261101289 /nfs/dbraw/zinc/10/12/89/261101289.db2.gz IKTHUFWCFUIDCB-MRXNPFEDSA-N 1 0 285.387 3.950 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)Cc1c(C)noc1C)c1ccccc1O ZINC000155925337 261110144 /nfs/dbraw/zinc/11/01/44/261110144.db2.gz JXTCIJJXXFZRPV-MEDUHNTESA-N 1 0 288.391 3.669 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](C)c1c(C)noc1C)c1ccccc1O ZINC000156866933 261134100 /nfs/dbraw/zinc/13/41/00/261134100.db2.gz AJVHYHUHAAZGAY-XHDPSFHLSA-N 1 0 288.391 3.841 20 10 CHCDRO CCOCc1ccc(C[NH2+][C@H](C)c2ccccc2O)cc1 ZINC000183410255 261973434 /nfs/dbraw/zinc/97/34/34/261973434.db2.gz NDPGFEBKXIHRKA-CQSZACIVSA-N 1 0 285.387 3.780 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)c2ccc(C)cc2O)cc1F ZINC000184927837 262034241 /nfs/dbraw/zinc/03/42/41/262034241.db2.gz RBNJLIOAUFBIJG-LBPRGKRZSA-N 1 0 289.350 3.699 20 10 CHCDRO CC(=O)Nc1cccc(C[NH2+][C@@H](C)c2cc(C)ccc2O)c1 ZINC000185020831 262038199 /nfs/dbraw/zinc/03/81/99/262038199.db2.gz PPVAWLMNQCPNOJ-ZDUSSCGKSA-N 1 0 298.386 3.510 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(Cl)nc2)c1 ZINC000185073994 262040495 /nfs/dbraw/zinc/04/04/95/262040495.db2.gz ZQNHVCXAGOCDMX-LLVKDONJSA-N 1 0 276.767 3.600 20 10 CHCDRO CCOc1ccccc1C[NH2+][C@H](C)c1cc(C)ccc1O ZINC000185103462 262041084 /nfs/dbraw/zinc/04/10/84/262041084.db2.gz QFHUCNOYWLNGTO-CQSZACIVSA-N 1 0 285.387 3.950 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc([C@@H](C)O)cc2)c(O)c1 ZINC000185120262 262042563 /nfs/dbraw/zinc/04/25/63/262042563.db2.gz SLPVOQZRELCGNB-UONOGXRCSA-N 1 0 285.387 3.605 20 10 CHCDRO COc1cc(C[NH2+][C@@H](C)c2cc(C)ccc2O)ccc1C ZINC000185193183 262045108 /nfs/dbraw/zinc/04/51/08/262045108.db2.gz QHVMTCAASQMCSJ-AWEZNQCLSA-N 1 0 285.387 3.868 20 10 CHCDRO C[C@@H]([NH2+][C@H]1[C@@H]2CCO[C@@H]2C1(C)C)c1cc(Cl)ccc1O ZINC000185534290 262058605 /nfs/dbraw/zinc/05/86/05/262058605.db2.gz KQRHFUGRCSJOEH-GQANPOSXSA-N 1 0 295.810 3.510 20 10 CHCDRO C[C@@H]([NH2+]C1CCSCC1)c1cc(Cl)ccc1O ZINC000185978675 262074205 /nfs/dbraw/zinc/07/42/05/262074205.db2.gz UGOZPMXDKOCFHP-SECBINFHSA-N 1 0 271.813 3.592 20 10 CHCDRO COC[C@H]([NH2+][C@@H](C)c1cc(F)ccc1O)c1ccccc1 ZINC000186035455 262075968 /nfs/dbraw/zinc/07/59/68/262075968.db2.gz NHEBICJCAPTJRV-LRDDRELGSA-N 1 0 289.350 3.570 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCOC2(CCCC2)C1)c1cc(F)ccc1O ZINC000186130151 262080871 /nfs/dbraw/zinc/08/08/71/262080871.db2.gz ZGZKOAMUOBOERS-TZMCWYRMSA-N 1 0 293.382 3.674 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCOC3(CCCC3)C2)c(O)c1 ZINC000186129705 262081161 /nfs/dbraw/zinc/08/11/61/262081161.db2.gz YJIVNXFTHZRFDI-HUUCEWRRSA-N 1 0 289.419 3.843 20 10 CHCDRO Cc1noc(C)c1[C@H](C)C[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000186158343 262082596 /nfs/dbraw/zinc/08/25/96/262082596.db2.gz NCQCGRSHQSQXOV-ZJUUUORDSA-N 1 0 292.354 3.590 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(C(C)(C)O)cc2)c1 ZINC000186612934 262101758 /nfs/dbraw/zinc/10/17/58/262101758.db2.gz CNZNSJPTKLWUGQ-AWEZNQCLSA-N 1 0 299.414 3.779 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(C(C)(C)O)cc2)c1 ZINC000186612918 262101880 /nfs/dbraw/zinc/10/18/80/262101880.db2.gz CNZNSJPTKLWUGQ-CQSZACIVSA-N 1 0 299.414 3.779 20 10 CHCDRO CSCCCCC[NH2+][C@@H](C)c1ccccc1O ZINC000186774116 262109526 /nfs/dbraw/zinc/10/95/26/262109526.db2.gz JFNAZHJWNHUWBF-LBPRGKRZSA-N 1 0 253.411 3.576 20 10 CHCDRO C[C@@H]([NH2+]C[C@H](C)c1nccs1)c1ccc(N(C)C)cc1 ZINC000186737977 262321702 /nfs/dbraw/zinc/32/17/02/262321702.db2.gz GJTPUJYIUBPCDB-QWHCGFSZSA-N 1 0 289.448 3.663 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1CCC(F)(F)C1)c1ccccc1O ZINC000281226270 263067405 /nfs/dbraw/zinc/06/74/05/263067405.db2.gz VJKPEQXCRUXUHS-DGCLKSJQSA-N 1 0 269.335 3.868 20 10 CHCDRO Oc1ccccc1C[N@H+](CCCCCF)C[C@H]1CCCO1 ZINC000284050828 263085415 /nfs/dbraw/zinc/08/54/15/263085415.db2.gz JPNZILVBUKICCR-MRXNPFEDSA-N 1 0 295.398 3.513 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CN(C)Cc3ccccc32)c(O)c1 ZINC000370375081 267313495 /nfs/dbraw/zinc/31/34/95/267313495.db2.gz QWWMVJFOAANCDB-KDOFPFPSSA-N 1 0 296.414 3.538 20 10 CHCDRO COC(C)(C)C[C@@H](C)[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000185564336 327841049 /nfs/dbraw/zinc/84/10/49/327841049.db2.gz MQONWBZYBFYEOM-OLZOCXBDSA-N 1 0 265.397 3.555 20 10 CHCDRO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccccc2O)cc1 ZINC000090339504 327094156 /nfs/dbraw/zinc/09/41/56/327094156.db2.gz MBTJCKHUELCVNA-OLZOCXBDSA-N 1 0 271.360 3.813 20 10 CHCDRO C[C@@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1cc(Cl)ccc1O ZINC000377408001 329014371 /nfs/dbraw/zinc/01/43/71/329014371.db2.gz OHDFMOXIBNRVPJ-MGPLVRAMSA-N 1 0 289.762 3.657 20 10 CHCDRO COc1cccc2c1OCC[C@H]2[NH2+][C@H](C)c1ccccc1O ZINC000378630015 329057142 /nfs/dbraw/zinc/05/71/42/329057142.db2.gz GDCKPYDHAMOMDM-IUODEOHRSA-N 1 0 299.370 3.575 20 10 CHCDRO CC[C@@H]([NH2+]CC[C@@H]1CCCOC1)c1cc(Cl)ccc1O ZINC000527923638 330296012 /nfs/dbraw/zinc/29/60/12/330296012.db2.gz DDBFKPMACOTNFV-SWLSCSKDSA-N 1 0 297.826 3.903 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ncccc2F)c(O)c1 ZINC000528035792 330302617 /nfs/dbraw/zinc/30/26/17/330302617.db2.gz KHKGKSWENPOSDI-NEPJUHHUSA-N 1 0 274.339 3.647 20 10 CHCDRO C[C@H]([NH2+][C@@H]1[C@H](C)O[C@@H](C)[C@H]1C)c1ccc(Cl)cc1O ZINC000528008397 330303532 /nfs/dbraw/zinc/30/35/32/330303532.db2.gz TZKCDTUBMHBFTC-YQEZVOHVSA-N 1 0 283.799 3.508 20 10 CHCDRO CC[C@H]([NH2+][C@H]1[C@@H](C)[C@H](C)O[C@H]1C)c1ccc(C)cc1O ZINC000528008983 330303761 /nfs/dbraw/zinc/30/37/61/330303761.db2.gz UWXLVSPUGDMGAA-ACMLMGIUSA-N 1 0 277.408 3.553 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(N(C)C)cc1 ZINC000194620009 330945973 /nfs/dbraw/zinc/94/59/73/330945973.db2.gz RZRLMNAQGCHTKN-CYBMUJFWSA-N 1 0 299.374 3.512 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccccc1[N+](=O)[O-] ZINC000268724439 334715082 /nfs/dbraw/zinc/71/50/82/334715082.db2.gz KCYKEZFEQVTELT-CYBMUJFWSA-N 1 0 299.374 3.512 20 10 CHCDRO CCC1(C[NH2+][C@@H](C)c2cc(C)ccc2O)CCOCC1 ZINC000273576862 334767230 /nfs/dbraw/zinc/76/72/30/334767230.db2.gz LYVTVNMXZRYZJU-AWEZNQCLSA-N 1 0 277.408 3.558 20 10 CHCDRO CCC[N@H+](Cc1ccnc(Cl)c1)Cc1ccccc1O ZINC000068973511 521690935 /nfs/dbraw/zinc/69/09/35/521690935.db2.gz BSSIFXBYGQBEEI-UHFFFAOYSA-N 1 0 290.794 3.853 20 10 CHCDRO CCc1nc(C)c(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)o1 ZINC000291970941 522203689 /nfs/dbraw/zinc/20/36/89/522203689.db2.gz TZCQLCGFPXMCFT-LBPRGKRZSA-N 1 0 288.391 3.719 20 10 CHCDRO CC[C@H]([NH2+]CC(C)(C)C[C@H](C)O)c1ccc(C)cc1O ZINC000279999759 522570698 /nfs/dbraw/zinc/57/06/98/522570698.db2.gz FWHCILWAJXAJMX-ZFWWWQNUSA-N 1 0 279.424 3.538 20 10 CHCDRO CC[C@H]([NH2+]CC[C@H]1CCCCO1)c1ccc(C)cc1O ZINC000280270783 522600459 /nfs/dbraw/zinc/60/04/59/522600459.db2.gz XUXJESBEFNCECX-ZBFHGGJFSA-N 1 0 277.408 3.701 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CSCCS1)c1ccc(C)cc1O ZINC000280082576 522621963 /nfs/dbraw/zinc/62/19/63/522621963.db2.gz LUIDMGJGQHUAHK-OCCSQVGLSA-N 1 0 297.489 3.590 20 10 CHCDRO CC[C@H]([NH2+]C[C@@]1(C)CCO[C@H]1C1CC1)c1ccccc1O ZINC000365077516 522624185 /nfs/dbraw/zinc/62/41/85/522624185.db2.gz KRIMDFAGQXSYCM-RYQLBKOJSA-N 1 0 289.419 3.638 20 10 CHCDRO CC[C@H]([NH2+]C[C@@]1(C)CCO[C@@H]1C1CC1)c1ccccc1O ZINC000365077507 522625716 /nfs/dbraw/zinc/62/57/16/522625716.db2.gz KRIMDFAGQXSYCM-CGTJXYLNSA-N 1 0 289.419 3.638 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(OC)ccc1O)c1ccccc1 ZINC000051626638 522643193 /nfs/dbraw/zinc/64/31/93/522643193.db2.gz CZEFWPDAJMOIJR-INIZCTEOSA-N 1 0 271.360 3.642 20 10 CHCDRO CC[C@H]([NH2+]Cc1occc1C)c1ccc(C)cc1O ZINC000293856979 522675091 /nfs/dbraw/zinc/67/50/91/522675091.db2.gz XOJKOHLUXDLHMT-AWEZNQCLSA-N 1 0 259.349 3.843 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1cnn(C)c1C)c1ccc(C)cc1O ZINC000280269129 522701007 /nfs/dbraw/zinc/70/10/07/522701007.db2.gz XTNQQKNLAILEGO-LRDDRELGSA-N 1 0 287.407 3.544 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1[C@@H]2CCO[C@@H]2C1(C)C)c1ccc(C)cc1O ZINC000280241337 522726596 /nfs/dbraw/zinc/72/65/96/522726596.db2.gz VZZWYIJTPPGMRU-DIECFANBSA-N 1 0 289.419 3.555 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1[C@H]2CCO[C@H]2C1(C)C)c1ccc(C)cc1O ZINC000280241349 522727663 /nfs/dbraw/zinc/72/76/63/522727663.db2.gz VZZWYIJTPPGMRU-YALNPMBYSA-N 1 0 289.419 3.555 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCCSC1)c1ccc(C)cc1O ZINC000280009294 522753273 /nfs/dbraw/zinc/75/32/73/522753273.db2.gz GPCHNJCGRROHCP-JSGCOSHPSA-N 1 0 265.422 3.637 20 10 CHCDRO CC[C@@H]([NH2+]CCc1csc(C)n1)c1ccc(C)cc1O ZINC000280156354 522844315 /nfs/dbraw/zinc/84/43/15/522844315.db2.gz QLICXBROCUJQNE-OAHLLOKOSA-N 1 0 290.432 3.749 20 10 CHCDRO COCC1(CC[NH2+][C@@H](C)c2ccc(C)c(C)c2O)CCC1 ZINC000293701921 522862946 /nfs/dbraw/zinc/86/29/46/522862946.db2.gz MEOSNCTVYKLVCF-HNNXBMFYSA-N 1 0 291.435 3.866 20 10 CHCDRO COCC1(CC[NH2+][C@H](C)c2ccc(N(C)C)cc2)CCC1 ZINC000293778924 522866764 /nfs/dbraw/zinc/86/67/64/522866764.db2.gz STEKDXOSPBCFCC-OAHLLOKOSA-N 1 0 290.451 3.610 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccccc1O ZINC000037668244 522878121 /nfs/dbraw/zinc/87/81/21/522878121.db2.gz ZYUSMJSWSIZVTP-OAHLLOKOSA-N 1 0 286.331 3.541 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)OCO2)c1ccc(C)cc1O ZINC000280022067 522880659 /nfs/dbraw/zinc/88/06/59/522880659.db2.gz HLWMDDWYULWFRD-OAHLLOKOSA-N 1 0 299.370 3.670 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1cnn(C)c1C)c1ccc(C)cc1O ZINC000280269132 522941070 /nfs/dbraw/zinc/94/10/70/522941070.db2.gz XTNQQKNLAILEGO-MLGOLLRUSA-N 1 0 287.407 3.544 20 10 CHCDRO COCc1cccc(C[NH2+][C@@H](C)c2cc(F)ccc2O)c1 ZINC000094617741 523057080 /nfs/dbraw/zinc/05/70/80/523057080.db2.gz YYJKPXCJYPOYIP-LBPRGKRZSA-N 1 0 289.350 3.529 20 10 CHCDRO COCc1ccccc1C[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000094617647 523106413 /nfs/dbraw/zinc/10/64/13/523106413.db2.gz ZGPJFUJTYPXAHA-LBPRGKRZSA-N 1 0 289.350 3.529 20 10 CHCDRO COCCCC[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000044655479 523177524 /nfs/dbraw/zinc/17/75/24/523177524.db2.gz ZKRHYCUDAIEEMR-CYBMUJFWSA-N 1 0 273.376 3.623 20 10 CHCDRO COc1ccc(F)cc1[C@@H](C)[NH2+][C@H](C)c1ccccc1O ZINC000037089976 524330680 /nfs/dbraw/zinc/33/06/80/524330680.db2.gz FGUOKRHABNFKMW-VXGBXAGGSA-N 1 0 289.350 3.952 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C2CCSCC2)c(O)c1 ZINC000294895771 524334200 /nfs/dbraw/zinc/33/42/00/524334200.db2.gz VOCYKVFPLSJEMX-LBPRGKRZSA-N 1 0 265.422 3.555 20 10 CHCDRO C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2ccc(N(C)C)cc2)o1 ZINC000020146021 524969303 /nfs/dbraw/zinc/96/93/03/524969303.db2.gz ZEONXEUHLVAUEL-SUMWQHHRSA-N 1 0 284.403 3.759 20 10 CHCDRO C[C@@H]1COCC[C@H]1[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000277252233 525139286 /nfs/dbraw/zinc/13/92/86/525139286.db2.gz AHOJEAGKOMCLCQ-RDTXWAMCSA-N 1 0 297.398 3.574 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C2CCC(C(F)(F)F)CC2)c1 ZINC000071407703 525346007 /nfs/dbraw/zinc/34/60/07/525346007.db2.gz UBESIRUXKFECKZ-UHFFFAOYSA-N 1 0 287.325 3.911 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H]2CCCc3sccc32)c1 ZINC000071409285 525355718 /nfs/dbraw/zinc/35/57/18/525355718.db2.gz RGKNLHBUGJNLBE-AWEZNQCLSA-N 1 0 273.401 3.929 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCSC1)c1cc2c(cc1O)CCCC2 ZINC000280120758 525392827 /nfs/dbraw/zinc/39/28/27/525392827.db2.gz PNLURBGVMFFKBF-STQMWFEESA-N 1 0 291.460 3.675 20 10 CHCDRO Cc1cc([C@@H](C)[NH2+]Cc2ccccc2O)c(C)s1 ZINC000037122875 525468291 /nfs/dbraw/zinc/46/82/91/525468291.db2.gz UDZRITWHXBZYNQ-LLVKDONJSA-N 1 0 261.390 3.921 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1ccc([N+](=O)[O-])cc1 ZINC000297448959 525581345 /nfs/dbraw/zinc/58/13/45/525581345.db2.gz WUVCWJBSGVNPHO-XHDPSFHLSA-N 1 0 298.342 3.639 20 10 CHCDRO C[C@@]12CC[N@H+](Cc3c(O)cccc3Cl)C[C@@H]1C2(F)F ZINC000292751287 525911669 /nfs/dbraw/zinc/91/16/69/525911669.db2.gz IMMCFQGMWZPWAS-QWHCGFSZSA-N 1 0 287.737 3.523 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2COc3ccccc32)c(O)c1 ZINC000290459489 525921861 /nfs/dbraw/zinc/92/18/61/525921861.db2.gz WLVYRWRVRVUUMM-UONOGXRCSA-N 1 0 283.371 3.527 20 10 CHCDRO COc1cccc(C[NH2+]C(C)(C)c2cccc(F)c2)c1O ZINC000076901912 526011198 /nfs/dbraw/zinc/01/11/98/526011198.db2.gz MSHIHRMLXNRSBQ-UHFFFAOYSA-N 1 0 289.350 3.565 20 10 CHCDRO COc1cccc(C[NH2+][C@@H](C)CCc2ccccc2)c1O ZINC000020138416 526028311 /nfs/dbraw/zinc/02/83/11/526028311.db2.gz FQZVUQXSEHCDGS-AWEZNQCLSA-N 1 0 285.387 3.512 20 10 CHCDRO COc1cccc(C[NH2+][C@@H](C)c2cc(C)sc2C)c1O ZINC000037123006 526032054 /nfs/dbraw/zinc/03/20/54/526032054.db2.gz SJPVEUIMAZIKPB-NSHDSACASA-N 1 0 291.416 3.930 20 10 CHCDRO CCCCC[NH2+][C@H](C)c1ccc(N2CCOCC2)c(F)c1 ZINC000020582639 570408764 /nfs/dbraw/zinc/40/87/64/570408764.db2.gz BLSHBWOAPIWZTD-CQSZACIVSA-N 1 0 294.414 3.503 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CC[C@@H]2OCCC[C@@H]2C1 ZINC000129065847 1125471963 /nfs/dbraw/zinc/47/19/63/1125471963.db2.gz LORYEGKHNWUYEZ-BEFAXECRSA-N 1 0 297.398 3.546 20 10 CHCDRO CC[C@@H]([NH2+]CCCCSC)c1ccc(N(C)C)cc1 ZINC000133653385 1125482488 /nfs/dbraw/zinc/48/24/88/1125482488.db2.gz ZWLNVFZFQYIGAG-MRXNPFEDSA-N 1 0 280.481 3.937 20 10 CHCDRO Cc1cnc([C@@H](C)C[NH2+][C@@H](C)c2ccccc2O)s1 ZINC000186774464 1120665846 /nfs/dbraw/zinc/66/58/46/1120665846.db2.gz KFVPHEQKXAUTGC-JQWIXIFHSA-N 1 0 276.405 3.611 20 10 CHCDRO C[N@H+](Cc1cc(F)ccc1O)C1CCCCCC1 ZINC000226562006 1121157547 /nfs/dbraw/zinc/15/75/47/1121157547.db2.gz IRFCNNIVBIBTAM-UHFFFAOYSA-N 1 0 251.345 3.686 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)CC2CCC2)c1 ZINC000710247508 1121474433 /nfs/dbraw/zinc/47/44/33/1121474433.db2.gz WBVXKIQNRDZUNF-VXGBXAGGSA-N 1 0 263.381 3.630 20 10 CHCDRO Cc1ccoc1C[N@@H+](C)Cc1cc(Cl)ccc1O ZINC000814174757 1121849313 /nfs/dbraw/zinc/84/93/13/1121849313.db2.gz JHWMCVWJFJMKMM-UHFFFAOYSA-N 1 0 265.740 3.579 20 10 CHCDRO CC(C)c1ccc(O)c(C[N@H+](C)C[C@@H]2CC2(C)C)c1 ZINC001183085137 1122203483 /nfs/dbraw/zinc/20/34/83/1122203483.db2.gz VPRKMXYSMUQELY-HNNXBMFYSA-N 1 0 261.409 3.994 20 10 CHCDRO CC[C@@H]([NH2+]CCCOCC1CC1)c1cc(Cl)ccc1O ZINC000775484566 1122616209 /nfs/dbraw/zinc/61/62/09/1122616209.db2.gz DYYOLJVCCDIVDB-OAHLLOKOSA-N 1 0 297.826 3.903 20 10 CHCDRO CC[C@@H]([NH2+]CC(C)(C)C[C@H](C)O)c1cc(Cl)ccc1O ZINC000775527721 1122644810 /nfs/dbraw/zinc/64/48/10/1122644810.db2.gz SQLCFLJYCFDGOR-SMDDNHRTSA-N 1 0 299.842 3.883 20 10 CHCDRO Oc1cc(Cl)ccc1C[NH+]1CCC2(CC(F)C2)CC1 ZINC001140462944 1131748412 /nfs/dbraw/zinc/74/84/12/1131748412.db2.gz OXRDFZCCESJURO-UHFFFAOYSA-N 1 0 283.774 3.760 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H](C)CC(F)F)c(O)c1C ZINC000842890877 1132474832 /nfs/dbraw/zinc/47/48/32/1132474832.db2.gz VDDCBNNPLSMLIO-SKDRFNHKSA-N 1 0 271.351 3.951 20 10 CHCDRO C[C@@H]([NH2+]C[C@]1(C)CCCS1)c1ccc(N(C)C)cc1 ZINC000133948826 1125511884 /nfs/dbraw/zinc/51/18/84/1125511884.db2.gz RPQZUHPGOVIEOR-CJNGLKHVSA-N 1 0 278.465 3.689 20 10 CHCDRO C[C@H]([NH2+]C[C@]1(C)CCCS1)c1ccc(N(C)C)cc1 ZINC000133948662 1125512178 /nfs/dbraw/zinc/51/21/78/1125512178.db2.gz RPQZUHPGOVIEOR-BBRMVZONSA-N 1 0 278.465 3.689 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCOC(C)(C)C1)c1cc(Cl)ccc1O ZINC000120213777 1125542443 /nfs/dbraw/zinc/54/24/43/1125542443.db2.gz HOGYPBKJNSSVOD-CMPLNLGQSA-N 1 0 283.799 3.654 20 10 CHCDRO Oc1ccccc1C[NH2+]Cc1ccccc1OC(F)(F)F ZINC000134225730 1125544514 /nfs/dbraw/zinc/54/45/14/1125544514.db2.gz HTTKCIBXOMKNEL-UHFFFAOYSA-N 1 0 297.276 3.581 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]CCCCC(C)C)c1 ZINC000134287343 1125552879 /nfs/dbraw/zinc/55/28/79/1125552879.db2.gz XKCQKEBJJLKWJZ-CYBMUJFWSA-N 1 0 265.397 3.878 20 10 CHCDRO Cc1occc1C[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841746850 1125575892 /nfs/dbraw/zinc/57/58/92/1125575892.db2.gz LPQZIZRIBXPOKF-SECBINFHSA-N 1 0 265.740 3.798 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCCSC2)cc1 ZINC000135699328 1125594974 /nfs/dbraw/zinc/59/49/74/1125594974.db2.gz AXXSJNKOFXMRNT-HNNXBMFYSA-N 1 0 278.465 3.518 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H]2CCc3c2cccc3F)cc1C ZINC000886363843 1125672371 /nfs/dbraw/zinc/67/23/71/1125672371.db2.gz FMJKKBPQXNDIOU-QGZVFWFLSA-N 1 0 285.362 3.925 20 10 CHCDRO C[C@@H](CCc1ccco1)[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000237360074 1125683722 /nfs/dbraw/zinc/68/37/22/1125683722.db2.gz KDJKAPXVLGRFNZ-HNNXBMFYSA-N 1 0 298.430 3.773 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]Cc1cscc1Cl)CC2 ZINC000886657838 1125704613 /nfs/dbraw/zinc/70/46/13/1125704613.db2.gz FVWNUGAXXCZVMV-LBPRGKRZSA-N 1 0 279.792 3.884 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc(C2CC2)no1)c1ccc(C)cc1O ZINC000886684868 1125708841 /nfs/dbraw/zinc/70/88/41/1125708841.db2.gz UXFHDSWHZPKSNP-OAHLLOKOSA-N 1 0 286.375 3.807 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCC2(CCC2)CO1)c1cc(F)ccc1O ZINC000886731101 1125713964 /nfs/dbraw/zinc/71/39/64/1125713964.db2.gz UZTVSOKTRJJNEM-OCCSQVGLSA-N 1 0 293.382 3.531 20 10 CHCDRO CC[C@@H]([NH2+]CC1(CCOC)CC1)c1ccc(N(C)C)cc1 ZINC000090536312 1125743245 /nfs/dbraw/zinc/74/32/45/1125743245.db2.gz PSRGPROTCIGSHI-QGZVFWFLSA-N 1 0 290.451 3.610 20 10 CHCDRO COc1ccccc1C[N@H+](C)Cc1cc(C)c(C)cc1O ZINC000192468317 1125768791 /nfs/dbraw/zinc/76/87/91/1125768791.db2.gz PXZMBMJQJFVRBB-UHFFFAOYSA-N 1 0 285.387 3.650 20 10 CHCDRO COC(C)(C)C[C@H](C)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000121951526 1125780479 /nfs/dbraw/zinc/78/04/79/1125780479.db2.gz XWIXPBJHLMGHSE-KBPBESRZSA-N 1 0 278.440 3.607 20 10 CHCDRO COC(C)(C)C[C@@H](C)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000121951684 1125780967 /nfs/dbraw/zinc/78/09/67/1125780967.db2.gz XWIXPBJHLMGHSE-KGLIPLIRSA-N 1 0 278.440 3.607 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CC(C)(C)N2CCCCC2)c1 ZINC000184847579 1129256195 /nfs/dbraw/zinc/25/61/95/1129256195.db2.gz UATQRRKJEKTUKK-OAHLLOKOSA-N 1 0 290.451 3.616 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2cncs2)c(O)c1C ZINC000903309948 1130150552 /nfs/dbraw/zinc/15/05/52/1130150552.db2.gz HNIHGTNVKLSOBR-VXGBXAGGSA-N 1 0 276.405 3.877 20 10 CHCDRO C[C@@H]([NH2+]C1CCOCC1)c1ccc(N2CCCCC2)cc1 ZINC000178270405 1126810515 /nfs/dbraw/zinc/81/05/15/1126810515.db2.gz NPLFPQVYSYTKFP-OAHLLOKOSA-N 1 0 288.435 3.507 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)[C@H](C)c1cccc(O)c1 ZINC000179560943 1126829242 /nfs/dbraw/zinc/82/92/42/1126829242.db2.gz SJHVDUILQIRPFR-CYBMUJFWSA-N 1 0 271.360 3.681 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCC[C@H]1c1cccs1 ZINC000179553517 1126829784 /nfs/dbraw/zinc/82/97/84/1126829784.db2.gz ZDPAQWOQQCQYLZ-ZDUSSCGKSA-N 1 0 259.374 3.791 20 10 CHCDRO COc1ccc(O)c(C[N@H+](C)[C@@H](C)c2cccs2)c1 ZINC000179713948 1126832846 /nfs/dbraw/zinc/83/28/46/1126832846.db2.gz WRMJEZSBVWIVBW-NSHDSACASA-N 1 0 277.389 3.655 20 10 CHCDRO CC(C)([NH2+]Cc1cc(F)ccc1O)c1cccc(F)c1 ZINC000180741804 1126848286 /nfs/dbraw/zinc/84/82/86/1126848286.db2.gz VXKWXYHYVMCLTF-UHFFFAOYSA-N 1 0 277.314 3.695 20 10 CHCDRO CC[C@H]([NH2+]CCCc1ccccn1)c1ccc(N(C)C)cc1 ZINC000181492025 1126856603 /nfs/dbraw/zinc/85/66/03/1126856603.db2.gz OJXPVCFHRLAURP-IBGZPJMESA-N 1 0 297.446 3.821 20 10 CHCDRO COc1cc(C[NH2+][C@@H](C)c2ccccc2O)ccc1C ZINC000183460700 1126887871 /nfs/dbraw/zinc/88/78/71/1126887871.db2.gz BIENWIYIVXVTRF-ZDUSSCGKSA-N 1 0 271.360 3.560 20 10 CHCDRO CCc1cccc(C[NH2+][C@H](CC)c2nccs2)c1O ZINC000691449342 1130711356 /nfs/dbraw/zinc/71/13/56/1130711356.db2.gz FBLSVMRBRBQMGS-CYBMUJFWSA-N 1 0 276.405 3.652 20 10 CHCDRO CCO[C@@H](CC[NH2+][C@H](C)c1cc(OC)ccc1O)C(C)C ZINC000185625620 1126901295 /nfs/dbraw/zinc/90/12/95/1126901295.db2.gz UNZSPFYEXPPCQQ-DYVFJYSZSA-N 1 0 295.423 3.503 20 10 CHCDRO COCCC1(C[NH2+][C@@H](C)c2cc(F)ccc2O)CCCC1 ZINC000185748147 1126902497 /nfs/dbraw/zinc/90/24/97/1126902497.db2.gz LDZVCPMLKPFWRX-ZDUSSCGKSA-N 1 0 295.398 3.779 20 10 CHCDRO CO[C@H](C)[C@H](C)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000191655578 1126953368 /nfs/dbraw/zinc/95/33/68/1126953368.db2.gz RZZCKOGAOBSDNJ-YNEHKIRRSA-N 1 0 273.376 3.619 20 10 CHCDRO CC[C@@H]([NH2+]CC(C)(C)COC)c1cc(Cl)ccc1O ZINC000813883032 1130794971 /nfs/dbraw/zinc/79/49/71/1130794971.db2.gz PIOGNXZLSNXWIL-CYBMUJFWSA-N 1 0 285.815 3.759 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]C1CCC2(CC2)CC1 ZINC000695695758 1130799116 /nfs/dbraw/zinc/79/91/16/1130799116.db2.gz CIPNXRMQSJBVIT-UHFFFAOYSA-N 1 0 265.784 3.858 20 10 CHCDRO CCCNc1ccc(C[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC000193157055 1126967751 /nfs/dbraw/zinc/96/77/51/1126967751.db2.gz WQIFZBUWLZLDDN-UHFFFAOYSA-N 1 0 296.414 3.733 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2cscn2)c1 ZINC000697819209 1130864041 /nfs/dbraw/zinc/86/40/41/1130864041.db2.gz JQASNEUQQSTBMZ-MNOVXSKESA-N 1 0 262.378 3.569 20 10 CHCDRO CSC(C)(C)C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC000168813635 1130937572 /nfs/dbraw/zinc/93/75/72/1130937572.db2.gz VSZAXQYQNBZJPM-NEPJUHHUSA-N 1 0 279.449 3.980 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)C2CCCCCC2)c(O)c1 ZINC000149992456 1127038741 /nfs/dbraw/zinc/03/87/41/1127038741.db2.gz JKMJQFWBMJIEFZ-CYBMUJFWSA-N 1 0 277.408 3.849 20 10 CHCDRO COc1ccc(C[NH2+][C@H]2CCO[C@@H](C(C)(C)C)C2)cc1C ZINC000270659872 1127059888 /nfs/dbraw/zinc/05/98/88/1127059888.db2.gz OCDHYHYSAGBPKQ-DOTOQJQBSA-N 1 0 291.435 3.687 20 10 CHCDRO CC[N@H+](CCc1cccs1)Cc1cccc(OC)c1O ZINC000271094809 1127068702 /nfs/dbraw/zinc/06/87/02/1127068702.db2.gz KPXCRIXGQZHKTD-UHFFFAOYSA-N 1 0 291.416 3.527 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H]2CCCc3cn[nH]c32)cc1 ZINC000271436412 1127082017 /nfs/dbraw/zinc/08/20/17/1127082017.db2.gz BQFCUQXAGVXDIE-DYVFJYSZSA-N 1 0 298.434 3.594 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)c(C)c2)o1 ZINC000271528423 1127088501 /nfs/dbraw/zinc/08/85/01/1127088501.db2.gz RMBYHLQHLBHWRV-CQSZACIVSA-N 1 0 272.392 3.813 20 10 CHCDRO CC[C@H](CSC)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000163860607 1127145552 /nfs/dbraw/zinc/14/55/52/1127145552.db2.gz HWKBAYZHBDFISK-MRXNPFEDSA-N 1 0 292.492 3.908 20 10 CHCDRO CC[C@H]([NH2+]CCSC(C)(C)C)c1ccccc1O ZINC000156474765 1127157933 /nfs/dbraw/zinc/15/79/33/1127157933.db2.gz WUOQTKMSXBUIJD-ZDUSSCGKSA-N 1 0 267.438 3.965 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C2(C3CC3)CC2)cc1F ZINC000760713534 1127203216 /nfs/dbraw/zinc/20/32/16/1127203216.db2.gz PAVSRQNOKBRXJN-UHFFFAOYSA-N 1 0 276.399 3.704 20 10 CHCDRO COCCC(C)(C)C[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000285462793 1127230228 /nfs/dbraw/zinc/23/02/28/1127230228.db2.gz ZZPAEEPIMQKFGQ-AWEZNQCLSA-N 1 0 279.424 3.722 20 10 CHCDRO [O-]c1cc(Cl)c(F)cc1C[N@@H+]1CCC[C@H](F)CC1 ZINC001237933621 1131153596 /nfs/dbraw/zinc/15/35/96/1131153596.db2.gz FBRNRZNDLXCMCP-JTQLQIEISA-N 1 0 275.726 3.509 20 10 CHCDRO Cc1cccc(CCC[NH2+][C@H](C)c2ccc(C)c(C)c2O)n1 ZINC000287292460 1127299217 /nfs/dbraw/zinc/29/92/17/1127299217.db2.gz DGUJXEICBSFCJU-MRXNPFEDSA-N 1 0 298.430 3.996 20 10 CHCDRO Cc1cccc(CCC[NH2+][C@@H](C)c2ccc(N(C)C)cc2)n1 ZINC000287659937 1127312005 /nfs/dbraw/zinc/31/20/05/1127312005.db2.gz VIQWNGITJRBGTD-INIZCTEOSA-N 1 0 297.446 3.739 20 10 CHCDRO CC[C@@H](CC(F)(F)F)[NH2+][C@H](C)c1ccccc1O ZINC000760903766 1127325115 /nfs/dbraw/zinc/32/51/15/1127325115.db2.gz YRGTXWGIIAEOBV-ZJUUUORDSA-N 1 0 261.287 3.774 20 10 CHCDRO CN1CCCc2cc(C[NH2+]Cc3ccc(Cl)o3)ccc21 ZINC000058477204 1127351175 /nfs/dbraw/zinc/35/11/75/1127351175.db2.gz JDSVGJUKFPDPLG-UHFFFAOYSA-N 1 0 290.794 3.605 20 10 CHCDRO CCCOc1ccc(C[NH2+][C@H]2CS[C@H](C)C2)cc1C ZINC001308437240 1127384011 /nfs/dbraw/zinc/38/40/11/1127384011.db2.gz NFCPPGVSEOHOAF-UKRRQHHQSA-N 1 0 279.449 3.767 20 10 CHCDRO C[C@@H]([NH2+]Cc1cc(F)ccc1O)c1c(F)cccc1F ZINC000226585467 1127412211 /nfs/dbraw/zinc/41/22/11/1127412211.db2.gz CEPVZJUFSAEHQS-SECBINFHSA-N 1 0 281.277 3.660 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]Cc1ccccc1C(F)(F)F ZINC000226587998 1127412610 /nfs/dbraw/zinc/41/26/10/1127412610.db2.gz FPMSUVLECUYFHP-UHFFFAOYSA-N 1 0 299.267 3.840 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H]2CCC[C@@H](C)CC2)c1O ZINC000227309953 1127469578 /nfs/dbraw/zinc/46/95/78/1127469578.db2.gz ACIXCEVGTAHKCH-UKRRQHHQSA-N 1 0 277.408 3.849 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2CCC(C)(C)C2)c1 ZINC000168861305 1127472556 /nfs/dbraw/zinc/47/25/56/1127472556.db2.gz NZVYJAIOFIVFDC-RYUDHWBXSA-N 1 0 263.381 3.630 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CCC[C@@H](SC)C2)cc1C ZINC000227377349 1127475158 /nfs/dbraw/zinc/47/51/58/1127475158.db2.gz XDOGEBVMUCLEHV-HUUCEWRRSA-N 1 0 279.449 3.767 20 10 CHCDRO CCCc1nc(C)c(C[NH2+][C@@H](C)c2cc(F)ccc2O)o1 ZINC000293685836 1127512834 /nfs/dbraw/zinc/51/28/34/1127512834.db2.gz NKXBKYCKESGEGT-JTQLQIEISA-N 1 0 292.354 3.631 20 10 CHCDRO C[C@@H]1C[C@H](C(F)(F)F)CC[N@@H+]1Cc1ccccc1O ZINC000295094376 1127619378 /nfs/dbraw/zinc/61/93/78/1127619378.db2.gz UFQDSKBQSVPTJX-ZYHUDNBSSA-N 1 0 273.298 3.555 20 10 CHCDRO Cc1csc([C@@H](C)C[NH2+][C@H]2CCc3cccc(O)c32)n1 ZINC000295783840 1127652949 /nfs/dbraw/zinc/65/29/49/1127652949.db2.gz ADELAVWGYDJSFU-GWCFXTLKSA-N 1 0 288.416 3.538 20 10 CHCDRO CC[C@@H]1CC[C@@H](C)[N@@H+]1Cc1cc(Cl)cc(OC)c1O ZINC000229121184 1127650928 /nfs/dbraw/zinc/65/09/28/1127650928.db2.gz WEZAQJGVAMVYNT-ZWNOBZJWSA-N 1 0 283.799 3.817 20 10 CHCDRO COc1cc(O)c(C[N@H+](C)C[C@@H]2CC2(C)C)cc1Cl ZINC001232270084 1127653949 /nfs/dbraw/zinc/65/39/49/1127653949.db2.gz SMNDOAHVNJXPEE-NSHDSACASA-N 1 0 283.799 3.532 20 10 CHCDRO Cc1cc(Cl)nc(C[NH2+][C@H]2CCc3cccc(O)c32)c1 ZINC000296495857 1127673760 /nfs/dbraw/zinc/67/37/60/1127673760.db2.gz PVIRQBBFYRPRKV-ZDUSSCGKSA-N 1 0 288.778 3.526 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCCc2ncccc2C)c1 ZINC000296522474 1127674626 /nfs/dbraw/zinc/67/46/26/1127674626.db2.gz PZTBZHPIZLMCFB-HNNXBMFYSA-N 1 0 284.403 3.687 20 10 CHCDRO CC(C)[C@@H](C[NH2+][C@H]1CCc2cccc(O)c21)c1cccnc1 ZINC000297619706 1127701647 /nfs/dbraw/zinc/70/16/47/1127701647.db2.gz IWGOPEIVBAMFMI-SJORKVTESA-N 1 0 296.414 3.804 20 10 CHCDRO CC(C)[C@@H](C[NH2+][C@@H]1CCc2cccc(O)c21)c1cccnc1 ZINC000297619702 1127701685 /nfs/dbraw/zinc/70/16/85/1127701685.db2.gz IWGOPEIVBAMFMI-IAGOWNOFSA-N 1 0 296.414 3.804 20 10 CHCDRO C[C@H](c1ccc(F)c(F)c1)[N@H+](C)Cc1ccccc1O ZINC000171926035 1127734252 /nfs/dbraw/zinc/73/42/52/1127734252.db2.gz UXTAPLCSMNYPCO-LLVKDONJSA-N 1 0 277.314 3.863 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]C[C@@H]2CC[C@@H](C)C2)c1O ZINC000230407280 1127752413 /nfs/dbraw/zinc/75/24/13/1127752413.db2.gz FTIURANCXNKSLK-GHMZBOCLSA-N 1 0 283.799 3.580 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C(C)(C)C2CC2)cc1 ZINC000230674346 1127770827 /nfs/dbraw/zinc/77/08/27/1127770827.db2.gz BOOFUUGXIZODPQ-UHFFFAOYSA-N 1 0 260.425 3.811 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@]2(C)CCO[C@H]2C2CC2)c(O)c1 ZINC000372096556 1127787941 /nfs/dbraw/zinc/78/79/41/1127787941.db2.gz TVVFVUIGFJCCSA-DOPJRALCSA-N 1 0 289.419 3.556 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)CCc2cccs2)cc1C ZINC000173407835 1127828386 /nfs/dbraw/zinc/82/83/86/1127828386.db2.gz UMTBXYDDVXHQQE-UHFFFAOYSA-N 1 0 275.417 3.745 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CCC[C@@H]2c2ccsc2)c1 ZINC000373223215 1127829383 /nfs/dbraw/zinc/82/93/83/1127829383.db2.gz HFDOXKRDGIHTHR-OAHLLOKOSA-N 1 0 289.400 3.799 20 10 CHCDRO Cc1ccc2c(c1)[C@@H]([NH2+][C@H](C)c1cc(F)ccc1O)CO2 ZINC000373266536 1127830984 /nfs/dbraw/zinc/83/09/84/1127830984.db2.gz NENCDEBYYPDPKP-ABAIWWIYSA-N 1 0 287.334 3.624 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@]2(C)CCO[C@@H]2C2CC2)c1 ZINC000373344499 1127835665 /nfs/dbraw/zinc/83/56/65/1127835665.db2.gz BAABVPALLSJTMR-MORSLUCNSA-N 1 0 289.419 3.556 20 10 CHCDRO COc1ccc2ccc(O)c(C[N@@H+]3CCC[C@H]3C)c2c1 ZINC000173528248 1127837565 /nfs/dbraw/zinc/83/75/65/1127837565.db2.gz JVUBXBASRXJYBX-GFCCVEGCSA-N 1 0 271.360 3.538 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCCCC1(F)F)c1ccccc1O ZINC000296443381 1129222780 /nfs/dbraw/zinc/22/27/80/1129222780.db2.gz ZQTLIROAQIFPBA-VXGBXAGGSA-N 1 0 269.335 3.868 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H](c2ccccc2)[C@@H]2CCOC2)c1 ZINC000374472289 1127900130 /nfs/dbraw/zinc/90/01/30/1127900130.db2.gz PMFHVGRNOMDROK-VQIMIIECSA-N 1 0 297.398 3.568 20 10 CHCDRO CC[C@H]([NH2+]CCCC(=O)OC(C)(C)C)c1ccccc1O ZINC000784266112 1127926088 /nfs/dbraw/zinc/92/60/88/1127926088.db2.gz PYECVWYKLVQRRE-AWEZNQCLSA-N 1 0 293.407 3.555 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)CC(O)(CC)CC)cc1 ZINC000777540089 1128117931 /nfs/dbraw/zinc/11/79/31/1128117931.db2.gz FZCWXJLDBZOTOY-UHFFFAOYSA-N 1 0 292.467 3.516 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CS[C@@H](C(C)C)C1 ZINC000754120381 1128196937 /nfs/dbraw/zinc/19/69/37/1128196937.db2.gz HOHVIDKUNHRWFQ-DOTOQJQBSA-N 1 0 292.492 3.681 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CC[C@H]2SC)cc1F ZINC000761988256 1128259536 /nfs/dbraw/zinc/25/95/36/1128259536.db2.gz ZKRPWQVGFYPMAD-GDBMZVCRSA-N 1 0 296.455 3.656 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2C[C@H]2C(F)(F)F)c(O)c1C ZINC000926951313 1128205905 /nfs/dbraw/zinc/20/59/05/1128205905.db2.gz PQNRGUMUYSZDOU-GMXVVIOVSA-N 1 0 287.325 3.858 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCS[C@@H](C)C2)c(O)c1 ZINC000927032732 1128209603 /nfs/dbraw/zinc/20/96/03/1128209603.db2.gz OPYVQMQTQJJAPC-RWMBFGLXSA-N 1 0 265.422 3.635 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCCc2cccnc21)c1ccccc1O ZINC000927062744 1128213661 /nfs/dbraw/zinc/21/36/61/1128213661.db2.gz LNEUGJUJQYVZDS-WFASDCNBSA-N 1 0 268.360 3.515 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H]2CCCc3cccnc32)c1O ZINC000927064261 1128214329 /nfs/dbraw/zinc/21/43/29/1128214329.db2.gz RJIQJWBQMUHIDR-WFASDCNBSA-N 1 0 298.386 3.524 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C2CC2)C2CCCC2)cc1 ZINC000762379062 1128295046 /nfs/dbraw/zinc/29/50/46/1128295046.db2.gz ZNCYJSNANVJVMR-UHFFFAOYSA-N 1 0 258.409 3.660 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C2(C)CCC(F)(F)CC2)c1 ZINC000784621283 1128328106 /nfs/dbraw/zinc/32/81/06/1128328106.db2.gz INGKIDQSEDKZBN-UHFFFAOYSA-N 1 0 269.335 3.758 20 10 CHCDRO C[C@H]1CC[N@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C[C@@H]1F ZINC000777967749 1128352635 /nfs/dbraw/zinc/35/26/35/1128352635.db2.gz ZAMAMLSNMCDXTO-FZMZJTMJSA-N 1 0 295.398 3.575 20 10 CHCDRO C[N@H+](CCc1ccccc1Cl)Cc1ccc(N)cc1 ZINC001235839255 1128366240 /nfs/dbraw/zinc/36/62/40/1128366240.db2.gz PLRYOJZCTXRUPI-UHFFFAOYSA-N 1 0 274.795 3.597 20 10 CHCDRO CCc1cccc(C[NH2+][C@@H]2CCCC[C@H]2SC)c1O ZINC000691449227 1128388866 /nfs/dbraw/zinc/38/88/66/1128388866.db2.gz CVQUBIIXABPPGQ-HUUCEWRRSA-N 1 0 279.449 3.718 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H](CO)CC2CCCC2)c1 ZINC000798936806 1128392535 /nfs/dbraw/zinc/39/25/35/1128392535.db2.gz GTAIEDFXGOSPTG-ZBFHGGJFSA-N 1 0 291.435 3.540 20 10 CHCDRO CCOc1cccc(C[NH2+][C@H]2CCCC[C@@H]2CC)c1O ZINC000037032041 1128408520 /nfs/dbraw/zinc/40/85/20/1128408520.db2.gz MPAKLSVJWKMMHE-ZFWWWQNUSA-N 1 0 277.408 3.849 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)COC2)c1ccccc1O ZINC000778236893 1128458252 /nfs/dbraw/zinc/45/82/52/1128458252.db2.gz OLTXWVHKGQKSLF-QGZVFWFLSA-N 1 0 283.371 3.663 20 10 CHCDRO CCN(C)c1ccc(C[NH2+][C@H](c2ccncc2)C2CC2)cc1 ZINC000934698831 1128467338 /nfs/dbraw/zinc/46/73/38/1128467338.db2.gz PTGVMXBFJXEVMP-IBGZPJMESA-N 1 0 295.430 3.779 20 10 CHCDRO CC(C)[N@H+](C/C=C\Cl)Cc1ccc(N(C)C)cc1 ZINC000917075052 1128474868 /nfs/dbraw/zinc/47/48/68/1128474868.db2.gz OWUKENIXAKNXNJ-YHYXMXQVSA-N 1 0 266.816 3.716 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CCc2ccccc2O)cc1 ZINC000154932804 1128597997 /nfs/dbraw/zinc/59/79/97/1128597997.db2.gz DOCXBESCVNUBRG-HNNXBMFYSA-N 1 0 298.430 3.742 20 10 CHCDRO CC(C)C[C@@H](C)[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1 ZINC000155307134 1128604057 /nfs/dbraw/zinc/60/40/57/1128604057.db2.gz IZTMEVBJZNNCBT-HZPDHXFCSA-N 1 0 290.451 3.608 20 10 CHCDRO CC[C@@H]([NH2+]CCc1cccc(OC)c1)c1ccccc1O ZINC000155180136 1128663966 /nfs/dbraw/zinc/66/39/66/1128663966.db2.gz IYYQJDCPQVFVJW-QGZVFWFLSA-N 1 0 285.387 3.684 20 10 CHCDRO CC(C)[C@@H](Cc1ccccc1)[NH2+]Cc1ccccc1O ZINC000779016990 1128682062 /nfs/dbraw/zinc/68/20/62/1128682062.db2.gz JCKIEHVRICUXET-QGZVFWFLSA-N 1 0 269.388 3.749 20 10 CHCDRO CCc1cc(C[N@H+](C)CCCOC)c(O)c(C(C)(C)C)c1 ZINC000921187392 1128702348 /nfs/dbraw/zinc/70/23/48/1128702348.db2.gz PBTZZYTWCLVGBY-UHFFFAOYSA-N 1 0 293.451 3.720 20 10 CHCDRO CC(C)C[C@H](C)C[C@H](C)[NH2+]Cc1ccc(O)cc1O ZINC001258055085 1128711926 /nfs/dbraw/zinc/71/19/26/1128711926.db2.gz IUQISWYWIFHDHW-STQMWFEESA-N 1 0 265.397 3.648 20 10 CHCDRO COc1ccc(C[NH2+]C[C@H]2CCO[C@@H](C(C)C)C2)cc1C ZINC000779063917 1128716385 /nfs/dbraw/zinc/71/63/85/1128716385.db2.gz CTOJHLWECDCXCX-FUHWJXTLSA-N 1 0 291.435 3.544 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCC(C)(C)O2)c(O)c1C ZINC000779079009 1128721173 /nfs/dbraw/zinc/72/11/73/1128721173.db2.gz JSINORCWXMYQMB-ZIAGYGMSSA-N 1 0 277.408 3.617 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCC(C)(C)O1)c1ccc(N(C)C)cc1 ZINC000779079344 1128723002 /nfs/dbraw/zinc/72/30/02/1128723002.db2.gz MPDZXYYLVMQNAM-SJORKVTESA-N 1 0 290.451 3.751 20 10 CHCDRO CC1(c2ccccc2)CC([NH2+]Cc2cc(F)ccc2O)C1 ZINC000779074931 1128720080 /nfs/dbraw/zinc/72/00/80/1128720080.db2.gz SVJIWFABJVYKAZ-UHFFFAOYSA-N 1 0 285.362 3.741 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCC[C@@H]1CCO)c1cc(Cl)ccc1O ZINC000779089657 1128726666 /nfs/dbraw/zinc/72/66/66/1128726666.db2.gz VDXZVYGFVZWRIV-UGFHNGPFSA-N 1 0 297.826 3.637 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCCc3ccccc3C2)c1O ZINC000317112007 1117744966 /nfs/dbraw/zinc/74/49/66/1117744966.db2.gz RGEKJNCXEYJDIK-UHFFFAOYSA-N 1 0 297.398 3.739 20 10 CHCDRO CSCCCCC[NH2+]Cc1cc(Cl)ccc1O ZINC000185163353 1117775938 /nfs/dbraw/zinc/77/59/38/1117775938.db2.gz IMMAFAXYBBSMTA-UHFFFAOYSA-N 1 0 273.829 3.669 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)C1CC1 ZINC000035136648 1117782681 /nfs/dbraw/zinc/78/26/81/1117782681.db2.gz OVBRKTICAUKCSR-CQSZACIVSA-N 1 0 258.409 3.565 20 10 CHCDRO COCCCCC[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000185233189 1117793194 /nfs/dbraw/zinc/79/31/94/1117793194.db2.gz XTCPKDCMYVLZBZ-AWEZNQCLSA-N 1 0 291.435 3.738 20 10 CHCDRO CCCC[C@H](COC)[NH2+][C@H](C)c1cc(C)ccc1O ZINC000185494448 1117829659 /nfs/dbraw/zinc/82/96/59/1117829659.db2.gz WGILMHJTFTWSBC-ZIAGYGMSSA-N 1 0 265.397 3.556 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCc2cc(F)ccc2F)c(O)c1 ZINC000185633866 1117860443 /nfs/dbraw/zinc/86/04/43/1117860443.db2.gz DKAHOAUSOUAQIE-LBPRGKRZSA-N 1 0 291.341 3.872 20 10 CHCDRO Cc1oc2ccccc2c1C[NH2+]Cc1cc(F)ccc1O ZINC000185668466 1117867409 /nfs/dbraw/zinc/86/74/09/1117867409.db2.gz INONPIJMQRNIQR-UHFFFAOYSA-N 1 0 285.318 3.876 20 10 CHCDRO CC(C)OCCC[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000021501226 1117900327 /nfs/dbraw/zinc/90/03/27/1117900327.db2.gz BHTPJVNZUYPDIT-UHFFFAOYSA-N 1 0 290.451 3.582 20 10 CHCDRO CC(C)C1(C[NH2+][C@@H](C)c2cc(F)ccc2O)CC1 ZINC000186100003 1117992745 /nfs/dbraw/zinc/99/27/45/1117992745.db2.gz OPSKVSVREVBUMG-NSHDSACASA-N 1 0 251.345 3.618 20 10 CHCDRO Oc1cccc(Cl)c1C[NH+]1CCc2ccccc2CC1 ZINC000211409240 1118027278 /nfs/dbraw/zinc/02/72/78/1118027278.db2.gz VYRFASDMNNTTBY-UHFFFAOYSA-N 1 0 287.790 3.646 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]CCc2cc(C)cc(C)c2)c1 ZINC000237683441 1128751822 /nfs/dbraw/zinc/75/18/22/1128751822.db2.gz UTFKNYLYNBXLAK-UHFFFAOYSA-N 1 0 269.388 3.650 20 10 CHCDRO CC[C@H]([NH2+]CCCOCC(C)C)c1ccc(N(C)C)cc1 ZINC000764687947 1118107397 /nfs/dbraw/zinc/10/73/97/1118107397.db2.gz SPJMNHKOULDDIJ-SFHVURJKSA-N 1 0 292.467 3.856 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCCOCC(C)C)cc1 ZINC000764686336 1118107402 /nfs/dbraw/zinc/10/74/02/1118107402.db2.gz GYNDXPFUJVCEGI-MRXNPFEDSA-N 1 0 292.467 3.856 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CCc2ccc(O)cc2)cc1 ZINC000765348161 1118145809 /nfs/dbraw/zinc/14/58/09/1118145809.db2.gz JCOBJNABWFSRGG-HNNXBMFYSA-N 1 0 298.430 3.742 20 10 CHCDRO CCc1ccc(C[NH2+][C@@H](C)c2ccccc2O)cc1 ZINC000179875445 1128763611 /nfs/dbraw/zinc/76/36/11/1128763611.db2.gz JMGVTFMULUVZBC-ZDUSSCGKSA-N 1 0 255.361 3.805 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1ccncc1OC)c1ccccc1O ZINC000188763282 1128765272 /nfs/dbraw/zinc/76/52/72/1128765272.db2.gz SMNMKAYQTVLEMP-DOMZBBRYSA-N 1 0 286.375 3.598 20 10 CHCDRO CCOc1cccc(C[NH2+]CC(C)(C)C(C)C)c1O ZINC000189470597 1128773676 /nfs/dbraw/zinc/77/36/76/1128773676.db2.gz PYMYLRPPVJIOJW-UHFFFAOYSA-N 1 0 265.397 3.563 20 10 CHCDRO CC[C@H]([NH2+]CCOCc1ccccc1)c1ccccc1O ZINC000186231690 1118395359 /nfs/dbraw/zinc/39/53/59/1118395359.db2.gz GTWLFPYQKLWFSU-KRWDZBQOSA-N 1 0 285.387 3.650 20 10 CHCDRO CC[C@@H]([NH2+]CC[C@@H]1CCCCO1)c1ccc(N(C)C)cc1 ZINC000180255649 1128784501 /nfs/dbraw/zinc/78/45/01/1128784501.db2.gz SNDJBTSBLYVSLX-ZWKOTPCHSA-N 1 0 290.451 3.753 20 10 CHCDRO C[C@H]([NH2+]CCOCc1ccccc1)c1ccc(N(C)C)cc1 ZINC000156926107 1118549682 /nfs/dbraw/zinc/54/96/82/1118549682.db2.gz BGTXICMOJMCBNQ-INIZCTEOSA-N 1 0 298.430 3.620 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CC[C@H](C)C[C@H]2C)c1O ZINC000252854016 1118550236 /nfs/dbraw/zinc/55/02/36/1118550236.db2.gz KPFGFBCITUUHPG-WDEREUQCSA-N 1 0 283.799 3.675 20 10 CHCDRO CC[C@H](N[C@H]1C[C@@H](C)c2c1c(O)ccc2F)C(F)F ZINC000834827732 1118576107 /nfs/dbraw/zinc/57/61/07/1118576107.db2.gz LEPHXYCCZZYRNQ-JEZHCXPESA-N 1 0 273.298 3.713 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(F)cc2F)c1 ZINC000051016601 1118605159 /nfs/dbraw/zinc/60/51/59/1118605159.db2.gz ICKOGDGCFWUXET-SNVBAGLBSA-N 1 0 293.313 3.530 20 10 CHCDRO CCCCOCC[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000040506625 1118622196 /nfs/dbraw/zinc/62/21/96/1118622196.db2.gz XJDJQBDVTSVFQT-UHFFFAOYSA-N 1 0 290.451 3.583 20 10 CHCDRO C[C@@H]1CC[C@H](C)[N@H+](Cc2c(O)cccc2Br)C1 ZINC000707146234 1118648376 /nfs/dbraw/zinc/64/83/76/1118648376.db2.gz KLNFQHYYTWAKHP-MNOVXSKESA-N 1 0 298.224 3.775 20 10 CHCDRO CC(C)[N@H+](CCc1ccccn1)Cc1ccc(N(C)C)cc1 ZINC000728386728 1118791093 /nfs/dbraw/zinc/79/10/93/1118791093.db2.gz AIDWTYAUZDQSAA-UHFFFAOYSA-N 1 0 297.446 3.601 20 10 CHCDRO CC[C@H]([NH2+][C@@H](CC)[C@H]1CCCOC1)c1ccccc1O ZINC000723990990 1118797667 /nfs/dbraw/zinc/79/76/67/1118797667.db2.gz YGNUPKRMNGBRLX-BPUTZDHNSA-N 1 0 277.408 3.638 20 10 CHCDRO Cc1cc(C[N@@H+]2CCS[C@@H](C(C)C)C2)ccc1N(C)C ZINC001167495439 1118853000 /nfs/dbraw/zinc/85/30/00/1118853000.db2.gz FHFAFEPJOZKRES-QGZVFWFLSA-N 1 0 292.492 3.634 20 10 CHCDRO CCC(C)(C)OCC[NH2+][C@H](C)c1ccc(C)cc1O ZINC000308764867 1118898781 /nfs/dbraw/zinc/89/87/81/1118898781.db2.gz ZXICWGYDPKQRAI-CYBMUJFWSA-N 1 0 265.397 3.556 20 10 CHCDRO COCc1ccccc1C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000119580106 1118950571 /nfs/dbraw/zinc/95/05/71/1118950571.db2.gz SUFVTLNXZWIYGJ-OAHLLOKOSA-N 1 0 298.430 3.750 20 10 CHCDRO COc1ccc(C[NH2+]C2(c3ccccc3)CC2)cc1C ZINC000068979946 1128814825 /nfs/dbraw/zinc/81/48/25/1128814825.db2.gz IKPJIKFXKLBXRS-UHFFFAOYSA-N 1 0 267.372 3.783 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCC[C@H]3CCCC[C@H]32)c1 ZINC000226156961 1119103376 /nfs/dbraw/zinc/10/33/76/1119103376.db2.gz GYJLSXKQXNQORD-GDBMZVCRSA-N 1 0 259.393 3.855 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2cc(F)ccc2O)s1 ZINC000226586207 1119212995 /nfs/dbraw/zinc/21/29/95/1119212995.db2.gz ZYPWYPDRGMGRQY-SNVBAGLBSA-N 1 0 265.353 3.752 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CS[C@@H](C)C2)c(O)c1 ZINC000840858937 1119302030 /nfs/dbraw/zinc/30/20/30/1119302030.db2.gz DSXNMTCLDIKMOH-AVGNSLFASA-N 1 0 265.422 3.554 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)C1CCCCC1 ZINC000052334114 1119354479 /nfs/dbraw/zinc/35/44/79/1119354479.db2.gz OLWOYMMLQUTZJE-CYBMUJFWSA-N 1 0 259.393 3.680 20 10 CHCDRO CC1(C)CC[C@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC000162709926 1119437877 /nfs/dbraw/zinc/43/78/77/1119437877.db2.gz TVDKHXMRNBYGOV-INIZCTEOSA-N 1 0 272.436 3.955 20 10 CHCDRO CCSCC[C@H](C)[NH2+][C@H](C)c1cc(OC)ccc1O ZINC000168808351 1119479188 /nfs/dbraw/zinc/47/91/88/1119479188.db2.gz VPBHBRJHDNBSSD-NWDGAFQWSA-N 1 0 283.437 3.583 20 10 CHCDRO C[C@H]([NH2+][C@H]1CC[C@H]1C)c1cc(Br)ccc1O ZINC000309587831 1119522988 /nfs/dbraw/zinc/52/29/88/1119522988.db2.gz SQJNWIPLYVMSRD-PTRXPTGYSA-N 1 0 284.197 3.604 20 10 CHCDRO CC[C@@H]([NH2+]CCc1cccc(C)c1)c1ccccc1O ZINC000051668733 1119641185 /nfs/dbraw/zinc/64/11/85/1119641185.db2.gz SYOYGGVXIFQVTG-QGZVFWFLSA-N 1 0 269.388 3.984 20 10 CHCDRO Cc1cc(CN[C@@H](C)c2ncco2)c(C)n1-c1ccccc1 ZINC000926765709 1119976997 /nfs/dbraw/zinc/97/69/97/1119976997.db2.gz ZYHUQQHABMCVGO-AWEZNQCLSA-N 1 0 295.386 3.933 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CCC(F)(F)C1)c1ccccc1O ZINC000310933170 1119993451 /nfs/dbraw/zinc/99/34/51/1119993451.db2.gz HYLYWDQSTWIZQB-CMPLNLGQSA-N 1 0 255.308 3.621 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CCOCC2CCC2)cc1 ZINC000765809426 1120044187 /nfs/dbraw/zinc/04/41/87/1120044187.db2.gz NYTNBSFVDSXKPT-HNNXBMFYSA-N 1 0 290.451 3.610 20 10 CHCDRO CC(C)([NH2+]Cc1cc(F)ccc1O)c1ccccc1 ZINC000272467426 1120046752 /nfs/dbraw/zinc/04/67/52/1120046752.db2.gz RIUOBEMWMZPKKO-UHFFFAOYSA-N 1 0 259.324 3.556 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCCC(F)(F)C1)c1ccccc1O ZINC000695066085 1120100466 /nfs/dbraw/zinc/10/04/66/1120100466.db2.gz MWTCILQVVPLUTA-QWRGUYRKSA-N 1 0 255.308 3.621 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCCC(F)(F)C1)c1ccccc1O ZINC000695065877 1120100702 /nfs/dbraw/zinc/10/07/02/1120100702.db2.gz MWTCILQVVPLUTA-GHMZBOCLSA-N 1 0 255.308 3.621 20 10 CHCDRO CC(C)OCCC[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000728688034 1120140275 /nfs/dbraw/zinc/14/02/75/1120140275.db2.gz AYGOTBVGCZGMKQ-UHFFFAOYSA-N 1 0 290.451 3.532 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCCOC(C)(C)C)c(O)c1 ZINC000695281358 1120184145 /nfs/dbraw/zinc/18/41/45/1120184145.db2.gz RSZKCOQKXNWLCD-ZDUSSCGKSA-N 1 0 265.397 3.556 20 10 CHCDRO CC[C@H](C)[C@@](C)(O)C[NH2+][C@@H](CC)c1ccc(N(C)C)cc1 ZINC000765948071 1120251137 /nfs/dbraw/zinc/25/11/37/1120251137.db2.gz YYNMJNQNKMWUPJ-WBAXXEDZSA-N 1 0 292.467 3.590 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCS[C@@H]2C)cc1 ZINC000312089295 1120293490 /nfs/dbraw/zinc/29/34/90/1120293490.db2.gz PADPFUFABFCFAK-CZUORRHYSA-N 1 0 278.465 3.516 20 10 CHCDRO c1cncc([C@H]([NH2+]Cc2ccc3c(c2)CCCO3)C2CC2)c1 ZINC000921939453 1120294066 /nfs/dbraw/zinc/29/40/66/1120294066.db2.gz BMRFLMAJTGZWJJ-LJQANCHMSA-N 1 0 294.398 3.648 20 10 CHCDRO COc1ccc(N2CC[NH+]([C@@H](C)c3ccccc3)CC2)cc1 ZINC000078224898 1128907526 /nfs/dbraw/zinc/90/75/26/1128907526.db2.gz MVDSWWAQXCKIES-INIZCTEOSA-N 1 0 296.414 3.578 20 10 CHCDRO CC(C)(C)c1cccc(C[N@H+]2C[C@H]3[C@H](CC3(F)F)C2)c1O ZINC001143103978 1120348640 /nfs/dbraw/zinc/34/86/40/1120348640.db2.gz NXRLRNDCBIIEPS-OCCSQVGLSA-N 1 0 295.373 3.777 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1C[C@@H]1C)c1cc2c(cc1O)CCCC2 ZINC000756453889 1120353479 /nfs/dbraw/zinc/35/34/79/1120353479.db2.gz AUDCEMVVWBFROJ-HUBLWGQQSA-N 1 0 259.393 3.578 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCCNc2ccccc2)c(O)c1 ZINC000185489528 1120378428 /nfs/dbraw/zinc/37/84/28/1120378428.db2.gz AUQTWDZVZXLAOQ-HNNXBMFYSA-N 1 0 284.403 3.853 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H](C)c2ccccn2)c1 ZINC000692689426 1120488683 /nfs/dbraw/zinc/48/86/83/1120488683.db2.gz GAFSRQYFOLSKLJ-KGLIPLIRSA-N 1 0 270.376 3.550 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)C[C@@H](C)O2)c1ccccc1O ZINC000922328648 1120513841 /nfs/dbraw/zinc/51/38/41/1120513841.db2.gz GRGJYJXEQIIEHO-OLZOCXBDSA-N 1 0 283.371 3.566 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCc2ccccc21)c1cc(F)ccc1O ZINC000756562055 1120522541 /nfs/dbraw/zinc/52/25/41/1120522541.db2.gz FDLFNUPBRMQHTJ-TZMCWYRMSA-N 1 0 285.362 3.912 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2ccccc2)c1 ZINC000019878471 1120542990 /nfs/dbraw/zinc/54/29/90/1120542990.db2.gz UWIMAOKJYMYHKY-OLZOCXBDSA-N 1 0 271.360 3.813 20 10 CHCDRO CCC[N@H+](Cc1occc1C)Cc1ccccc1O ZINC000092705028 1120552911 /nfs/dbraw/zinc/55/29/11/1120552911.db2.gz CREAVVOBULFWRT-UHFFFAOYSA-N 1 0 259.349 3.706 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(C)cc2)c1 ZINC000019962555 1120553723 /nfs/dbraw/zinc/55/37/23/1120553723.db2.gz ZTFOGAHOYMCLAD-CYBMUJFWSA-N 1 0 271.360 3.560 20 10 CHCDRO C[N@H+](Cc1c(O)cccc1Cl)C(C1CC1)C1CC1 ZINC000123647886 1120555582 /nfs/dbraw/zinc/55/55/82/1120555582.db2.gz XLOXDTBTNIVIHT-UHFFFAOYSA-N 1 0 265.784 3.666 20 10 CHCDRO CCO[C@@H](C[NH2+]Cc1ccc(N(C)C)cc1)c1ccccc1 ZINC000194461221 1120599764 /nfs/dbraw/zinc/59/97/64/1120599764.db2.gz NXVYXKBHWSNKNX-IBGZPJMESA-N 1 0 298.430 3.620 20 10 CHCDRO C[C@@H]1C[C@@H]([NH2+]C/C=C\c2ccc(N(C)C)cc2)CCS1 ZINC000922837242 1120607712 /nfs/dbraw/zinc/60/77/12/1120607712.db2.gz GNPVDTCRZDIJMF-PJFORWJISA-N 1 0 290.476 3.640 20 10 CHCDRO C[C@@H]([NH2+]CC[C@@H]1CC1(Cl)Cl)c1cc(F)ccc1O ZINC000857082392 1120629197 /nfs/dbraw/zinc/62/91/97/1120629197.db2.gz NDDGDQQZBHOHFI-RKDXNWHRSA-N 1 0 292.181 3.766 20 10 CHCDRO Cc1ccc(C[C@@H](C)[NH2+][C@H]2CCc3cccc(O)c32)s1 ZINC000312900056 1120654254 /nfs/dbraw/zinc/65/42/54/1120654254.db2.gz YHMZMHKQRMXBBR-ABAIWWIYSA-N 1 0 287.428 3.970 20 10 CHCDRO Cc1cnc([C@H](C)C[NH2+][C@@H](C)c2ccccc2O)s1 ZINC000186774484 1120666043 /nfs/dbraw/zinc/66/60/43/1120666043.db2.gz KFVPHEQKXAUTGC-PWSUYJOCSA-N 1 0 276.405 3.611 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)Cc1ccsc1 ZINC000766028883 1120673890 /nfs/dbraw/zinc/67/38/90/1120673890.db2.gz IHYOIUHHZPQBTD-AWEZNQCLSA-N 1 0 288.460 3.843 20 10 CHCDRO Cc1cc(Br)cc(C[N@@H+](C)CC(C)C)c1O ZINC000162809035 1120752491 /nfs/dbraw/zinc/75/24/91/1120752491.db2.gz AJKIXWRAXVCPGY-UHFFFAOYSA-N 1 0 286.213 3.551 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCc2ccc(F)c(F)c2)c1 ZINC000191518970 1128942402 /nfs/dbraw/zinc/94/24/02/1128942402.db2.gz DENANAICNZAMMJ-LBPRGKRZSA-N 1 0 291.341 3.872 20 10 CHCDRO CSCC[C@@H](C)[N@H+](C)Cc1cc(C)c(C)cc1O ZINC000093558708 1120822233 /nfs/dbraw/zinc/82/22/33/1120822233.db2.gz NAQMNWPJWLRFPB-CYBMUJFWSA-N 1 0 267.438 3.582 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]CCSC(C)(C)C)c1 ZINC000273345732 1120837317 /nfs/dbraw/zinc/83/73/17/1120837317.db2.gz APIISKUCBPBDLD-LLVKDONJSA-N 1 0 283.437 3.583 20 10 CHCDRO Cc1nc(C(C)(C)[NH2+]Cc2cccc(C)c2O)sc1C ZINC000182223387 1128946496 /nfs/dbraw/zinc/94/64/96/1128946496.db2.gz FPUOCWBGTBYOSC-UHFFFAOYSA-N 1 0 290.432 3.799 20 10 CHCDRO CCSCC[C@@H](C)[N@H+](C)Cc1cc(C)ccc1O ZINC000093871032 1120893141 /nfs/dbraw/zinc/89/31/41/1120893141.db2.gz JLSYXWMNDNERML-CYBMUJFWSA-N 1 0 267.438 3.664 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)c1ccccn1 ZINC000314201722 1120905110 /nfs/dbraw/zinc/90/51/10/1120905110.db2.gz QELSTISMLNZLTH-INIZCTEOSA-N 1 0 295.430 3.923 20 10 CHCDRO Cc1cc(C[NH2+]Cc2ccccn2)c(C)n1-c1ccccc1 ZINC000314382076 1120937079 /nfs/dbraw/zinc/93/70/79/1120937079.db2.gz QUQOBJGDTHDVBB-UHFFFAOYSA-N 1 0 291.398 3.779 20 10 CHCDRO COc1cc(Cl)cc(C[NH+]2C[C@@H](C)C[C@H](C)C2)c1O ZINC000228561344 1120972018 /nfs/dbraw/zinc/97/20/18/1120972018.db2.gz FKUFGNCZJQGVPD-QWRGUYRKSA-N 1 0 283.799 3.532 20 10 CHCDRO CO[C@@H](C)CC[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000273617857 1120973320 /nfs/dbraw/zinc/97/33/20/1120973320.db2.gz YCSOSONNEIMJNT-QWHCGFSZSA-N 1 0 273.376 3.621 20 10 CHCDRO COc1ccc(C[NH2+][C@H]2CCCCC23CCCC3)c(O)c1 ZINC000314940893 1120982089 /nfs/dbraw/zinc/98/20/89/1120982089.db2.gz SDUOUNZGFKFWBD-KRWDZBQOSA-N 1 0 289.419 3.993 20 10 CHCDRO CC1(C)CC[C@H]([NH2+]Cc2cc(Br)ccc2O)C1 ZINC000218963136 1120991977 /nfs/dbraw/zinc/99/19/77/1120991977.db2.gz NRIWCHOCKXYWKZ-LBPRGKRZSA-N 1 0 298.224 3.823 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CCCc2nn(C)cc21)c1ccc(C)cc1O ZINC000282516658 1121064237 /nfs/dbraw/zinc/06/42/37/1121064237.db2.gz UEANOCGTRONQQL-HZPDHXFCSA-N 1 0 299.418 3.552 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]CC1CCSCC1 ZINC000168774007 1121143882 /nfs/dbraw/zinc/14/38/82/1121143882.db2.gz PSXOSJCXGKALKW-TZMCWYRMSA-N 1 0 291.460 3.982 20 10 CHCDRO Cc1cc(C[NH2+][C@H]2CCO[C@@H](C)C2)c(C)n1-c1ccccc1 ZINC000318851026 1121171957 /nfs/dbraw/zinc/17/19/57/1121171957.db2.gz NTMQSTBBODYHPO-YJBOKZPZSA-N 1 0 298.430 3.751 20 10 CHCDRO Cc1cc(C[NH2+][C@@H]2CCO[C@H](C)C2)c(C)n1-c1ccccc1 ZINC000318851023 1121172609 /nfs/dbraw/zinc/17/26/09/1121172609.db2.gz NTMQSTBBODYHPO-CRAIPNDOSA-N 1 0 298.430 3.751 20 10 CHCDRO CCCC[C@H](COC)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000766076210 1121183729 /nfs/dbraw/zinc/18/37/29/1121183729.db2.gz QMGLLLDIHGIBCN-GOEBONIOSA-N 1 0 278.440 3.608 20 10 CHCDRO CC[C@H]([NH2+]CCC1(F)CCC1)c1ccccc1O ZINC000702433204 1121199570 /nfs/dbraw/zinc/19/95/70/1121199570.db2.gz UXORJYFEZVLHBG-ZDUSSCGKSA-N 1 0 251.345 3.715 20 10 CHCDRO C[C@@H]([NH2+]CC[C@H](C)F)c1ccc2ccccc2c1O ZINC000702625084 1121206155 /nfs/dbraw/zinc/20/61/55/1121206155.db2.gz XCGMDEOENOIJOI-NWDGAFQWSA-N 1 0 261.340 3.944 20 10 CHCDRO CC(C)O[C@@H]1C[C@@H]([NH2+]Cc2cc(Cl)ccc2O)C1(C)C ZINC000766088347 1121207208 /nfs/dbraw/zinc/20/72/08/1121207208.db2.gz HUXADWRRIIUVRI-HUUCEWRRSA-N 1 0 297.826 3.727 20 10 CHCDRO CC(C)O[C@H]1C[C@@H]([NH2+]Cc2cc(Cl)ccc2O)C1(C)C ZINC000766088345 1121207683 /nfs/dbraw/zinc/20/76/83/1121207683.db2.gz HUXADWRRIIUVRI-CABCVRRESA-N 1 0 297.826 3.727 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)CC(F)(F)F)c(O)c1 ZINC000231791499 1121244162 /nfs/dbraw/zinc/24/41/62/1121244162.db2.gz PYVKAOSZCBJJSG-VHSXEESVSA-N 1 0 261.287 3.692 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CSC[C@H]1C)c1ccc(N(C)C)cc1 ZINC000797064037 1121267906 /nfs/dbraw/zinc/26/79/06/1121267906.db2.gz FPOHWMQGHGFCIF-UHOFOFEASA-N 1 0 278.465 3.545 20 10 CHCDRO CC[C@@H]([NH2+]CC[C@@H]1CCSC1)c1ccccc1O ZINC000704777418 1121367847 /nfs/dbraw/zinc/36/78/47/1121367847.db2.gz TZKPJKZLLYEKMG-TZMCWYRMSA-N 1 0 265.422 3.576 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCSC[C@H]2C(C)(C)C)cc1 ZINC001175697397 1121416856 /nfs/dbraw/zinc/41/68/56/1121416856.db2.gz CKWWOOCLJHQWEZ-INIZCTEOSA-N 1 0 292.492 3.716 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCCC12CC2)c1cc(F)ccc1O ZINC000706226655 1121420138 /nfs/dbraw/zinc/42/01/38/1121420138.db2.gz SDSWRBHGIMQVAW-RYUDHWBXSA-N 1 0 263.356 3.762 20 10 CHCDRO CCOCc1cc(C[NH2+]C[C@]23C[C@H]2CCC3)ccc1OC ZINC000922964905 1121499994 /nfs/dbraw/zinc/49/99/94/1121499994.db2.gz KRAKNMJYSCHRPI-AEFFLSMTSA-N 1 0 289.419 3.512 20 10 CHCDRO CC[C@@H](Cc1ccc(C)cc1)[NH2+]Cc1cccc(OC)c1O ZINC000237016750 1121606111 /nfs/dbraw/zinc/60/61/11/1121606111.db2.gz JMKNHQCURSCCTQ-KRWDZBQOSA-N 1 0 299.414 3.820 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CCOC23CCCCC3)cc1C ZINC001176760587 1121692463 /nfs/dbraw/zinc/69/24/63/1121692463.db2.gz BKVMDGDRJZIBGG-QGZVFWFLSA-N 1 0 289.419 3.585 20 10 CHCDRO C[C@@H]1CC(C)(C)C[C@@H]1[NH2+]Cc1ccc2c(c1)CCCN2C ZINC001177529985 1121735141 /nfs/dbraw/zinc/73/51/41/1121735141.db2.gz XSQNAIZFCLIEHR-PBHICJAKSA-N 1 0 286.463 3.983 20 10 CHCDRO CCN(C)c1ccc(C[N@H+](C)Cc2cccs2)cc1 ZINC000773732497 1121774102 /nfs/dbraw/zinc/77/41/02/1121774102.db2.gz CEMDREQZBKAZBH-UHFFFAOYSA-N 1 0 274.433 3.836 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]CC2(C3CC3)CCC2)cc1 ZINC001178272023 1121777133 /nfs/dbraw/zinc/77/71/33/1121777133.db2.gz ACFRAWWAORZLPS-HYXAFXHYSA-N 1 0 284.447 3.936 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)CC(C)(C)OC)c1ccc(N(C)C)cc1 ZINC000766189615 1121780327 /nfs/dbraw/zinc/78/03/27/1121780327.db2.gz GHQWOBUKZVYRPM-YOEHRIQHSA-N 1 0 292.467 3.997 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccccc1F ZINC001203357002 1121806807 /nfs/dbraw/zinc/80/68/07/1121806807.db2.gz CHOOQVDWINRUNH-UHFFFAOYSA-N 1 0 286.394 3.914 20 10 CHCDRO CC(C)(C[NH2+]Cc1ccc2c(c1)CCCO2)C1CCC1 ZINC001178736636 1121809616 /nfs/dbraw/zinc/80/96/16/1121809616.db2.gz FLQPNKLPRIUMAC-UHFFFAOYSA-N 1 0 273.420 3.928 20 10 CHCDRO CN(C)c1ccc(C[NH2+]CCC(C)(C)C2CC2)cc1F ZINC001178817268 1121823723 /nfs/dbraw/zinc/82/37/23/1121823723.db2.gz MYCRVGDVHIANNG-UHFFFAOYSA-N 1 0 278.415 3.808 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C[C@H]2C[C@@H]2c2ccccc2)cc1 ZINC000237125572 1121833531 /nfs/dbraw/zinc/83/35/31/1121833531.db2.gz JBQYKFMSQGDDFA-IEBWSBKVSA-N 1 0 280.415 3.646 20 10 CHCDRO CCCOc1ccc(C[NH2+]CC2CC(C)C2)cc1C ZINC001179232968 1121861970 /nfs/dbraw/zinc/86/19/70/1121861970.db2.gz WVIDLSHJTGIIHN-UHFFFAOYSA-N 1 0 261.409 3.920 20 10 CHCDRO COc1ccc2c(c1)C[C@@H]([NH2+][C@H](C)c1ccccc1O)CC2 ZINC001179489518 1121883479 /nfs/dbraw/zinc/88/34/79/1121883479.db2.gz RTBHRJYTXZZDMD-CJNGLKHVSA-N 1 0 297.398 3.609 20 10 CHCDRO CC[N@H+](Cc1ccoc1)Cc1cc(Cl)c(C)cc1O ZINC001179869519 1121921502 /nfs/dbraw/zinc/92/15/02/1121921502.db2.gz XLYSSKHUTJHJOO-UHFFFAOYSA-N 1 0 279.767 3.969 20 10 CHCDRO CC[C@@H]1CCC[N@@H+]1C/C=C/c1ccc(N(C)C)cc1 ZINC001179863575 1121921906 /nfs/dbraw/zinc/92/19/06/1121921906.db2.gz PMPSOVFHVQGDGL-BIENSFFJSA-N 1 0 258.409 3.640 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(N(C)CC)cc1)c1nccs1 ZINC000773839020 1121952360 /nfs/dbraw/zinc/95/23/60/1121952360.db2.gz OQTGPGTTWKSRJA-OAHLLOKOSA-N 1 0 289.448 3.840 20 10 CHCDRO Cc1ccccc1OCC[NH2+]Cc1c(O)cccc1Cl ZINC000733325048 1121976868 /nfs/dbraw/zinc/97/68/68/1121976868.db2.gz UIWLSZVNYXLVOC-UHFFFAOYSA-N 1 0 291.778 3.523 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CCCC3(CC3)C2)cc1 ZINC000773856605 1121984425 /nfs/dbraw/zinc/98/44/25/1121984425.db2.gz JKUCNESYNJRRNN-UHFFFAOYSA-N 1 0 258.409 3.519 20 10 CHCDRO Cc1occc1C[NH2+]Cc1c(C)c2ccccc2n1C ZINC000414444526 1121989552 /nfs/dbraw/zinc/98/95/52/1121989552.db2.gz KXAVJEYCWSHCFF-UHFFFAOYSA-N 1 0 268.360 3.678 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC(C)=C(C)C2)c(Cl)c1 ZINC001181284488 1122045838 /nfs/dbraw/zinc/04/58/38/1122045838.db2.gz BERBBVLOBQAXTI-UHFFFAOYSA-N 1 0 265.784 3.896 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2ccc3ncccc3c2)c(O)c1 ZINC001181435178 1122056949 /nfs/dbraw/zinc/05/69/49/1122056949.db2.gz AEQLQMCXHRSIGV-UHFFFAOYSA-N 1 0 278.355 3.539 20 10 CHCDRO COc1ccc(N(CCCn2ccnc2)[C@@H](C)C2CC2)cc1 ZINC000183189616 1129032654 /nfs/dbraw/zinc/03/26/54/1129032654.db2.gz LLTVANOBILFYQD-HNNXBMFYSA-N 1 0 299.418 3.587 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H](c2ccccc2)N(C)C)c1 ZINC000192743776 1129033182 /nfs/dbraw/zinc/03/31/82/1129033182.db2.gz PMYXJPXITCBTPV-YJBOKZPZSA-N 1 0 298.430 3.654 20 10 CHCDRO COc1cc(C)cc(C[NH2+]C(C)(C)c2cccs2)c1O ZINC000894259344 1122130250 /nfs/dbraw/zinc/13/02/50/1122130250.db2.gz DLWSDMYYIDPHBP-UHFFFAOYSA-N 1 0 291.416 3.796 20 10 CHCDRO COc1cccc([C@H](C)[N@H+](C)Cc2ccccc2O)c1 ZINC000079433189 1129034258 /nfs/dbraw/zinc/03/42/58/1129034258.db2.gz LGVCJECAYKNVIM-ZDUSSCGKSA-N 1 0 271.360 3.594 20 10 CHCDRO CC[C@@H]([NH2+]CCN1CCCC(C)(C)C1)c1ccccc1O ZINC000774490473 1122169966 /nfs/dbraw/zinc/16/99/66/1122169966.db2.gz XSNOHXIDYVATEB-MRXNPFEDSA-N 1 0 290.451 3.555 20 10 CHCDRO COc1cccc(C[NH2+][C@H](C)[C@H](C)c2ccccc2)c1O ZINC000271834521 1122177551 /nfs/dbraw/zinc/17/75/51/1122177551.db2.gz PORHVRLIPDODJB-UONOGXRCSA-N 1 0 285.387 3.683 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C[C@@H](C)c2cc(F)cc(F)c2)c1 ZINC001182960247 1122196878 /nfs/dbraw/zinc/19/68/78/1122196878.db2.gz PYUXKPCLLKMADA-GFCCVEGCSA-N 1 0 291.341 3.872 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2c(F)ccc(F)c2Cl)c1 ZINC001182960147 1122197151 /nfs/dbraw/zinc/19/71/51/1122197151.db2.gz OYRKIMAJTMPZDA-UHFFFAOYSA-N 1 0 297.732 3.922 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CC[C@H]3C[C@H]3C2)c(C(F)(F)F)c1 ZINC001183012385 1122199876 /nfs/dbraw/zinc/19/98/76/1122199876.db2.gz RQGIJGXGOQITGY-AAEUAGOBSA-N 1 0 298.352 3.613 20 10 CHCDRO C[C@H]([NH2+]C1CC(c2ccccc2)C1)c1ccccc1O ZINC000272805550 1122213834 /nfs/dbraw/zinc/21/38/34/1122213834.db2.gz CCRZKXUMJNLOMT-JEYLPNPQSA-N 1 0 267.372 3.989 20 10 CHCDRO Oc1cc(Cl)ccc1C[NH+]1CCC(CCF)CC1 ZINC001183248858 1122215297 /nfs/dbraw/zinc/21/52/97/1122215297.db2.gz RPAZXHJJCCOOOW-UHFFFAOYSA-N 1 0 271.763 3.617 20 10 CHCDRO CC[C@](C)([NH2+]Cc1cc(Cl)cc(OC)c1O)C1CC1 ZINC000691638784 1122221171 /nfs/dbraw/zinc/22/11/71/1122221171.db2.gz LKZQPYNBKLOGJO-HNNXBMFYSA-N 1 0 283.799 3.723 20 10 CHCDRO Cc1ccc([C@@H](O)C[NH2+][C@H](C)c2ccc(C)c(C)c2O)cc1 ZINC000273299387 1122227101 /nfs/dbraw/zinc/22/71/01/1122227101.db2.gz AZPYTQZFDCMSLD-QAPCUYQASA-N 1 0 299.414 3.702 20 10 CHCDRO CCOc1ccc(C[NH2+][C@H](C)c2ccc(C)cc2O)cc1 ZINC000273391108 1122231637 /nfs/dbraw/zinc/23/16/37/1122231637.db2.gz KSBGYUIXGVZCTG-CQSZACIVSA-N 1 0 285.387 3.950 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(F)cc2)c(O)c1C ZINC000273412744 1122232031 /nfs/dbraw/zinc/23/20/31/1122232031.db2.gz PZSJBQOGYJZSNO-ZDUSSCGKSA-N 1 0 273.351 3.999 20 10 CHCDRO Cc1cccc([C@H](O)C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)c1 ZINC000273455197 1122234192 /nfs/dbraw/zinc/23/41/92/1122234192.db2.gz GXCKKTZAUJJIIO-MAUKXSAKSA-N 1 0 299.414 3.702 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](C)c2nccs2)c(O)c1C ZINC000273471428 1122235248 /nfs/dbraw/zinc/23/52/48/1122235248.db2.gz SAYTWTQZCZBJED-YPMHNXCESA-N 1 0 290.432 3.920 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCO[C@@H](CC(C)C)C2)c1 ZINC000273519294 1122237107 /nfs/dbraw/zinc/23/71/07/1122237107.db2.gz TYOZEFMOIOMJOZ-JYJNAYRXSA-N 1 0 291.435 3.945 20 10 CHCDRO Cc1cnccc1CC[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000273528120 1122237264 /nfs/dbraw/zinc/23/72/64/1122237264.db2.gz VURWIHQLRIVJKW-LBPRGKRZSA-N 1 0 290.794 3.642 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccccc2N(C)C)c(O)c1 ZINC000273536909 1122237912 /nfs/dbraw/zinc/23/79/12/1122237912.db2.gz XNISGCYFNZUZCJ-AWEZNQCLSA-N 1 0 284.403 3.617 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H](O)c2ccccc2C)c(O)c1C ZINC000273568860 1122238315 /nfs/dbraw/zinc/23/83/15/1122238315.db2.gz KHKNZQHLWBAMSI-YJBOKZPZSA-N 1 0 299.414 3.702 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2cn3cc(C)ccc3n2)c1 ZINC000273618330 1122241634 /nfs/dbraw/zinc/24/16/34/1122241634.db2.gz YETOZGQKLCDYHF-CQSZACIVSA-N 1 0 295.386 3.508 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@@H]2C[C@@H]2[C@H]2C[C@@H]2C)cc1Cl ZINC001183822051 1122242188 /nfs/dbraw/zinc/24/21/88/1122242188.db2.gz AUGTUBVTEVLQDS-RETIQXCHSA-N 1 0 279.811 3.736 20 10 CHCDRO CC[C@@H]1CCC[C@@H](C[NH2+]Cc2c([O-])cccc2F)C1 ZINC001183920345 1122248436 /nfs/dbraw/zinc/24/84/36/1122248436.db2.gz XBHPSYVFIZGSJW-CHWSQXEVSA-N 1 0 265.372 3.837 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@H](C)C1CCSCC1 ZINC000192898124 1129045914 /nfs/dbraw/zinc/04/59/14/1129045914.db2.gz CCHQOWVHDVHIEH-CQSZACIVSA-N 1 0 292.492 3.893 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H]1CS[C@@H](C(C)C)C1 ZINC000775141088 1122440106 /nfs/dbraw/zinc/44/01/06/1122440106.db2.gz VZOAMGVNJUBOQV-DLBZAZTESA-N 1 0 292.492 3.892 20 10 CHCDRO CCOc1ccc(C[N@H+](CC2CCC2)C(C)C)c(O)c1 ZINC000775175389 1122466313 /nfs/dbraw/zinc/46/63/13/1122466313.db2.gz FBOVKUSARGJGBP-UHFFFAOYSA-N 1 0 277.408 3.801 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](CC2CCC2)C(C)C)c1 ZINC000775179373 1122467519 /nfs/dbraw/zinc/46/75/19/1122467519.db2.gz YRUZPVTYROWEDJ-UHFFFAOYSA-N 1 0 277.408 3.801 20 10 CHCDRO C[C@@H]([NH2+]C[C@H](C)N(C)Cc1ccccc1)c1ccccc1O ZINC000183506625 1129058828 /nfs/dbraw/zinc/05/88/28/1129058828.db2.gz JRMVWLVLLHTXJL-JKSUJKDBSA-N 1 0 298.430 3.563 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H](C)c2ccc(F)cc2F)c1 ZINC000071407298 1129060155 /nfs/dbraw/zinc/06/01/55/1129060155.db2.gz AWYUSDULKURCNU-LLVKDONJSA-N 1 0 277.314 3.830 20 10 CHCDRO CSCCCCC[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000775358896 1122527381 /nfs/dbraw/zinc/52/73/81/1122527381.db2.gz BAGNRQIJPIDHIN-UHFFFAOYSA-N 1 0 284.444 3.515 20 10 CHCDRO COc1ccc(C[NH2+][C@H]2CCCO[C@@H]2CC(C)C)cc1C ZINC000775367611 1122530607 /nfs/dbraw/zinc/53/06/07/1122530607.db2.gz ALYMGDVCLPANHC-FUHWJXTLSA-N 1 0 291.435 3.687 20 10 CHCDRO CCC(CC)(CCO)[NH2+]Cc1cc(C(C)C)ccc1O ZINC001205503820 1122532359 /nfs/dbraw/zinc/53/23/59/1122532359.db2.gz KCSPOSACOKGGCP-UHFFFAOYSA-N 1 0 279.424 3.546 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](O)c1cc(C)cc(C)c1)c1ccccc1O ZINC000775413851 1122556457 /nfs/dbraw/zinc/55/64/57/1122556457.db2.gz CMECFDZGGQGXFH-IEBWSBKVSA-N 1 0 299.414 3.783 20 10 CHCDRO C[C@@H]1CCC[C@@H](C)[N@H+](Cc2ccc(N(C)C)cc2)C1 ZINC001191068040 1122568470 /nfs/dbraw/zinc/56/84/70/1122568470.db2.gz AIMOLYJGAOLHCH-HUUCEWRRSA-N 1 0 260.425 3.763 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCCOC1)c1cccc(Cl)c1[O-] ZINC000287273713 1122570221 /nfs/dbraw/zinc/57/02/21/1122570221.db2.gz BCHPUROLZHMTPU-RISCZKNCSA-N 1 0 283.799 3.513 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccccn1)c1cc(Cl)ccc1O ZINC000775483467 1122616593 /nfs/dbraw/zinc/61/65/93/1122616593.db2.gz WNXQZECDRKBSGV-OAHLLOKOSA-N 1 0 290.794 3.724 20 10 CHCDRO CC[C@H]([NH2+]Cc1c(C)noc1C)c1cc(Cl)ccc1O ZINC000775489768 1122620286 /nfs/dbraw/zinc/62/02/86/1122620286.db2.gz SBERKTNJKQQFQI-AWEZNQCLSA-N 1 0 294.782 3.891 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCCOC1)c1cc(Cl)ccc1O ZINC000775490648 1122620353 /nfs/dbraw/zinc/62/03/53/1122620353.db2.gz CVUJNVFPFIBKDF-RISCZKNCSA-N 1 0 283.799 3.513 20 10 CHCDRO CC[C@@H]([NH2+]CCc1cccnc1)c1cc(Cl)ccc1O ZINC000775493273 1122622621 /nfs/dbraw/zinc/62/26/21/1122622621.db2.gz WWFJRZWMOLBZJE-OAHLLOKOSA-N 1 0 290.794 3.724 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](C)N1CCC(C)CC1)c1ccccc1O ZINC000775497161 1122626506 /nfs/dbraw/zinc/62/65/06/1122626506.db2.gz NQZHASXLBDVMOG-WBVHZDCISA-N 1 0 290.451 3.553 20 10 CHCDRO CC[C@H]([NH2+]CCCSC)c1cc(Cl)ccc1O ZINC000775508633 1122629624 /nfs/dbraw/zinc/62/96/24/1122629624.db2.gz WAMROXKZJLHQBA-LBPRGKRZSA-N 1 0 273.829 3.839 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1cnn(C)c1)c1cc(Cl)ccc1O ZINC000775508579 1122629672 /nfs/dbraw/zinc/62/96/72/1122629672.db2.gz CVEDUGRDNDCINM-QMTHXVAHSA-N 1 0 293.798 3.581 20 10 CHCDRO CC[C@@H]([NH2+]CCc1nccs1)c1cc(Cl)ccc1O ZINC000775500630 1122629911 /nfs/dbraw/zinc/62/99/11/1122629911.db2.gz VLYXRTKRVQTPKH-GFCCVEGCSA-N 1 0 296.823 3.786 20 10 CHCDRO CC[C@@H]([NH2+]CC(C)(C)OC)c1cc(Cl)ccc1O ZINC000775513188 1122633641 /nfs/dbraw/zinc/63/36/41/1122633641.db2.gz HNQFEPMQWBPURV-GFCCVEGCSA-N 1 0 271.788 3.511 20 10 CHCDRO CC[C@H]([NH2+]C[C@]1(C)CCCO1)c1cc(Cl)ccc1O ZINC000775514141 1122634381 /nfs/dbraw/zinc/63/43/81/1122634381.db2.gz XEYAHOMBODMLNG-ZFWWWQNUSA-N 1 0 283.799 3.655 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@]1(C)CCCO1)c1cc(Cl)ccc1O ZINC000775514140 1122634437 /nfs/dbraw/zinc/63/44/37/1122634437.db2.gz XEYAHOMBODMLNG-UKRRQHHQSA-N 1 0 283.799 3.655 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccnc(SC)c1)c1ccccc1O ZINC000775519187 1122637461 /nfs/dbraw/zinc/63/74/61/1122637461.db2.gz JDVBDVDQFJPQHP-CQSZACIVSA-N 1 0 288.416 3.750 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cccc(F)n1)c1cc(Cl)ccc1O ZINC000775523248 1122638502 /nfs/dbraw/zinc/63/85/02/1122638502.db2.gz GSRAJKNFHCFNNZ-CYBMUJFWSA-N 1 0 294.757 3.821 20 10 CHCDRO CC[C@@H]([NH2+]C1CCSCC1)c1cc(Cl)ccc1O ZINC000775519399 1122638963 /nfs/dbraw/zinc/63/89/63/1122638963.db2.gz NLNIKQRRIQORJG-CYBMUJFWSA-N 1 0 285.840 3.982 20 10 CHCDRO CC[C@H]([NH2+]CCC[C@H]1CCCC[C@H]1O)c1ccccc1O ZINC000775522406 1122640187 /nfs/dbraw/zinc/64/01/87/1122640187.db2.gz OPOMBGJTTSAIEP-HYVNUMGLSA-N 1 0 291.435 3.764 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1C[C@@H]1c1ccccc1)c1ccccc1O ZINC000183600080 1129068743 /nfs/dbraw/zinc/06/87/43/1129068743.db2.gz UKWFVBPAEDYNPA-UKPHBRMFSA-N 1 0 267.372 3.847 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)[C@H]1CCCOC1)c1cc(Cl)ccc1O ZINC000775548485 1122659279 /nfs/dbraw/zinc/65/92/79/1122659279.db2.gz SZETVYNIHMMDIJ-HUBLWGQQSA-N 1 0 297.826 3.901 20 10 CHCDRO CC[C@@H]1CC[N@H+](Cc2ccc(N(C)C)c(C)c2)[C@@H]1C ZINC001193603174 1122705145 /nfs/dbraw/zinc/70/51/45/1122705145.db2.gz AOLPRNGGXBKFML-GDBMZVCRSA-N 1 0 260.425 3.681 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1ccccc1O)c1c(C)noc1C ZINC000183630592 1129072757 /nfs/dbraw/zinc/07/27/57/1129072757.db2.gz JGYHBSRHWXKGNM-QMTHXVAHSA-N 1 0 274.364 3.799 20 10 CHCDRO CO[C@H]1CC[N@H+](Cc2c(O)ccc3ccccc32)CC1(C)C ZINC000295121635 1122742479 /nfs/dbraw/zinc/74/24/79/1122742479.db2.gz XLRXMKYGLXPDIX-SFHVURJKSA-N 1 0 299.414 3.792 20 10 CHCDRO COc1ccc(O)c(C[N@H+](Cc2ccccc2C)C2CC2)c1 ZINC000775649991 1122864965 /nfs/dbraw/zinc/86/49/65/1122864965.db2.gz VYKSTTAUPXYYGX-UHFFFAOYSA-N 1 0 297.398 3.874 20 10 CHCDRO Cc1cccc(C[N@@H+](C)C[C@H](C)c2ccccc2)c1O ZINC000775678175 1122900808 /nfs/dbraw/zinc/90/08/08/1122900808.db2.gz BESDXDMUBUYFSA-HNNXBMFYSA-N 1 0 269.388 3.936 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCCO[C@H](c3ccccc3)C2)c1O ZINC000775679295 1122901102 /nfs/dbraw/zinc/90/11/02/1122901102.db2.gz VTBMSPGXHUFOOA-SFHVURJKSA-N 1 0 297.398 3.664 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCS[C@H](c3ccccc3)C2)c1O ZINC000775698214 1122912106 /nfs/dbraw/zinc/91/21/06/1122912106.db2.gz MBSJRMMZLLUWDH-KRWDZBQOSA-N 1 0 299.439 3.991 20 10 CHCDRO CC[C@H]1C[N@H+](Cc2cc(Cl)cc(C)c2O)CCS1 ZINC000775702312 1122914344 /nfs/dbraw/zinc/91/43/44/1122914344.db2.gz OQPYGBGLQUAGIN-ZDUSSCGKSA-N 1 0 285.840 3.681 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2C[C@H](c3ccccc3)C[C@H]2C)c1 ZINC000775702330 1122914355 /nfs/dbraw/zinc/91/43/55/1122914355.db2.gz QAIALTXJPQFYDL-GDBMZVCRSA-N 1 0 297.398 3.779 20 10 CHCDRO CCC[C@@H](C)[C@@H]1CCC[N@@H+]1Cc1cc(OC)ccc1O ZINC000775732054 1122929181 /nfs/dbraw/zinc/92/91/81/1122929181.db2.gz LORGETNJVBQSEM-CJNGLKHVSA-N 1 0 277.408 3.801 20 10 CHCDRO COc1ccccc1CC(C)(C)[NH2+]Cc1ccccc1O ZINC000105495033 1123053867 /nfs/dbraw/zinc/05/38/67/1123053867.db2.gz PHMGITZRMIZZEL-UHFFFAOYSA-N 1 0 285.387 3.512 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+][C@@H]2CCc3ccc(C)cc32)c1 ZINC000776174352 1123101478 /nfs/dbraw/zinc/10/14/78/1123101478.db2.gz JSLBABMSNRQORV-GOSISDBHSA-N 1 0 297.398 3.876 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]C[C@@H]1CCc2ccccc21 ZINC000776174780 1123101835 /nfs/dbraw/zinc/10/18/35/1123101835.db2.gz GINKZSMIBGNGFR-ZDUSSCGKSA-N 1 0 287.790 3.865 20 10 CHCDRO CC(C)Nc1ccc(Nc2cc[nH+]c(N(C)C)c2)cc1 ZINC001201491079 1123109424 /nfs/dbraw/zinc/10/94/24/1123109424.db2.gz LOKIRYZKTKJLQF-UHFFFAOYSA-N 1 0 270.380 3.712 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc(Cl)cc(C)c1O)C1CCOCC1 ZINC000776230882 1123163423 /nfs/dbraw/zinc/16/34/23/1123163423.db2.gz BOSISMHEVBLUHR-OAHLLOKOSA-N 1 0 297.826 3.649 20 10 CHCDRO CCSCCC[NH2+]Cc1ccc(N(CC)CC)c(F)c1 ZINC001202142328 1123178217 /nfs/dbraw/zinc/17/82/17/1123178217.db2.gz FHWGFVOLAVPXQJ-UHFFFAOYSA-N 1 0 298.471 3.905 20 10 CHCDRO COc1ccc(C[NH2+]Cc2cc(Cl)ccc2O)c(C)c1 ZINC000776253076 1123179381 /nfs/dbraw/zinc/17/93/81/1123179381.db2.gz NSIXGBYSNFEELR-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)C[C@H]2CCCOC2)cc1C(C)C ZINC000107671978 1123225474 /nfs/dbraw/zinc/22/54/74/1123225474.db2.gz BUIPCDCQXWGIOZ-OAHLLOKOSA-N 1 0 291.435 3.682 20 10 CHCDRO CC[C@](C)([NH2+]Cc1cccc(OC)c1O)c1ccccc1 ZINC000107717802 1123226576 /nfs/dbraw/zinc/22/65/76/1123226576.db2.gz YGUIEMLRCPLFSL-SFHVURJKSA-N 1 0 285.387 3.816 20 10 CHCDRO CCOc1ccc(C[NH2+][C@@H]2Cc3ccccc3[C@@H]2C)c(O)c1 ZINC000850363651 1123257601 /nfs/dbraw/zinc/25/76/01/1123257601.db2.gz FHQQVYUPBXQJRP-SCLBCKFNSA-N 1 0 297.398 3.609 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CC[C@]2(C)CC2(F)F)c(Cl)c1 ZINC000850380982 1123261371 /nfs/dbraw/zinc/26/13/71/1123261371.db2.gz SGLNFCURTOJNLF-CYBMUJFWSA-N 1 0 289.753 3.879 20 10 CHCDRO COC1CC(CC[NH2+][C@@H](C)c2cc(Cl)ccc2O)C1 ZINC000850482779 1123273975 /nfs/dbraw/zinc/27/39/75/1123273975.db2.gz RELDNBLJGDGVPB-ZBOXLXRLSA-N 1 0 283.799 3.511 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCN(C(C)(C)C)C1)c1ccc(C)cc1O ZINC000850492209 1123274108 /nfs/dbraw/zinc/27/41/08/1123274108.db2.gz BQKLXRZMJRZHAS-HOCLYGCPSA-N 1 0 290.451 3.614 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](C)c1ccccn1)c1ccc(N(C)C)cc1 ZINC000850482919 1123274193 /nfs/dbraw/zinc/27/41/93/1123274193.db2.gz SIBVLBGLDDYTEM-YJBOKZPZSA-N 1 0 297.446 3.992 20 10 CHCDRO CC[C@H](COCC1CC1)[NH2+][C@@H](CC)c1ccccc1O ZINC000850494121 1123275253 /nfs/dbraw/zinc/27/52/53/1123275253.db2.gz MZONSUVYKCQHGF-ZBFHGGJFSA-N 1 0 277.408 3.638 20 10 CHCDRO CSCC1(CC[NH2+][C@@H](C)c2ccc(C)cc2O)CC1 ZINC000850506330 1123276385 /nfs/dbraw/zinc/27/63/85/1123276385.db2.gz ISVNDLIXOHZCPR-ZDUSSCGKSA-N 1 0 279.449 3.885 20 10 CHCDRO CSCC1(CC[NH2+][C@@H](C)c2cc(C)ccc2O)CC1 ZINC000850508613 1123277004 /nfs/dbraw/zinc/27/70/04/1123277004.db2.gz UVLAJKQIYNWILI-ZDUSSCGKSA-N 1 0 279.449 3.885 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H]2COC3(CCC3)C2)cc1 ZINC000850524515 1123280905 /nfs/dbraw/zinc/28/09/05/1123280905.db2.gz GTJOVUUGBHNJPK-GOEBONIOSA-N 1 0 288.435 3.505 20 10 CHCDRO C[C@H]([NH2+][C@H]1C[C@H](O)c2ccccc21)c1ccc(N(C)C)cc1 ZINC000850527619 1123282514 /nfs/dbraw/zinc/28/25/14/1123282514.db2.gz AYPSYUFURNHUMF-AGRHKRQWSA-N 1 0 296.414 3.582 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CCc2ccoc2)cc1 ZINC000850532001 1123285422 /nfs/dbraw/zinc/28/54/22/1123285422.db2.gz PGRXHASYQRGVKU-AWEZNQCLSA-N 1 0 272.392 3.629 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCc2ccc(O)cc21)c1cc(F)ccc1O ZINC000850543408 1123288994 /nfs/dbraw/zinc/28/89/94/1123288994.db2.gz JDBCWIMBXZHERL-MGPLVRAMSA-N 1 0 287.334 3.575 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1C(C)(C)C1(F)F)c1ccccc1O ZINC000850553634 1123289925 /nfs/dbraw/zinc/28/99/25/1123289925.db2.gz ZTLVEOLXQCCNEM-DGCLKSJQSA-N 1 0 269.335 3.724 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]CC2CCC(O)CC2)c1O ZINC000850553351 1123290229 /nfs/dbraw/zinc/29/02/29/1123290229.db2.gz WJAUCAZDRKGHQV-LKSINWNRSA-N 1 0 297.826 3.556 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2C(C)(C)C2(F)F)c(O)c1 ZINC000850553585 1123290234 /nfs/dbraw/zinc/29/02/34/1123290234.db2.gz ZEXGILRLJMNFKZ-GWCFXTLKSA-N 1 0 269.335 3.643 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)C2CCC(F)CC2)c1 ZINC000850554376 1123290664 /nfs/dbraw/zinc/29/06/64/1123290664.db2.gz JHDARAQTTOUJGP-FEPKRQSRSA-N 1 0 295.398 3.968 20 10 CHCDRO C[C@@H]([NH2+]CC1=CCCC1)c1ccc(Cl)cc1O ZINC000850556224 1123291159 /nfs/dbraw/zinc/29/11/59/1123291159.db2.gz DRTSBRULMCVKTF-SNVBAGLBSA-N 1 0 251.757 3.807 20 10 CHCDRO CC[C@@H]([NH2+]CCCc1ccco1)c1ccccc1O ZINC000850569422 1123294339 /nfs/dbraw/zinc/29/43/39/1123294339.db2.gz DAUJCEQZNYSXTH-OAHLLOKOSA-N 1 0 259.349 3.659 20 10 CHCDRO CC[C@H]([NH2+][C@@H](c1ccccc1)[C@H](C)O)c1ccccc1O ZINC000850582912 1123296053 /nfs/dbraw/zinc/29/60/53/1123296053.db2.gz HOTIWSBEYJPSRQ-QANKJYHBSA-N 1 0 285.387 3.555 20 10 CHCDRO COC1(C)CC[NH+](Cc2c(O)ccc3ccccc32)CC1 ZINC000271660142 1129114858 /nfs/dbraw/zinc/11/48/58/1129114858.db2.gz XMRWHRQBKSUEMF-UHFFFAOYSA-N 1 0 285.387 3.546 20 10 CHCDRO Cc1nc(CN(C)Cc2ccc(N3CCCCC3)cc2)co1 ZINC000851715841 1123374409 /nfs/dbraw/zinc/37/44/09/1123374409.db2.gz CJNVNBJBUDWCQY-UHFFFAOYSA-N 1 0 299.418 3.605 20 10 CHCDRO CC[N@H+](Cc1cc(C2CC2)no1)Cc1ccc(N(C)C)cc1 ZINC000851721712 1123374685 /nfs/dbraw/zinc/37/46/85/1123374685.db2.gz PKESGKAYAQDFMF-UHFFFAOYSA-N 1 0 299.418 3.640 20 10 CHCDRO COc1cccc(C[N@H+](C)Cc2ccccc2O)c1Cl ZINC000851841472 1123384322 /nfs/dbraw/zinc/38/43/22/1123384322.db2.gz SQOOHBPQQZYSEM-UHFFFAOYSA-N 1 0 291.778 3.686 20 10 CHCDRO C[N@H+](CCSc1ccccc1F)Cc1ccccc1O ZINC000111235745 1123432211 /nfs/dbraw/zinc/43/22/11/1123432211.db2.gz ZKVKSFAVZTVMNB-UHFFFAOYSA-N 1 0 291.391 3.755 20 10 CHCDRO c1ccc([C@H]2C[C@H]2C[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC000111398679 1123443232 /nfs/dbraw/zinc/44/32/32/1123443232.db2.gz KIMHWAMCOSFRCN-ZWKOTPCHSA-N 1 0 279.383 3.515 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cc(F)ccc2F)c1 ZINC000111405130 1123443784 /nfs/dbraw/zinc/44/37/84/1123443784.db2.gz ODSCKIAEJSRGML-SNVBAGLBSA-N 1 0 293.313 3.530 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CC[C@@H]3C[C@@H]3C2)cc1C(C)C ZINC000853581077 1123444138 /nfs/dbraw/zinc/44/41/38/1123444138.db2.gz RRGYBTXSDXGJGR-ZIAGYGMSSA-N 1 0 259.393 3.666 20 10 CHCDRO Cc1cc(Cl)cc(CN2CCC(F)(F)[C@@H](F)C2)c1O ZINC001237680602 1129125153 /nfs/dbraw/zinc/12/51/53/1129125153.db2.gz DRYGFFNTUWAKPU-NSHDSACASA-N 1 0 293.716 3.533 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2cc(C)nc3c2CCCC3)c1 ZINC000895582682 1123495564 /nfs/dbraw/zinc/49/55/64/1123495564.db2.gz VYFWQZMDYMUZFL-UHFFFAOYSA-N 1 0 296.414 3.573 20 10 CHCDRO COc1cccc(C[NH2+][C@@H]2CCCC[C@H]2C(C)C)c1O ZINC000112675766 1123496147 /nfs/dbraw/zinc/49/61/47/1123496147.db2.gz RFCHLLPMTCHUHM-LSDHHAIUSA-N 1 0 277.408 3.705 20 10 CHCDRO Oc1cccc(Cl)c1C[NH+]1CCC2(CCCCO2)CC1 ZINC000895654080 1123501494 /nfs/dbraw/zinc/50/14/94/1123501494.db2.gz ONUFSLCDCNKUAY-UHFFFAOYSA-N 1 0 295.810 3.581 20 10 CHCDRO Cc1cc([C@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)c(C)o1 ZINC000113330329 1123521359 /nfs/dbraw/zinc/52/13/59/1123521359.db2.gz WPJCWTZICSUPAD-LBPRGKRZSA-N 1 0 290.382 3.952 20 10 CHCDRO Oc1c(C[N@@H+]2CC[C@@H]([C@@H]3CCCO3)C2)ccc2ccccc21 ZINC000895848597 1123521468 /nfs/dbraw/zinc/52/14/68/1123521468.db2.gz SEKLUKUBRXQVRZ-QAPCUYQASA-N 1 0 297.398 3.546 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](C)C2(C)CC2)cc1 ZINC000776882969 1123558835 /nfs/dbraw/zinc/55/88/35/1123558835.db2.gz LJBILOKLEJJSST-KBPBESRZSA-N 1 0 260.425 3.982 20 10 CHCDRO COc1ccc(C[NH2+]Cc2c(C)oc3ccccc32)c(O)c1 ZINC000183922135 1129129795 /nfs/dbraw/zinc/12/97/95/1129129795.db2.gz XPQFLMRMTYENTH-UHFFFAOYSA-N 1 0 297.354 3.745 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC[C@H](C(F)(F)F)C2)cc1 ZINC000194155205 1129131071 /nfs/dbraw/zinc/13/10/71/1129131071.db2.gz WFMYSGLJMLICFC-ZDUSSCGKSA-N 1 0 286.341 3.527 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CC[C@H]2CC2(Cl)Cl)c1 ZINC000857081609 1123585833 /nfs/dbraw/zinc/58/58/33/1123585833.db2.gz HDYZMGXXDVSLLZ-QWRGUYRKSA-N 1 0 288.218 3.935 20 10 CHCDRO CC[C@@H]([NH2+]CC[C@H]1CC1(F)F)c1ccc(N(C)C)cc1 ZINC000857082197 1123585925 /nfs/dbraw/zinc/58/59/25/1123585925.db2.gz URSJRLZSOYGBIT-DZGCQCFKSA-N 1 0 282.378 3.839 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]C(C)(C2CC2)C2CC2)c1O ZINC000691820684 1123594324 /nfs/dbraw/zinc/59/43/24/1123594324.db2.gz UTNDVFBRFMAUIK-UHFFFAOYSA-N 1 0 295.810 3.723 20 10 CHCDRO CCc1cccc(C[NH2+][C@H](c2ccccn2)C2CC2)c1O ZINC000896609255 1123605270 /nfs/dbraw/zinc/60/52/70/1123605270.db2.gz MOPMMASOZJKDSV-KRWDZBQOSA-N 1 0 282.387 3.591 20 10 CHCDRO Cc1cc(C[NH2+]Cc2ccc(N(C)C)cc2C)ccc1F ZINC000115629269 1123620394 /nfs/dbraw/zinc/62/03/94/1123620394.db2.gz AKJOIDGKYUTNAO-UHFFFAOYSA-N 1 0 286.394 3.798 20 10 CHCDRO COc1cc(Cl)cc(C[N@H+](C)CC2CCCC2)c1O ZINC000228631248 1123634643 /nfs/dbraw/zinc/63/46/43/1123634643.db2.gz LHMYCYVFXDZCCK-UHFFFAOYSA-N 1 0 283.799 3.676 20 10 CHCDRO COc1cc(C)cc(C[N@@H+]2CCCC3(CCCC3)C2)c1O ZINC000783543232 1123635776 /nfs/dbraw/zinc/63/57/76/1123635776.db2.gz CKOHBWQAIUWFBF-UHFFFAOYSA-N 1 0 289.419 3.865 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CC[C@@H]2CCCOC2)cc1 ZINC000858445273 1123654312 /nfs/dbraw/zinc/65/43/12/1123654312.db2.gz DXBAJDUFJXFUKP-HOTGVXAUSA-N 1 0 290.451 3.610 20 10 CHCDRO CC[C@H]([NH2+]CC[C@H]1CCCOC1)c1ccc(N(C)C)cc1 ZINC000858446291 1123655306 /nfs/dbraw/zinc/65/53/06/1123655306.db2.gz WTUVQTYQJGDRIC-QAPCUYQASA-N 1 0 290.451 3.610 20 10 CHCDRO COc1ccc(C[NH2+]C[C@@H]2CCC(F)(F)C2)cc1C ZINC000281777939 1123744513 /nfs/dbraw/zinc/74/45/13/1123744513.db2.gz UDOYOAFQOHQRAG-CYBMUJFWSA-N 1 0 269.335 3.529 20 10 CHCDRO CCCOc1ccc(C[NH2+]C[C@@](C)(CC)OC)cc1C ZINC001202505427 1123772140 /nfs/dbraw/zinc/77/21/40/1123772140.db2.gz RAZSXGNGPSGWNZ-QGZVFWFLSA-N 1 0 279.424 3.689 20 10 CHCDRO COc1cccc(O)c1C[N@@H+]1CCc2c(C)cc(C)cc2C1 ZINC000777219545 1123784436 /nfs/dbraw/zinc/78/44/36/1123784436.db2.gz LPTIWNYACAFNRV-UHFFFAOYSA-N 1 0 297.398 3.576 20 10 CHCDRO CC(C)[N@H+](Cc1c(O)cccc1Br)C1CC1 ZINC000862223110 1123793389 /nfs/dbraw/zinc/79/33/89/1123793389.db2.gz NZJQJSITYCWSDC-UHFFFAOYSA-N 1 0 284.197 3.528 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)c2cc(Cl)ccc2O)nc1C ZINC000840782337 1123797683 /nfs/dbraw/zinc/79/76/83/1123797683.db2.gz ACMMIHSDBZKHFQ-GFCCVEGCSA-N 1 0 290.794 3.908 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1C[C@H]1c1ccccc1F)c1ccccc1O ZINC000840788677 1123802199 /nfs/dbraw/zinc/80/21/99/1123802199.db2.gz QXDOZNBVCPZAOM-DIOULYMOSA-N 1 0 271.335 3.738 20 10 CHCDRO COCCC1CC[NH+](Cc2ccc3ccccc3c2O)CC1 ZINC000862438213 1123809971 /nfs/dbraw/zinc/80/99/71/1123809971.db2.gz YFDQSBFYZUISOW-UHFFFAOYSA-N 1 0 299.414 3.794 20 10 CHCDRO COC1CCC([NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)CC1 ZINC000840793401 1123811065 /nfs/dbraw/zinc/81/10/65/1123811065.db2.gz ZOOQBBCIBGBOCJ-DLOFLVKXSA-N 1 0 293.382 3.627 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CCCC3(CC3)CC2)c1 ZINC000862539286 1123818544 /nfs/dbraw/zinc/81/85/44/1123818544.db2.gz LNWTWFQKZSEYLT-UHFFFAOYSA-N 1 0 275.392 3.557 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+]C1CC(OC(C)C)C1 ZINC000475198156 1123822709 /nfs/dbraw/zinc/82/27/09/1123822709.db2.gz WGXOQEZKNBVSME-UHFFFAOYSA-N 1 0 286.419 3.532 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](C)CCOC)c1cc(Cl)ccc1O ZINC000840836223 1123838823 /nfs/dbraw/zinc/83/88/23/1123838823.db2.gz VWEFAKUCUYVICX-FZMZJTMJSA-N 1 0 285.815 3.759 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CS[C@H](C)C2)c(O)c1C ZINC000840859774 1123860847 /nfs/dbraw/zinc/86/08/47/1123860847.db2.gz MGJMGOPQGDKAGG-KGYLQXTDSA-N 1 0 265.422 3.554 20 10 CHCDRO CC(=O)Nc1cccc([C@@H](C)[NH2+][C@@H](C)c2ccccc2O)c1 ZINC000192946481 1123866759 /nfs/dbraw/zinc/86/67/59/1123866759.db2.gz FLRSDLXLTQANGA-OLZOCXBDSA-N 1 0 298.386 3.762 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2cnc(CC(C)C)s2)c1 ZINC000119795637 1123908930 /nfs/dbraw/zinc/90/89/30/1123908930.db2.gz NQLTWMHWXISSMT-UHFFFAOYSA-N 1 0 290.432 3.645 20 10 CHCDRO Cc1nc(C)c(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)s1 ZINC000119825356 1123914431 /nfs/dbraw/zinc/91/44/31/1123914431.db2.gz ZHXWEHNIWSKKCT-NSHDSACASA-N 1 0 289.448 3.677 20 10 CHCDRO CCCC[C@H](COC)[NH2+][C@H](CC)c1ccc(C)cc1O ZINC000794801659 1123950355 /nfs/dbraw/zinc/95/03/55/1123950355.db2.gz KDKMYNOKASONGL-GDBMZVCRSA-N 1 0 279.424 3.947 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1COc2ccccc2C1)c1ccc(C)cc1O ZINC000794802509 1123950805 /nfs/dbraw/zinc/95/08/05/1123950805.db2.gz FVTYRDCTIWFCSQ-RDJZCZTQSA-N 1 0 297.398 3.745 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)CCSC)c1ccc(C)cc1O ZINC000794803727 1123953339 /nfs/dbraw/zinc/95/33/39/1123953339.db2.gz SOMGHMNDNNJYJS-JSGCOSHPSA-N 1 0 267.438 3.883 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1CCCCN1CC)c1ccc(C)cc1O ZINC000794806997 1123954056 /nfs/dbraw/zinc/95/40/56/1123954056.db2.gz JDDQLSJVUWTYGM-NVXWUHKLSA-N 1 0 290.451 3.616 20 10 CHCDRO CC[C@H]([NH2+]CCNc1ccccc1)c1ccc(C)cc1O ZINC000794808345 1123954864 /nfs/dbraw/zinc/95/48/64/1123954864.db2.gz ADUOYLZAWURUMX-KRWDZBQOSA-N 1 0 284.403 3.853 20 10 CHCDRO CC[C@@H]([NH2+]CCc1c(C)noc1C)c1ccc(C)cc1O ZINC000794811195 1123956385 /nfs/dbraw/zinc/95/63/85/1123956385.db2.gz VQVLVJFQFDAMHF-MRXNPFEDSA-N 1 0 288.391 3.589 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1C[C@H](OC)C1(C)C)c1ccc(C)cc1O ZINC000794811598 1123956770 /nfs/dbraw/zinc/95/67/70/1123956770.db2.gz RYQZJEBRNGMCRG-IMJJTQAJSA-N 1 0 277.408 3.555 20 10 CHCDRO CC[C@H]([NH2+]CCOC(C)(C)C)c1ccc(C)cc1O ZINC000794816234 1123958872 /nfs/dbraw/zinc/95/88/72/1123958872.db2.gz YHOKBOGJXJQVOI-AWEZNQCLSA-N 1 0 265.397 3.556 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CC)c1ccc(C)cc1O)[C@H]1CCCO1 ZINC000794815941 1123959241 /nfs/dbraw/zinc/95/92/41/1123959241.db2.gz MKUUQGDJCSAAKM-ZMSDIMECSA-N 1 0 277.408 3.699 20 10 CHCDRO CC[C@@H]([NH2+]CC1(CO)CCCCC1)c1ccc(C)cc1O ZINC000794819417 1123961016 /nfs/dbraw/zinc/96/10/16/1123961016.db2.gz WPCPDEFPSWPAGE-MRXNPFEDSA-N 1 0 291.435 3.684 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc2c(c1)COC2)c1ccc(C)cc1O ZINC000794819670 1123961689 /nfs/dbraw/zinc/96/16/89/1123961689.db2.gz XDWZSUMFPRDXRM-SFHVURJKSA-N 1 0 297.398 3.972 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H](C)N(CC)CC)cc1 ZINC000794828566 1123962462 /nfs/dbraw/zinc/96/24/62/1123962462.db2.gz CCHBHNRAXXKJJQ-CVEARBPZSA-N 1 0 291.483 3.524 20 10 CHCDRO Cc1cccc(C[N@H+]2C[C@H](C)[C@H]3CCCC[C@H]32)c1O ZINC000783593273 1123998354 /nfs/dbraw/zinc/99/83/54/1123998354.db2.gz OVPWXOLRKLXXNO-NUEKZKHPSA-N 1 0 259.393 3.711 20 10 CHCDRO Cc1scc(C[NH2+]Cc2cc(C)c(C)cc2O)c1C ZINC000865679614 1124004552 /nfs/dbraw/zinc/00/45/52/1124004552.db2.gz BRDLSFPYCNWBDY-UHFFFAOYSA-N 1 0 275.417 3.977 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]CC2([C@H]3CCCCO3)CCC2)c1 ZINC000865725857 1124008118 /nfs/dbraw/zinc/00/81/18/1124008118.db2.gz FDLDXYGFYAKCQN-QGZVFWFLSA-N 1 0 289.419 3.530 20 10 CHCDRO FC(F)(F)[C@@H]1C[C@H]1[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000865754664 1124010812 /nfs/dbraw/zinc/01/08/12/1124010812.db2.gz ZDSDMBAENUTXHS-HUUCEWRRSA-N 1 0 298.352 3.717 20 10 CHCDRO C[C@@H]([NH2+]CC(C)(C)F)c1cc(Br)ccc1O ZINC000866409302 1124064399 /nfs/dbraw/zinc/06/43/99/1124064399.db2.gz XZKAFLRZUUOYIP-MRVPVSSYSA-N 1 0 290.176 3.553 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1cnc(C)s1)c1ccccc1O ZINC000866456238 1124068307 /nfs/dbraw/zinc/06/83/07/1124068307.db2.gz XMWMNXGOQHCXJF-ZWNOBZJWSA-N 1 0 276.405 3.959 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1ccccc1O ZINC000121102659 1124077049 /nfs/dbraw/zinc/07/70/49/1124077049.db2.gz QKOOMTJWGAKXIS-QGZVFWFLSA-N 1 0 299.418 3.945 20 10 CHCDRO CCOc1cccc(C[NH2+][C@H](C)c2ccccc2O)c1 ZINC000037679358 1129165234 /nfs/dbraw/zinc/16/52/34/1129165234.db2.gz PPGIWFGXJCJIHO-CYBMUJFWSA-N 1 0 271.360 3.642 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1cc2cnccc2o1 ZINC000866618864 1124090289 /nfs/dbraw/zinc/09/02/89/1124090289.db2.gz BKFIQPILHONUHI-BXUZGUMPSA-N 1 0 294.354 3.872 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCc2cccc(O)c21)c1cc2cnccc2o1 ZINC000866618866 1124090605 /nfs/dbraw/zinc/09/06/05/1124090605.db2.gz BKFIQPILHONUHI-FZMZJTMJSA-N 1 0 294.354 3.872 20 10 CHCDRO Cc1cc(N(C)C)ccc1CNc1ccc([C@H](C)[NH3+])cc1 ZINC000841030856 1124107905 /nfs/dbraw/zinc/10/79/05/1124107905.db2.gz MDTZAHYTCYSHAS-AWEZNQCLSA-N 1 0 283.419 3.693 20 10 CHCDRO CCCC[N@H+](Cc1ccccc1O)CC1(OC)CCC1 ZINC001119234814 1131247576 /nfs/dbraw/zinc/24/75/76/1131247576.db2.gz FVXDCCVKRASZEQ-UHFFFAOYSA-N 1 0 277.408 3.563 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)c1cccs1 ZINC000122683534 1124524450 /nfs/dbraw/zinc/52/44/50/1124524450.db2.gz XFBULJIBUPZDRY-ZDUSSCGKSA-N 1 0 274.433 3.973 20 10 CHCDRO CC(C)Cc1ccc(C[NH2+]Cc2ccccc2O)cc1 ZINC000122876762 1124542344 /nfs/dbraw/zinc/54/23/44/1124542344.db2.gz QJCBATBYCFMUPV-UHFFFAOYSA-N 1 0 269.388 3.881 20 10 CHCDRO c1cc(N2CCCCC2)ccc1C[NH2+]C[C@H]1CCCS1 ZINC000123949362 1124680861 /nfs/dbraw/zinc/68/08/61/1124680861.db2.gz UKXKEMRDTRMTCM-QGZVFWFLSA-N 1 0 290.476 3.662 20 10 CHCDRO COCC(C)(C)CC[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000872104742 1124682835 /nfs/dbraw/zinc/68/28/35/1124682835.db2.gz OIHQXTYCWIXSBO-WCQYABFASA-N 1 0 295.398 3.732 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1C[C@@H]2CCC[C@@H]2O1)c1ccc(Cl)cc1O ZINC000872108970 1124685122 /nfs/dbraw/zinc/68/51/22/1124685122.db2.gz ZORNIJYGFAYDPJ-GPMKHBRKSA-N 1 0 295.810 3.654 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CC2(OC(C)C)CCC2)c1 ZINC000872115956 1124687095 /nfs/dbraw/zinc/68/70/95/1124687095.db2.gz NLUDXXUEZXTPGJ-AWEZNQCLSA-N 1 0 277.408 3.699 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CC2(OC(C)C)CCC2)c1 ZINC000872115957 1124687633 /nfs/dbraw/zinc/68/76/33/1124687633.db2.gz NLUDXXUEZXTPGJ-CQSZACIVSA-N 1 0 277.408 3.699 20 10 CHCDRO Oc1cccc2c1C[N@H+](Cc1c[nH]c3c1cccc3F)CC2 ZINC001137059047 1124710007 /nfs/dbraw/zinc/71/00/07/1124710007.db2.gz KJFSCZLZRBQALB-UHFFFAOYSA-N 1 0 296.345 3.571 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccc(OC)cc1)c1ccccc1O ZINC000019907445 1124768771 /nfs/dbraw/zinc/76/87/71/1124768771.db2.gz FRCYWHJEUBNXJY-KRWDZBQOSA-N 1 0 285.387 3.684 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]CCCc2ccccc2)c1 ZINC000020122738 1124806440 /nfs/dbraw/zinc/80/64/40/1124806440.db2.gz RNVVXZKVRKBMSW-CQSZACIVSA-N 1 0 285.387 3.684 20 10 CHCDRO Oc1ccccc1C[N@H+](CCC[C@H]1CCO1)C1CCCC1 ZINC000876720757 1124972274 /nfs/dbraw/zinc/97/22/74/1124972274.db2.gz CGIBWYGSSRZMQX-KRWDZBQOSA-N 1 0 289.419 3.706 20 10 CHCDRO Cc1nc(C)c([C@H](C)[N@H+](C)Cc2ccc(C)cc2O)s1 ZINC000876716325 1124973824 /nfs/dbraw/zinc/97/38/24/1124973824.db2.gz YLYJFSSNHUWSCJ-LBPRGKRZSA-N 1 0 290.432 3.967 20 10 CHCDRO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2c(C)cccc2O)n1 ZINC000876741346 1124975472 /nfs/dbraw/zinc/97/54/72/1124975472.db2.gz SXICKBWIVAUTJJ-KRWDZBQOSA-N 1 0 282.387 3.741 20 10 CHCDRO Cc1ccc(CNc2ccc(C)cc2C[NH+](C)C)c(O)c1 ZINC000876864860 1124984903 /nfs/dbraw/zinc/98/49/03/1124984903.db2.gz WJGNHCFIPWNXNM-UHFFFAOYSA-N 1 0 284.403 3.683 20 10 CHCDRO COc1ccc([C@H]([NH2+]Cc2ccc(C)cc2O)C2CC2)cc1 ZINC000876904868 1124988413 /nfs/dbraw/zinc/98/84/13/1124988413.db2.gz MJLMXPDYMSPNKP-LJQANCHMSA-N 1 0 297.398 3.950 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]Cc1ccc([C@H]2C[C@@H]2C)o1 ZINC000876945612 1124991743 /nfs/dbraw/zinc/99/17/43/1124991743.db2.gz GLKSEFPUONIZKE-JSGCOSHPSA-N 1 0 271.360 3.707 20 10 CHCDRO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(C)cc1O)CC2 ZINC000877015355 1124998887 /nfs/dbraw/zinc/99/88/87/1124998887.db2.gz MZXWAVNRAQSBDO-KRWDZBQOSA-N 1 0 267.372 3.786 20 10 CHCDRO CCc1cccc2c1OCC[C@@H]2[NH2+]Cc1ccc(C)cc1O ZINC000877023143 1124999416 /nfs/dbraw/zinc/99/94/16/1124999416.db2.gz FXNVBCTVXXLCML-KRWDZBQOSA-N 1 0 297.398 3.876 20 10 CHCDRO CCc1nc([C@@H](C)[NH2+]Cc2ccc(C)cc2O)cs1 ZINC000877045900 1125001724 /nfs/dbraw/zinc/00/17/24/1125001724.db2.gz FULFMBMJFYKQBS-LLVKDONJSA-N 1 0 276.405 3.570 20 10 CHCDRO Cc1nc(C(C)(C)[NH2+]Cc2ccc(C)cc2O)sc1C ZINC000877044486 1125001595 /nfs/dbraw/zinc/00/15/95/1125001595.db2.gz XLPQNCMYCWNOBE-UHFFFAOYSA-N 1 0 290.432 3.799 20 10 CHCDRO CCC(CC)c1cc(C[NH2+]Cc2c(C)cccc2O)on1 ZINC000877063260 1125004112 /nfs/dbraw/zinc/00/41/12/1125004112.db2.gz HLASSVSVSMGEOG-UHFFFAOYSA-N 1 0 288.391 3.882 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2ccccc2OCC2CC2)c(O)c1 ZINC000877052514 1125004354 /nfs/dbraw/zinc/00/43/54/1125004354.db2.gz SGMVNPUTVGEEPO-UHFFFAOYSA-N 1 0 297.398 3.779 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H]2CCO[C@@H](c3ccccc3)C2)c(O)c1 ZINC000877377138 1125024289 /nfs/dbraw/zinc/02/42/89/1125024289.db2.gz VZUREGKNLBRDQL-IEBWSBKVSA-N 1 0 297.398 3.711 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](c2ccccc2)C(C)(C)CO)c(O)c1 ZINC000877481408 1125032834 /nfs/dbraw/zinc/03/28/34/1125032834.db2.gz GTADSPHGVCOCRU-GOSISDBHSA-N 1 0 299.414 3.550 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]C[C@@H]1CCCCC1(F)F ZINC000877556498 1125044443 /nfs/dbraw/zinc/04/44/43/1125044443.db2.gz SXZDGGXIXVIFKW-LBPRGKRZSA-N 1 0 269.335 3.616 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]C[C@H]1CCCCC1(F)F ZINC000877556497 1125045493 /nfs/dbraw/zinc/04/54/93/1125045493.db2.gz SXZDGGXIXVIFKW-GFCCVEGCSA-N 1 0 269.335 3.616 20 10 CHCDRO CCO[P@](C)(=O)CC[C@@H](C)[NH2+]Cc1cc(C)ccc1O ZINC000877652773 1125057722 /nfs/dbraw/zinc/05/77/22/1125057722.db2.gz NSZHHIUXAPXQMZ-XCLFUZPHSA-N 1 0 299.351 3.513 20 10 CHCDRO CO[C@H](c1ccccc1)[C@@H](C)[NH2+]Cc1cc(C)ccc1O ZINC000877652327 1125057937 /nfs/dbraw/zinc/05/79/37/1125057937.db2.gz GLCMQPHYJMOYFA-KDOFPFPSSA-N 1 0 285.387 3.566 20 10 CHCDRO Cc1cccc(C[NH2+]CC2([C@H]3CCCCO3)CCC2)c1O ZINC000877698154 1125063914 /nfs/dbraw/zinc/06/39/14/1125063914.db2.gz RIIPMJZKJWSASI-MRXNPFEDSA-N 1 0 289.419 3.530 20 10 CHCDRO Cc1ccc(C[NH2+]CC2([C@@H]3CCCCO3)CCC2)c(O)c1 ZINC000877697844 1125064382 /nfs/dbraw/zinc/06/43/82/1125064382.db2.gz NVXIDNLFZCUHAV-KRWDZBQOSA-N 1 0 289.419 3.530 20 10 CHCDRO Oc1cccc2c1C[N@H+](Cc1ccc(C(F)F)cc1)C2 ZINC000877702939 1125066158 /nfs/dbraw/zinc/06/61/58/1125066158.db2.gz KTIPRJGJFWGSKN-UHFFFAOYSA-N 1 0 275.298 3.846 20 10 CHCDRO CCn1c(C[NH2+][C@@H](C)c2ccccc2O)nc2ccccc21 ZINC000877757347 1125074421 /nfs/dbraw/zinc/07/44/21/1125074421.db2.gz RTQLTVSCJVQTRN-ZDUSSCGKSA-N 1 0 295.386 3.613 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H](C)c2ccccc2O)cc1C ZINC000877757032 1125075386 /nfs/dbraw/zinc/07/53/86/1125075386.db2.gz ASIDICSPMBZAPU-ZDUSSCGKSA-N 1 0 271.360 3.565 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000127366871 1125087113 /nfs/dbraw/zinc/08/71/13/1125087113.db2.gz DWOKBXJRZUDSGC-CQSZACIVSA-N 1 0 276.767 3.711 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCC2(CCC2)O1)c1ccc(N(C)C)cc1 ZINC000878454714 1125154386 /nfs/dbraw/zinc/15/43/86/1125154386.db2.gz GXNYHDJGWSKWLX-PBHICJAKSA-N 1 0 288.435 3.505 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@H]2CC[C@H](c3ccccc3)C2)c1 ZINC000127330284 1125178678 /nfs/dbraw/zinc/17/86/78/1125178678.db2.gz XPRABYWNKBOFEB-RDJZCZTQSA-N 1 0 297.398 3.827 20 10 CHCDRO CSc1cccc(C[NH2+][C@@H](C)c2ccccc2O)c1 ZINC000879650134 1125223342 /nfs/dbraw/zinc/22/33/42/1125223342.db2.gz KKIHHPMJGHPQDS-LBPRGKRZSA-N 1 0 273.401 3.965 20 10 CHCDRO Cc1ccc(O)c(C[N@H+]2C[C@H](c3ccccc3)OC[C@@H]2C)c1 ZINC000130667425 1125366149 /nfs/dbraw/zinc/36/61/49/1125366149.db2.gz CZCYRQQWZGTWTL-HNAYVOBHSA-N 1 0 297.398 3.663 20 10 CHCDRO CSc1ccc(C[NH2+]Cc2ccc(N(C)C)cc2C)o1 ZINC000883003263 1125367246 /nfs/dbraw/zinc/36/72/46/1125367246.db2.gz HBFFGEMMDSYODO-UHFFFAOYSA-N 1 0 290.432 3.666 20 10 CHCDRO C[C@H]([NH2+]CC(C)(C)CC(F)F)c1ccccc1O ZINC000883259376 1125387109 /nfs/dbraw/zinc/38/71/09/1125387109.db2.gz KSNQZBVQMWXQJX-JTQLQIEISA-N 1 0 257.324 3.724 20 10 CHCDRO C[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccc(N(C)C)cc1 ZINC000237327534 1125391751 /nfs/dbraw/zinc/39/17/51/1125391751.db2.gz FIMJZIACHCYJIS-CYBMUJFWSA-N 1 0 299.374 3.512 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(C)nc2Cl)c(O)c1 ZINC000883302515 1125392669 /nfs/dbraw/zinc/39/26/69/1125392669.db2.gz ZYKTTZQDOHFOBM-GFCCVEGCSA-N 1 0 290.794 3.908 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2cc(O)ccc2Cl)c(O)c1 ZINC000883325656 1125396908 /nfs/dbraw/zinc/39/69/08/1125396908.db2.gz HRBSXCQRSMKKDC-LLVKDONJSA-N 1 0 291.778 3.910 20 10 CHCDRO C[C@H]([NH2+]C[C@@]1(C)OCCc2ccccc21)c1ccccc1O ZINC000883339970 1125397949 /nfs/dbraw/zinc/39/79/49/1125397949.db2.gz GNGKWDHMLZGUMQ-IFXJQAMLSA-N 1 0 297.398 3.531 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1CCC2(CCC2)O1)c1ccc(C)cc1O ZINC000883357021 1125401056 /nfs/dbraw/zinc/40/10/56/1125401056.db2.gz BBTOBHYITRFXDW-GDBMZVCRSA-N 1 0 289.419 3.843 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC3(CCC3)O2)c(O)c1C ZINC000883357100 1125401063 /nfs/dbraw/zinc/40/10/63/1125401063.db2.gz CSPCYCLMSYGZGJ-CABCVRRESA-N 1 0 289.419 3.761 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCC3(CCC3)O2)c(O)c1C ZINC000883357101 1125401500 /nfs/dbraw/zinc/40/15/00/1125401500.db2.gz CSPCYCLMSYGZGJ-GJZGRUSLSA-N 1 0 289.419 3.761 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@]23CCCO3)c(O)c1C ZINC000883365503 1125402278 /nfs/dbraw/zinc/40/22/78/1125402278.db2.gz BTKLIZQIJRNHRH-LESCRADOSA-N 1 0 289.419 3.761 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@@H]1c3ccccc3CC[C@@H]1F)CC2 ZINC000883378015 1125404734 /nfs/dbraw/zinc/40/47/34/1125404734.db2.gz XVHFLYFTZQYFHA-FRQCXROJSA-N 1 0 297.373 3.995 20 10 CHCDRO CC[C@H](CSC)[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C ZINC000168863683 1125416231 /nfs/dbraw/zinc/41/62/31/1125416231.db2.gz PKYKKUPNVHNHAU-YNEHKIRRSA-N 1 0 279.449 3.980 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CCCSC)cc1 ZINC000132465763 1125418470 /nfs/dbraw/zinc/41/84/70/1125418470.db2.gz IVGHHLVYMJNZNO-ZDUSSCGKSA-N 1 0 266.454 3.546 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@@H+]2CCc3ccsc3C2)c1 ZINC000132545044 1125419192 /nfs/dbraw/zinc/41/91/92/1125419192.db2.gz FBDNDLBJTVWJAN-UHFFFAOYSA-N 1 0 273.401 3.629 20 10 CHCDRO CCOc1cccc(C[N@H+](C)[C@@H]2CCC[C@H](C)C2)c1O ZINC000132751604 1125421009 /nfs/dbraw/zinc/42/10/09/1125421009.db2.gz ZMLPMQOHLDRREK-DZGCQCFKSA-N 1 0 277.408 3.801 20 10 CHCDRO C[C@H]([NH2+]C1CC1)c1ccc(N2CCCCCC2)cc1 ZINC000132751994 1125421063 /nfs/dbraw/zinc/42/10/63/1125421063.db2.gz USINCRIQBIDMRC-AWEZNQCLSA-N 1 0 258.409 3.880 20 10 CHCDRO Cc1ccccc1C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000037719048 1129210170 /nfs/dbraw/zinc/21/01/70/1129210170.db2.gz SBOJCIVBZBKGBZ-HNNXBMFYSA-N 1 0 268.404 3.912 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]Cc1cccc(Cl)c1)CC2 ZINC000296183026 1129220477 /nfs/dbraw/zinc/22/04/77/1129220477.db2.gz YFGLCEBBJZHQFU-CQSZACIVSA-N 1 0 273.763 3.823 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2[C@H](C)C[C@H]3CCCC[C@H]32)c1 ZINC000245865026 1129230348 /nfs/dbraw/zinc/23/03/48/1129230348.db2.gz PSEQHFQVZRPVKW-XJKCOSOUSA-N 1 0 275.392 3.554 20 10 CHCDRO CSC(C)(C)C[C@@H](C)[N@H+](C)Cc1ccccc1O ZINC001258347584 1129232586 /nfs/dbraw/zinc/23/25/86/1129232586.db2.gz XGYSWVBEPDCKJX-GFCCVEGCSA-N 1 0 267.438 3.744 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CC(C)(C)N2CCCCC2)c1 ZINC000184847597 1129256622 /nfs/dbraw/zinc/25/66/22/1129256622.db2.gz UATQRRKJEKTUKK-HNNXBMFYSA-N 1 0 290.451 3.616 20 10 CHCDRO CC(C)OCCC[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000184863500 1129257250 /nfs/dbraw/zinc/25/72/50/1129257250.db2.gz WLYDBWKYIWXZIT-CQSZACIVSA-N 1 0 291.435 3.737 20 10 CHCDRO c1cc(C[NH2+]CCC2CCCCC2)cc2c1OCC2 ZINC000037740182 1129258336 /nfs/dbraw/zinc/25/83/36/1129258336.db2.gz JFMBJBVPSKKWLF-UHFFFAOYSA-N 1 0 259.393 3.682 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@H](C)SC)cc1 ZINC000246264489 1129264729 /nfs/dbraw/zinc/26/47/29/1129264729.db2.gz ABNJQFDMLGNFRG-QWHCGFSZSA-N 1 0 266.454 3.545 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@H](C)SC)cc1 ZINC000246264507 1129265175 /nfs/dbraw/zinc/26/51/75/1129265175.db2.gz ABNJQFDMLGNFRG-STQMWFEESA-N 1 0 266.454 3.545 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ncc(Cl)s2)c(O)c1 ZINC000719393610 1129332085 /nfs/dbraw/zinc/33/20/85/1129332085.db2.gz FDQJMORQTHICCN-SECBINFHSA-N 1 0 282.796 3.661 20 10 CHCDRO CC[C@H]([NH2+][C@@H](CC)[C@@H]1CCCO1)c1ccc(N(C)C)cc1 ZINC000090858405 1129332910 /nfs/dbraw/zinc/33/29/10/1129332910.db2.gz CCZJSDJPHXIYKG-BZSNNMDCSA-N 1 0 290.451 3.751 20 10 CHCDRO C[C@@H]([NH2+]CC[C@H]1CCCO1)c1ccc2ccccc2c1O ZINC000038095431 1129336298 /nfs/dbraw/zinc/33/62/98/1129336298.db2.gz RJHXNUFPDCEZJB-UKRRQHHQSA-N 1 0 285.387 3.765 20 10 CHCDRO COc1ccc(C[NH2+]CCOC2CCCCCC2)cc1C ZINC000735676977 1129355527 /nfs/dbraw/zinc/35/55/27/1129355527.db2.gz MIVVXQISNFZVPG-UHFFFAOYSA-N 1 0 291.435 3.833 20 10 CHCDRO CC(C)[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccccn1 ZINC000736647623 1129378958 /nfs/dbraw/zinc/37/89/58/1129378958.db2.gz KGFMYLLAGVUGIY-GOSISDBHSA-N 1 0 282.387 3.503 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)Cc2cccc(C)n2)cc1 ZINC000736946181 1129382043 /nfs/dbraw/zinc/38/20/43/1129382043.db2.gz WTRNIQWGGNMBCK-UHFFFAOYSA-N 1 0 297.446 3.868 20 10 CHCDRO CCC[N@H+](Cc1ccc(COC)cc1)Cc1ccccc1O ZINC000092704986 1129404979 /nfs/dbraw/zinc/40/49/79/1129404979.db2.gz RDAXZPWCLWPXGL-UHFFFAOYSA-N 1 0 299.414 3.951 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C[C@@H](C)C2CC2)cc1F ZINC000740004251 1129409082 /nfs/dbraw/zinc/40/90/82/1129409082.db2.gz LXIDLQKKEWOJNK-CYBMUJFWSA-N 1 0 278.415 3.808 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCCO[C@H]1C(C)(C)C)c1ccccc1O ZINC000248384710 1129415917 /nfs/dbraw/zinc/41/59/17/1129415917.db2.gz FUYHNKXYKIWXAJ-JJRVBVJISA-N 1 0 291.435 3.884 20 10 CHCDRO CC(C)C[C@@H]1OCCC[C@H]1[NH2+][C@H](C)c1ccccc1O ZINC000248546883 1129421334 /nfs/dbraw/zinc/42/13/34/1129421334.db2.gz FWPZYJXBHUORFR-UNEWFSDZSA-N 1 0 277.408 3.637 20 10 CHCDRO CO[C@@H](C)C[N@H+](C)Cc1cc2oc3ccccc3c2cc1O ZINC000795752560 1129446823 /nfs/dbraw/zinc/44/68/23/1129446823.db2.gz UGABURQZTGOABX-LBPRGKRZSA-N 1 0 299.370 3.758 20 10 CHCDRO C[C@@H]([NH2+]CCc1cc(F)cc(F)c1)c1cc(F)ccc1O ZINC000094618102 1129448270 /nfs/dbraw/zinc/44/82/70/1129448270.db2.gz JVCXYIWRSZFQGA-SNVBAGLBSA-N 1 0 295.304 3.703 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)c2cc(F)ccc2O)cc1 ZINC000094616761 1129448390 /nfs/dbraw/zinc/44/83/90/1129448390.db2.gz KVABRNCJWNJYGX-LBPRGKRZSA-N 1 0 259.324 3.691 20 10 CHCDRO C[C@@H](C[NH2+][C@H](C)c1cc(F)ccc1O)c1ccccc1 ZINC000094616907 1129448440 /nfs/dbraw/zinc/44/84/40/1129448440.db2.gz WKEMXMMNQUXFMF-QWHCGFSZSA-N 1 0 273.351 3.986 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]Cc2c(C)cccc2F)c1 ZINC000742380386 1129473166 /nfs/dbraw/zinc/47/31/66/1129473166.db2.gz MWWRHNCLEJPIGY-UHFFFAOYSA-N 1 0 289.350 3.528 20 10 CHCDRO CCC(CC)(C[NH2+]Cc1ccc(N(C)C)c(F)c1)SC ZINC000742388042 1129474008 /nfs/dbraw/zinc/47/40/08/1129474008.db2.gz OVXBGLCGUFTTHG-UHFFFAOYSA-N 1 0 298.471 3.903 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCC[C@@H](C)C1 ZINC000742370953 1129474565 /nfs/dbraw/zinc/47/45/65/1129474565.db2.gz BFYPJDQGBSXDHC-CZUORRHYSA-N 1 0 260.425 3.729 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCC[C@H](C)C1 ZINC000742370943 1129474832 /nfs/dbraw/zinc/47/48/32/1129474832.db2.gz BFYPJDQGBSXDHC-BBRMVZONSA-N 1 0 260.425 3.729 20 10 CHCDRO CCOc1ccc(C[NH2+][C@@H]2CC[C@H]3CCC[C@@H]3C2)c(O)c1 ZINC000742378729 1129476220 /nfs/dbraw/zinc/47/62/20/1129476220.db2.gz LIXKBBCSGYQMNB-IIAWOOMASA-N 1 0 289.419 3.849 20 10 CHCDRO CCCCC[C@H](CCC)[NH2+]Cc1ccc(O)c(O)c1 ZINC001258664710 1129476409 /nfs/dbraw/zinc/47/64/09/1129476409.db2.gz PVYKVCRUHIKTHO-AWEZNQCLSA-N 1 0 265.397 3.936 20 10 CHCDRO COC(C)(C)C[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000742381136 1129476942 /nfs/dbraw/zinc/47/69/42/1129476942.db2.gz YFLHFVWAAYQJBJ-UHFFFAOYSA-N 1 0 285.387 3.574 20 10 CHCDRO CC(C)O[C@@H]1C[C@@H]([NH2+][C@H](C)c2cc(F)ccc2O)C1(C)C ZINC000766330172 1129604357 /nfs/dbraw/zinc/60/43/57/1129604357.db2.gz BQHTZCYBIHBTJN-HFBAOOFYSA-N 1 0 295.398 3.774 20 10 CHCDRO CC(C)O[C@@H]1C[C@H]([NH2+][C@@H](C)c2ccccc2O)C1(C)C ZINC000766331757 1129604382 /nfs/dbraw/zinc/60/43/82/1129604382.db2.gz UKWXERANPLTFBU-VBNZEHGJSA-N 1 0 277.408 3.635 20 10 CHCDRO CC[C@H](C[C@@H](C)CO)[NH2+][C@H](C)c1ccc(N(C)CC)cc1 ZINC000766361410 1129659799 /nfs/dbraw/zinc/65/97/99/1129659799.db2.gz VQBBGWIOFZKTFP-BFYDXBDKSA-N 1 0 292.467 3.590 20 10 CHCDRO CO[C@]1(C)C[C@H]([NH2+][C@@H](C)c2ccc(N(C)C)cc2)C1(C)C ZINC000766382689 1129660665 /nfs/dbraw/zinc/66/06/65/1129660665.db2.gz XYVAYVDTDVEOAX-QANKJYHBSA-N 1 0 290.451 3.607 20 10 CHCDRO CC[C@H]([NH2+]CCC(F)(F)F)c1ccc(N(C)C)cc1 ZINC000766526519 1129681562 /nfs/dbraw/zinc/68/15/62/1129681562.db2.gz DJLOEONBUGGXBS-ZDUSSCGKSA-N 1 0 274.330 3.746 20 10 CHCDRO C[C@H]([NH2+]CC1(C)CC(F)(F)C1)c1cc(F)ccc1O ZINC000720911172 1129720584 /nfs/dbraw/zinc/72/05/84/1129720584.db2.gz HJMMOHRTANERMT-VIFPVBQESA-N 1 0 273.298 3.617 20 10 CHCDRO C[C@@H]1SCC[C@@H]1[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000380317772 1129728992 /nfs/dbraw/zinc/72/89/92/1129728992.db2.gz MUZAAWIRWFSXJD-YOEHRIQHSA-N 1 0 290.476 3.661 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cc(C)ccc2F)c1 ZINC000828681689 1131396194 /nfs/dbraw/zinc/39/61/94/1131396194.db2.gz FRZLUEFFWKZSGU-LBPRGKRZSA-N 1 0 289.350 3.699 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H]2CC3CCC2CC3)c1 ZINC000380548647 1129831258 /nfs/dbraw/zinc/83/12/58/1129831258.db2.gz XFWYCTMLDOARAU-OCLKLICZSA-N 1 0 275.392 3.630 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCC(F)(F)C2)cc1 ZINC000380542072 1129831511 /nfs/dbraw/zinc/83/15/11/1129831511.db2.gz WBLURJIHNXUIOQ-AWEZNQCLSA-N 1 0 282.378 3.810 20 10 CHCDRO CC[C@@H](C)[C@@H](C[NH2+]Cc1ccc(N(CC)CC)cc1)OC ZINC000381128638 1129834033 /nfs/dbraw/zinc/83/40/33/1129834033.db2.gz GQUIOSMAFKVZGE-CRAIPNDOSA-N 1 0 292.467 3.684 20 10 CHCDRO CCOc1ccc(C[N@H+](C)C2CCCCC2)c(O)c1 ZINC000768139631 1129836974 /nfs/dbraw/zinc/83/69/74/1129836974.db2.gz VGOIZLIBKQWLKL-UHFFFAOYSA-N 1 0 263.381 3.555 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCC(F)(F)C2)c(O)c1 ZINC000381322875 1129837226 /nfs/dbraw/zinc/83/72/26/1129837226.db2.gz GLHXQOAXZUCJOW-QWRGUYRKSA-N 1 0 255.308 3.539 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+]2Cc3ccccc3[C@@H](C)C2)c1 ZINC000768195585 1129843002 /nfs/dbraw/zinc/84/30/02/1129843002.db2.gz NVPACNUIENRQEI-AWEZNQCLSA-N 1 0 297.398 3.910 20 10 CHCDRO COc1cccc(O)c1C[N@@H+]1CCC[C@H]1Cc1ccccc1 ZINC000768226760 1129843677 /nfs/dbraw/zinc/84/36/77/1129843677.db2.gz CEVHSVFSBRIYCY-INIZCTEOSA-N 1 0 297.398 3.608 20 10 CHCDRO CCOc1ccc(C[N@H+](Cc2ccccc2)C2CC2)c(O)c1 ZINC000768231811 1129845298 /nfs/dbraw/zinc/84/52/98/1129845298.db2.gz YXIFISRCARTMMV-UHFFFAOYSA-N 1 0 297.398 3.956 20 10 CHCDRO CCc1cccc(C[NH2+][C@@H](C)Cc2ccsc2)c1O ZINC000691446274 1129849442 /nfs/dbraw/zinc/84/94/42/1129849442.db2.gz NLRYWWRXBVHQMF-LBPRGKRZSA-N 1 0 275.417 3.737 20 10 CHCDRO Cc1ccc(O)c(C[N@H+](C2CC2)C2CCCCC2)c1 ZINC000768336965 1129851393 /nfs/dbraw/zinc/85/13/93/1129851393.db2.gz DRTPNNYHTUXCJX-UHFFFAOYSA-N 1 0 259.393 3.998 20 10 CHCDRO COc1cc(C[N@@H+]2CC[C@@H]2c2ccccc2)c(O)cc1C ZINC000768439397 1129856761 /nfs/dbraw/zinc/85/67/61/1129856761.db2.gz LFAQBMQBQMXPTB-MRXNPFEDSA-N 1 0 283.371 3.656 20 10 CHCDRO Oc1ccccc1C[NH2+][C@@H]1CCC[C@H](c2cccnc2)C1 ZINC000800231362 1129856879 /nfs/dbraw/zinc/85/68/79/1129856879.db2.gz DFXPCRHYBXITCK-WMLDXEAASA-N 1 0 282.387 3.603 20 10 CHCDRO Oc1ccccc1C[NH2+][C@H]1CCC[C@H](c2cccnc2)C1 ZINC000800231363 1129857293 /nfs/dbraw/zinc/85/72/93/1129857293.db2.gz DFXPCRHYBXITCK-YOEHRIQHSA-N 1 0 282.387 3.603 20 10 CHCDRO COc1cc(C[N@H+](C)[C@@H]2CCC[C@@H](C)C2)c(O)cc1C ZINC000768442719 1129857829 /nfs/dbraw/zinc/85/78/29/1129857829.db2.gz ZJYVLOKHWMICPL-IUODEOHRSA-N 1 0 277.408 3.720 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC000800274138 1129861008 /nfs/dbraw/zinc/86/10/08/1129861008.db2.gz KCEHQMHGZLJCDY-SNVBAGLBSA-N 1 0 289.753 3.961 20 10 CHCDRO CC(C)C[N@H+](Cc1ccc(N(C)C)c(F)c1)C1CC1 ZINC000768532920 1129861121 /nfs/dbraw/zinc/86/11/21/1129861121.db2.gz QYWKHCBSXPPXBN-UHFFFAOYSA-N 1 0 264.388 3.512 20 10 CHCDRO Cc1cc([C@@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)oc1C ZINC000800475221 1129875665 /nfs/dbraw/zinc/87/56/65/1129875665.db2.gz VLMKZKVFMYSZLY-GFCCVEGCSA-N 1 0 290.382 3.952 20 10 CHCDRO c1csc(SCCC[NH2+][C@@H]2CCC23CCC3)n1 ZINC000800479722 1129877149 /nfs/dbraw/zinc/87/71/49/1129877149.db2.gz IOVUKVDBZMYSGG-LLVKDONJSA-N 1 0 268.451 3.548 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CC2(COC)CCC2)cc1 ZINC000800494204 1129880455 /nfs/dbraw/zinc/88/04/55/1129880455.db2.gz UTXXLWUMEBYKSU-OAHLLOKOSA-N 1 0 290.451 3.610 20 10 CHCDRO C[C@@H]([NH2+][C@H]1Cc2ccc(Cl)cc2C1)c1ccccc1O ZINC000800496238 1129880627 /nfs/dbraw/zinc/88/06/27/1129880627.db2.gz UMPACILOIJIFRV-ABAIWWIYSA-N 1 0 287.790 3.864 20 10 CHCDRO COc1ccc(CCC[N@H+](C)Cc2cc(C)ccc2O)cc1 ZINC000768920350 1129881491 /nfs/dbraw/zinc/88/14/91/1129881491.db2.gz LWFPGPUWLSNGDK-UHFFFAOYSA-N 1 0 299.414 3.774 20 10 CHCDRO CCOCc1cc(C[NH2+][C@H](C)CCC2CC2)ccc1OC ZINC000768952183 1129885224 /nfs/dbraw/zinc/88/52/24/1129885224.db2.gz LXJAMNYFWSSHAR-CQSZACIVSA-N 1 0 291.435 3.900 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](CC)C[C@@H]2CCCO2)cc1 ZINC000769027990 1129886635 /nfs/dbraw/zinc/88/66/35/1129886635.db2.gz BXALROVGZJIBDB-SFHVURJKSA-N 1 0 290.451 3.534 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H](C)c2ccsc2)cc1C ZINC000800889583 1129895932 /nfs/dbraw/zinc/89/59/32/1129895932.db2.gz QVCCWBCDTAPZKW-GFCCVEGCSA-N 1 0 261.390 3.921 20 10 CHCDRO COc1cccc(C[N@H+](C)CCC2CCCCC2)c1O ZINC000769245461 1129898851 /nfs/dbraw/zinc/89/88/51/1129898851.db2.gz SKFMIHDXPMBLTE-UHFFFAOYSA-N 1 0 277.408 3.803 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CCC[C@H]2C(C)(C)C)c1 ZINC000769313471 1129901606 /nfs/dbraw/zinc/90/16/06/1129901606.db2.gz NXNFBIPLJGRMCC-INIZCTEOSA-N 1 0 277.408 3.801 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](O)c2cc(C)cc(C)c2)c(O)c1 ZINC000800992823 1129902752 /nfs/dbraw/zinc/90/27/52/1129902752.db2.gz TUKXXJYMZOGNIH-HNAYVOBHSA-N 1 0 299.414 3.702 20 10 CHCDRO COc1cccc(O)c1C[N@@H+]1CCc2ccccc2[C@H]1C ZINC000769354020 1129904384 /nfs/dbraw/zinc/90/43/84/1129904384.db2.gz ZCVGPVKLNJTDGO-CYBMUJFWSA-N 1 0 283.371 3.520 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC[C@H](c3ccc(F)cc3)C2)c1 ZINC000769399096 1129906052 /nfs/dbraw/zinc/90/60/52/1129906052.db2.gz VSRDCUVQPDRLSR-HNNXBMFYSA-N 1 0 285.362 3.829 20 10 CHCDRO CCOc1ccc(C[N@@H+]2[C@H](C)C[C@H]3CCCC[C@H]32)c(O)c1 ZINC000769403296 1129907097 /nfs/dbraw/zinc/90/70/97/1129907097.db2.gz BUHGTQJVKLJULG-CKEIUWERSA-N 1 0 289.419 3.944 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2[C@H](C)C[C@H]3CCCC[C@H]32)c1 ZINC000769404219 1129907153 /nfs/dbraw/zinc/90/71/53/1129907153.db2.gz KTDDPUSNTSQNNS-IIAWOOMASA-N 1 0 259.393 3.854 20 10 CHCDRO C[C@H]1OCC[N@H+](Cc2cc(-c3ccccc3)ccc2O)[C@H]1C ZINC000769422004 1129907305 /nfs/dbraw/zinc/90/73/05/1129907305.db2.gz DZBTYNLANJJTIA-LSDHHAIUSA-N 1 0 297.398 3.668 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2Cc3ccccc3C[C@@H]2C)c1 ZINC000769483817 1129909462 /nfs/dbraw/zinc/90/94/62/1129909462.db2.gz SHMYDLXDEMEXEH-AWEZNQCLSA-N 1 0 297.398 3.738 20 10 CHCDRO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)C[C@@H]1C[C@@H]1C ZINC000769487680 1129909781 /nfs/dbraw/zinc/90/97/81/1129909781.db2.gz KVBPPNUHAISCFE-HOCLYGCPSA-N 1 0 260.425 3.619 20 10 CHCDRO C[C@@H]1COCC[N@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000769458225 1129911857 /nfs/dbraw/zinc/91/18/57/1129911857.db2.gz YXXNXEXMVILISQ-HNNXBMFYSA-N 1 0 297.398 3.528 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCS[C@@H]3CCCC[C@H]32)cc1 ZINC000769497901 1129914237 /nfs/dbraw/zinc/91/42/37/1129914237.db2.gz HKFRSBXKSDUNBY-IAGOWNOFSA-N 1 0 290.476 3.613 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CC[C@H]2Cc2ccccc2)cc1 ZINC000769506804 1129914672 /nfs/dbraw/zinc/91/46/72/1129914672.db2.gz WTSWNFBXRPGWJN-IBGZPJMESA-N 1 0 280.415 3.570 20 10 CHCDRO CCC[C@H](C)[C@H]1CCC[N@@H+]1Cc1cccc(OC)c1O ZINC000769537596 1129916512 /nfs/dbraw/zinc/91/65/12/1129916512.db2.gz MSRKAEYMFXUEEJ-DZGCQCFKSA-N 1 0 277.408 3.801 20 10 CHCDRO C[C@@H]1C[C@@H](CC[NH2+]Cc2cc(Cl)ccc2O)C[C@H](C)O1 ZINC000801732428 1129941398 /nfs/dbraw/zinc/94/13/98/1129941398.db2.gz KLXQAPISWBBURV-CLLJXQQHSA-N 1 0 297.826 3.729 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2ccc(N3CCCCC3)cc2)[C@@H]1C ZINC000770283060 1129942965 /nfs/dbraw/zinc/94/29/65/1129942965.db2.gz IEXVWJUGEKJLFR-HZPDHXFCSA-N 1 0 272.436 3.907 20 10 CHCDRO CC(C)[N@H+](Cc1ccc(F)cc1)Cc1ccccc1O ZINC000770509821 1129948659 /nfs/dbraw/zinc/94/86/59/1129948659.db2.gz ULQBFMZYIONTJU-UHFFFAOYSA-N 1 0 273.351 3.942 20 10 CHCDRO COc1cccc(C[NH2+][C@H]2CC[C@@H](c3ccccc3)C2)c1O ZINC000770740562 1129958150 /nfs/dbraw/zinc/95/81/50/1129958150.db2.gz JAKDNRVROOBBOU-WBVHZDCISA-N 1 0 297.398 3.827 20 10 CHCDRO CCC[N@@H+](Cc1ccccc1O)C[C@H](OC)c1ccccc1 ZINC000801925279 1129960008 /nfs/dbraw/zinc/96/00/08/1129960008.db2.gz KSMJBOGVZHMORX-IBGZPJMESA-N 1 0 299.414 3.992 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCO[C@@H](C)C1)c1ccc(N(C)C)cc1 ZINC000771388835 1129979429 /nfs/dbraw/zinc/97/94/29/1129979429.db2.gz PPNQZJDQLHAEAK-DAYGRLMNSA-N 1 0 290.451 3.608 20 10 CHCDRO C[C@H]([NH2+]Cc1ccccc1O)[C@@H]1C[C@H]1c1ccccc1 ZINC000802302783 1129990673 /nfs/dbraw/zinc/99/06/73/1129990673.db2.gz SCPXJYJYZXHVIJ-JQFCIGGWSA-N 1 0 267.372 3.674 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@@H](C)[C@@H]2C[C@H]2c2ccccc2)c1 ZINC000802303593 1129990704 /nfs/dbraw/zinc/99/07/04/1129990704.db2.gz LCONBVQSRONMQH-KKXDTOCCSA-N 1 0 297.398 3.683 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCC2C[C@H](C)O[C@@H](C)C2)c1 ZINC000802309997 1129991393 /nfs/dbraw/zinc/99/13/93/1129991393.db2.gz WRABUYRJEXOGDC-KKUMJFAQSA-N 1 0 291.435 3.945 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC[C@@H]2C[C@@H](C)O[C@@H](C)C2)c(O)c1 ZINC000802308715 1129991658 /nfs/dbraw/zinc/99/16/58/1129991658.db2.gz HGGRSHYOFQKQMX-FZKCQIBNSA-N 1 0 291.435 3.945 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]CC1CC(c2ccccc2)C1 ZINC000802659510 1130028258 /nfs/dbraw/zinc/02/82/58/1130028258.db2.gz IFKYRDDZDSGPKC-UHFFFAOYSA-N 1 0 285.362 3.815 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2nccc3c2CCCC3)c(O)c1 ZINC000903182601 1130126129 /nfs/dbraw/zinc/12/61/29/1130126129.db2.gz SLBHYKJDNSWGBU-AWEZNQCLSA-N 1 0 296.414 3.825 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCSC(C)(C)C1)c1cc(F)ccc1O ZINC000903285190 1130146446 /nfs/dbraw/zinc/14/64/46/1130146446.db2.gz WPAGKTCEYAUSGS-CMPLNLGQSA-N 1 0 283.412 3.856 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCSC(C)(C)C1)c1cc(F)ccc1O ZINC000903285191 1130146536 /nfs/dbraw/zinc/14/65/36/1130146536.db2.gz WPAGKTCEYAUSGS-JQWIXIFHSA-N 1 0 283.412 3.856 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCSC(C)(C)C1)c1cc(F)ccc1O ZINC000903285192 1130146637 /nfs/dbraw/zinc/14/66/37/1130146637.db2.gz WPAGKTCEYAUSGS-PWSUYJOCSA-N 1 0 283.412 3.856 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2c(C)cc(CO)cc2C)c(O)c1 ZINC000903307783 1130149931 /nfs/dbraw/zinc/14/99/31/1130149931.db2.gz KNPGHUUCISISNP-HNNXBMFYSA-N 1 0 299.414 3.661 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)C(C)(C)OC)c1ccc(C)cc1O ZINC000903331433 1130157946 /nfs/dbraw/zinc/15/79/46/1130157946.db2.gz NKVFDZSRPHRVEP-JSGCOSHPSA-N 1 0 265.397 3.555 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCOC23CCCC3)c(O)c1C ZINC000903383044 1130168855 /nfs/dbraw/zinc/16/88/55/1130168855.db2.gz LKCLRMCBUQGDAM-GOEBONIOSA-N 1 0 289.419 3.761 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@@H](c1ccncc1)C1CC1)CC2 ZINC000903427469 1130175592 /nfs/dbraw/zinc/17/55/92/1130175592.db2.gz GMCJOCAICSEJEC-MAUKXSAKSA-N 1 0 280.371 3.515 20 10 CHCDRO C[C@H]1C[C@H]1C[N@H+](Cc1ccco1)Cc1ccccc1O ZINC000788444038 1130186933 /nfs/dbraw/zinc/18/69/33/1130186933.db2.gz WOYVJIFKGLJCDY-ZFWWWQNUSA-N 1 0 271.360 3.643 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CCc2cccs2)c(O)c1 ZINC000788506575 1130192170 /nfs/dbraw/zinc/19/21/70/1130192170.db2.gz WHCZVBYMFXIDDM-ZDUSSCGKSA-N 1 0 275.417 3.964 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)[C@@]2(C)CCCO2)cc1 ZINC000788546764 1130193505 /nfs/dbraw/zinc/19/35/05/1130193505.db2.gz LQDSHCFMPYKZPF-MAUKXSAKSA-N 1 0 290.451 3.580 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@H]2CCCS2)c(O)c1 ZINC000788629598 1130199007 /nfs/dbraw/zinc/19/90/07/1130199007.db2.gz WMGJVYKXBXHWHL-QWHCGFSZSA-N 1 0 265.422 3.555 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H]2CCCS2)c(O)c1 ZINC000788629600 1130199134 /nfs/dbraw/zinc/19/91/34/1130199134.db2.gz WMGJVYKXBXHWHL-STQMWFEESA-N 1 0 265.422 3.555 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCC12CCCC2 ZINC000788983068 1130220944 /nfs/dbraw/zinc/22/09/44/1130220944.db2.gz AKGKLSMMIHNYPV-QGZVFWFLSA-N 1 0 272.436 3.873 20 10 CHCDRO CCOC[C@@H]([NH2+][C@H](C)c1ccc(N(C)CC)cc1)C(C)C ZINC000788985198 1130221950 /nfs/dbraw/zinc/22/19/50/1130221950.db2.gz OPTPGDXTKHAKFW-CRAIPNDOSA-N 1 0 292.467 3.854 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)C[C@H]2CC[C@@H](C)O2)cc1 ZINC000789307254 1130242418 /nfs/dbraw/zinc/24/24/18/1130242418.db2.gz VGIIASMZLPQVJC-CRAIPNDOSA-N 1 0 290.451 3.532 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CCSC(C)(C)CC2)c(O)c1 ZINC000789762934 1130275434 /nfs/dbraw/zinc/27/54/34/1130275434.db2.gz BQCIRQQVFZGPEG-UHFFFAOYSA-N 1 0 295.448 3.508 20 10 CHCDRO Cc1cccc(C[NH2+]Cc2cc(F)c(Cl)cc2F)c1O ZINC000789771055 1130275812 /nfs/dbraw/zinc/27/58/12/1130275812.db2.gz ULZDIURONLFZFM-UHFFFAOYSA-N 1 0 297.732 3.922 20 10 CHCDRO Oc1ccccc1C[NH+]1CCC(F)(c2ccccc2)CC1 ZINC000789756401 1130276610 /nfs/dbraw/zinc/27/66/10/1130276610.db2.gz DELKKGDGNIADNT-UHFFFAOYSA-N 1 0 285.362 3.853 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+]C[C@@H](C)c2ccccn2)c1O ZINC000826803610 1130283308 /nfs/dbraw/zinc/28/33/08/1130283308.db2.gz PHYIMDFTFCICCA-GFCCVEGCSA-N 1 0 290.794 3.642 20 10 CHCDRO CSCC1(CC[NH2+]Cc2cc(Cl)cc(C)c2O)CC1 ZINC000826938077 1130316577 /nfs/dbraw/zinc/31/65/77/1130316577.db2.gz YRDMMVOXLRLPCO-UHFFFAOYSA-N 1 0 299.867 3.977 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2CCO[C@@H](C(C)(C)C)C2)c1O ZINC000790930502 1130338710 /nfs/dbraw/zinc/33/87/10/1130338710.db2.gz DCBOVXJSHIUCPO-CQSZACIVSA-N 1 0 297.826 3.601 20 10 CHCDRO Cc1cc(C)c(C[N@@H+](C)Cc2ccc(N3CCCC3)cc2)[nH]1 ZINC001137328263 1130380869 /nfs/dbraw/zinc/38/08/69/1130380869.db2.gz YULBXXQTZIUFDC-UHFFFAOYSA-N 1 0 297.446 3.864 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)cc1)[C@H]1CC[C@H](C)C1 ZINC001170159389 1130397219 /nfs/dbraw/zinc/39/72/19/1130397219.db2.gz TXYYZFUVCUXCCI-YOEHRIQHSA-N 1 0 260.425 3.763 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CC(C)(C)OC[C@@H]2C)cc1C(C)C ZINC000792722407 1130494149 /nfs/dbraw/zinc/49/41/49/1130494149.db2.gz MEXBHASARSXBGJ-AWEZNQCLSA-N 1 0 291.435 3.823 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C(C)(C)CCOC)cc1F ZINC000747100196 1130517278 /nfs/dbraw/zinc/51/72/78/1130517278.db2.gz CPLRIRDXQBAFLD-UHFFFAOYSA-N 1 0 296.430 3.577 20 10 CHCDRO CC[N@@H+](Cc1c(O)cccc1Cl)CC1CCC1 ZINC000793352324 1130549355 /nfs/dbraw/zinc/54/93/55/1130549355.db2.gz LHUUYSAVSAIRKT-UHFFFAOYSA-N 1 0 253.773 3.668 20 10 CHCDRO COc1ccc(C[NH2+]Cc2ccc(CC(C)C)cc2)c(O)c1 ZINC000793387590 1130551722 /nfs/dbraw/zinc/55/17/22/1130551722.db2.gz IEMLPKDEUXHATB-UHFFFAOYSA-N 1 0 299.414 3.889 20 10 CHCDRO CC[C@@H](C)C[C@H](CC)[NH2+]Cc1ccc(OC)cc1O ZINC000793386278 1130552182 /nfs/dbraw/zinc/55/21/82/1130552182.db2.gz KESAAWDLAORWHN-OCCSQVGLSA-N 1 0 265.397 3.705 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCc2ccc(O)cc21 ZINC000827347484 1130567832 /nfs/dbraw/zinc/56/78/32/1130567832.db2.gz QJNNVWIGIVMSTC-LJQANCHMSA-N 1 0 296.414 3.544 20 10 CHCDRO CC1(C)[C@H]([NH2+]Cc2ccccc2O)C[C@@H]1Oc1ccccc1 ZINC000793530149 1130572117 /nfs/dbraw/zinc/57/21/17/1130572117.db2.gz ZEXUNRJJHULZPE-MSOLQXFVSA-N 1 0 297.398 3.728 20 10 CHCDRO C[N@H+](CCc1ccc(F)cc1Cl)Cc1ccccc1O ZINC000811456783 1130610134 /nfs/dbraw/zinc/61/01/34/1130610134.db2.gz FSZCFCFCFGYNSQ-UHFFFAOYSA-N 1 0 293.769 3.859 20 10 CHCDRO C[N@H+](CCOc1cccc(Cl)c1)Cc1ccccc1O ZINC000759707968 1130671868 /nfs/dbraw/zinc/67/18/68/1130671868.db2.gz SKWJLQYXKBXBBR-UHFFFAOYSA-N 1 0 291.778 3.556 20 10 CHCDRO Oc1ccccc1C[NH2+][C@@H]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000780520426 1130683044 /nfs/dbraw/zinc/68/30/44/1130683044.db2.gz PEPGULUMPWCKII-RHSMWYFYSA-N 1 0 285.362 3.957 20 10 CHCDRO CC[NH+](CC)CCSc1ncc(-c2ccccc2)n1C ZINC000780813122 1130693075 /nfs/dbraw/zinc/69/30/75/1130693075.db2.gz FTFHDGHJPJHQAG-UHFFFAOYSA-N 1 0 289.448 3.521 20 10 CHCDRO C[C@H]1C[NH+](Cc2cccc(-c3ccccc3)c2O)C[C@H](C)O1 ZINC001234992185 1130700766 /nfs/dbraw/zinc/70/07/66/1130700766.db2.gz NTXMNLPYFHIOHD-GJZGRUSLSA-N 1 0 297.398 3.668 20 10 CHCDRO C[C@@H]1CC[N@@H+]1Cc1cccc(-c2ccccc2)c1O ZINC001235000458 1130701593 /nfs/dbraw/zinc/70/15/93/1130701593.db2.gz IJXUREGAGDMYRP-CYBMUJFWSA-N 1 0 253.345 3.653 20 10 CHCDRO C[C@H](Nc1cc2c(c[nH+]1)CCCC2)c1cc(F)ccc1O ZINC000812739193 1130709826 /nfs/dbraw/zinc/70/98/26/1130709826.db2.gz MTVGYTVLXTUGMH-NSHDSACASA-N 1 0 286.350 3.978 20 10 CHCDRO CCc1ccc(C[NH2+]Cc2cccc(CC)c2O)s1 ZINC000691449611 1130711914 /nfs/dbraw/zinc/71/19/14/1130711914.db2.gz VSGBTDMDBFAXLP-UHFFFAOYSA-N 1 0 275.417 3.868 20 10 CHCDRO CN(C)c1ccc(C[NH2+]CCCCF)c(C(F)(F)F)c1 ZINC000812772371 1130712981 /nfs/dbraw/zinc/71/29/81/1130712981.db2.gz LGRDALHPRPFDCF-UHFFFAOYSA-N 1 0 292.320 3.611 20 10 CHCDRO CCSC1(C[NH2+][C@H](C)c2cc(C)ccc2O)CC1 ZINC000691786976 1130717064 /nfs/dbraw/zinc/71/70/64/1130717064.db2.gz GTEXTDXQWBPBEL-GFCCVEGCSA-N 1 0 265.422 3.637 20 10 CHCDRO CCSC1(C[NH2+][C@@H](CC)c2ccccc2O)CC1 ZINC000691787635 1130717411 /nfs/dbraw/zinc/71/74/11/1130717411.db2.gz NTMOIRZSILNRPJ-ZDUSSCGKSA-N 1 0 265.422 3.719 20 10 CHCDRO CC[N@@H+](Cc1ccc(N2CCCCC2)cc1)C[C@@H](C)OC ZINC000812807919 1130720150 /nfs/dbraw/zinc/72/01/50/1130720150.db2.gz MFAZUFKVRYZKIP-MRXNPFEDSA-N 1 0 290.451 3.534 20 10 CHCDRO COc1cc(C[N@@H+]2CC[C@@]3(CC[C@H](C)C3)C2)c(O)cc1C ZINC000781587664 1130728796 /nfs/dbraw/zinc/72/87/96/1130728796.db2.gz RANHMXZFQDTQKD-SCLBCKFNSA-N 1 0 289.419 3.721 20 10 CHCDRO COC1CC[NH+](Cc2cc(C)cc(C(C)(C)C)c2O)CC1 ZINC000813088596 1130738706 /nfs/dbraw/zinc/73/87/06/1130738706.db2.gz WYLOYQCWVJPOHD-UHFFFAOYSA-N 1 0 291.435 3.609 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CC[C@]3(CC[C@H](C)C3)C2)c(O)c1 ZINC000781926890 1130748647 /nfs/dbraw/zinc/74/86/47/1130748647.db2.gz BIURNNFQIMLGLL-KSSFIOAISA-N 1 0 289.419 3.803 20 10 CHCDRO CCCCCC[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000781971663 1130751324 /nfs/dbraw/zinc/75/13/24/1130751324.db2.gz CEPKEIVUBUQYHV-UHFFFAOYSA-N 1 0 290.451 3.535 20 10 CHCDRO C[N@@H+](Cc1ccccc1O)C[C@@H]1CCc2ccccc2C1 ZINC000782047956 1130753109 /nfs/dbraw/zinc/75/31/09/1130753109.db2.gz JOBXQEWDFLMWGI-OAHLLOKOSA-N 1 0 281.399 3.629 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cccc3[nH]ccc32)c1 ZINC000813330966 1130760509 /nfs/dbraw/zinc/76/05/09/1130760509.db2.gz KJOJBAYNTPMCDH-GFCCVEGCSA-N 1 0 296.370 3.733 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2ccc(C(C)(C)C)cc2O)C[C@H]1F ZINC001235674616 1130766445 /nfs/dbraw/zinc/76/64/45/1130766445.db2.gz HDCHPGKEWNUVLV-IUODEOHRSA-N 1 0 279.399 3.870 20 10 CHCDRO C[N@H+](Cc1ccccn1)Cc1ccc(C(C)(C)C)cc1O ZINC001235676357 1130766796 /nfs/dbraw/zinc/76/67/96/1130766796.db2.gz RAPSDXJXFSSZJS-UHFFFAOYSA-N 1 0 284.403 3.717 20 10 CHCDRO CC(=O)[C@H]1CCCC[N@@H+]1Cc1ccc(C(C)(C)C)cc1O ZINC001235678105 1130767119 /nfs/dbraw/zinc/76/71/19/1130767119.db2.gz JJQWGIZLJXDQRX-MRXNPFEDSA-N 1 0 289.419 3.633 20 10 CHCDRO C[N@@H+](Cc1ccc(C(C)(C)C)cc1O)CC1CCC1 ZINC001235681539 1130768331 /nfs/dbraw/zinc/76/83/31/1130768331.db2.gz AMINTHQPCHZNAF-UHFFFAOYSA-N 1 0 261.409 3.922 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1CCC=CO1)c1cc(Cl)ccc1O ZINC000783310565 1130815766 /nfs/dbraw/zinc/81/57/66/1130815766.db2.gz PMQSEDCLCCQKIA-TZMCWYRMSA-N 1 0 281.783 3.779 20 10 CHCDRO C[C@H](COc1ccccc1)[NH2+][C@H](C)c1ccccc1O ZINC000783505775 1130831116 /nfs/dbraw/zinc/83/11/16/1130831116.db2.gz QCMGONMUGBOLIF-ZIAGYGMSSA-N 1 0 271.360 3.510 20 10 CHCDRO C[C@H]([NH2+][C@H]1CSc2ccccc21)c1ccccc1O ZINC000783513748 1130832276 /nfs/dbraw/zinc/83/22/76/1130832276.db2.gz MNPIGHDDIWBXAY-FZMZJTMJSA-N 1 0 271.385 3.890 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)c1ccccc1O ZINC000783513861 1130833014 /nfs/dbraw/zinc/83/30/14/1130833014.db2.gz NSTXKZYXBLPDTL-CQSZACIVSA-N 1 0 284.403 3.617 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC3(CCC3)[C@@H]2C(C)C)c1 ZINC000814171245 1130833117 /nfs/dbraw/zinc/83/31/17/1130833117.db2.gz MKYCXXIAPKXIRQ-INIZCTEOSA-N 1 0 259.393 3.711 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH+](C1CCC1)C1CCC1 ZINC000814177995 1130835123 /nfs/dbraw/zinc/83/51/23/1130835123.db2.gz YCDDYUDAYGLMQH-UHFFFAOYSA-N 1 0 265.784 3.953 20 10 CHCDRO COCC(C)(C)[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000814178355 1130836093 /nfs/dbraw/zinc/83/60/93/1130836093.db2.gz MZLLGOYHJXOROQ-UHFFFAOYSA-N 1 0 290.451 3.534 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2cc(F)ccc2O)[C@H]2CCCC[C@@H]12 ZINC000783592154 1130841733 /nfs/dbraw/zinc/84/17/33/1130841733.db2.gz DGEMNQLAZUNGGF-UGFHNGPFSA-N 1 0 263.356 3.542 20 10 CHCDRO Cc1cccc(C[NH2+][C@H](CC(F)(F)F)C(C)C)c1O ZINC000783740397 1130852782 /nfs/dbraw/zinc/85/27/82/1130852782.db2.gz IRHUWDTXXHXLPK-GFCCVEGCSA-N 1 0 275.314 3.767 20 10 CHCDRO Oc1ccccc1C[NH2+]C[C@H](c1ccccc1)C1CC1 ZINC000814298325 1130861498 /nfs/dbraw/zinc/86/14/98/1130861498.db2.gz REQPWPGPHFGICB-QGZVFWFLSA-N 1 0 267.372 3.676 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2cscn2)c1 ZINC000697819211 1130864018 /nfs/dbraw/zinc/86/40/18/1130864018.db2.gz JQASNEUQQSTBMZ-WDEREUQCSA-N 1 0 262.378 3.569 20 10 CHCDRO CC(C)c1ccc(C[N@@H+]2CCc3cc(N)ccc3C2)c(O)c1 ZINC001236104764 1130865087 /nfs/dbraw/zinc/86/50/87/1130865087.db2.gz ACGPRHKVSFHSAM-UHFFFAOYSA-N 1 0 296.414 3.656 20 10 CHCDRO CC(C)(C)[C@@H]1CC[N@H+](Cc2c(O)ccc3ccncc32)C1 ZINC000784034277 1130870732 /nfs/dbraw/zinc/87/07/32/1130870732.db2.gz VEVSSJGGRYJRRL-CQSZACIVSA-N 1 0 284.403 3.808 20 10 CHCDRO CCCC[C@H]1CN(Cc2ccc3ccccc3c2O)CC[NH2+]1 ZINC001236137576 1130873684 /nfs/dbraw/zinc/87/36/84/1130873684.db2.gz NPTLCPDDHADPTF-KRWDZBQOSA-N 1 0 298.430 3.509 20 10 CHCDRO CCC(F)(F)C(C)(C)C[NH2+]Cc1cccc(C)c1O ZINC000699703673 1130911498 /nfs/dbraw/zinc/91/14/98/1130911498.db2.gz GFHLUBCNCRIAPS-UHFFFAOYSA-N 1 0 271.351 3.862 20 10 CHCDRO CCC(F)(F)C(C)(C)C[NH2+]Cc1cc(C)ccc1O ZINC000699703154 1130911621 /nfs/dbraw/zinc/91/16/21/1130911621.db2.gz DSSFJYXRXIUYHG-UHFFFAOYSA-N 1 0 271.351 3.862 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]C[C@H](SC)C(C)(C)C)c1 ZINC000784626683 1130914310 /nfs/dbraw/zinc/91/43/10/1130914310.db2.gz ZJZSLESSCVGDAT-HNNXBMFYSA-N 1 0 297.464 3.658 20 10 CHCDRO COc1cccc([C@@H]2CCC[N@H+](Cc3ccc(N)cc3)C2)c1 ZINC001236335670 1130915474 /nfs/dbraw/zinc/91/54/74/1130915474.db2.gz QTLXQPXAXGUABC-QGZVFWFLSA-N 1 0 296.414 3.657 20 10 CHCDRO CC(C)[C@H]1CC[C@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000796697107 1130924038 /nfs/dbraw/zinc/92/40/38/1130924038.db2.gz WKYNIRNZAYNADT-QZTJIDSGSA-N 1 0 272.436 3.811 20 10 CHCDRO CSC(C)(C)C[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C ZINC000168813917 1130940951 /nfs/dbraw/zinc/94/09/51/1130940951.db2.gz VSZAXQYQNBZJPM-NWDGAFQWSA-N 1 0 279.449 3.980 20 10 CHCDRO Cc1ccc([C@H](O)[C@@H](C)[NH2+][C@H](C)c2ccc(C)cc2O)cc1 ZINC000797061044 1130957657 /nfs/dbraw/zinc/95/76/57/1130957657.db2.gz MYYQTFOUSSLXFW-SPYBWZPUSA-N 1 0 299.414 3.782 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CC2(C(F)(F)F)CC2)c1 ZINC000797068647 1130958335 /nfs/dbraw/zinc/95/83/35/1130958335.db2.gz AVURSUOAUOVEFJ-JTQLQIEISA-N 1 0 273.298 3.694 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CSC[C@H]1C)c1cc(Cl)ccc1O ZINC000797065951 1130958679 /nfs/dbraw/zinc/95/86/79/1130958679.db2.gz OBAZYIRWGQEFNA-ICCXJUOJSA-N 1 0 285.840 3.838 20 10 CHCDRO CCCN1CCC[C@H]1C[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000797116704 1130962757 /nfs/dbraw/zinc/96/27/57/1130962757.db2.gz WWFYGGFMDZTSJF-HOTGVXAUSA-N 1 0 290.451 3.534 20 10 CHCDRO CCOc1ccc(C[NH2+]C2CC(C(C)(C)C)C2)c(O)c1 ZINC000815147839 1130966841 /nfs/dbraw/zinc/96/68/41/1130966841.db2.gz XKZDBTUSTIUALC-UHFFFAOYSA-N 1 0 277.408 3.705 20 10 CHCDRO CCOCC[NH2+][C@H](CCc1ccccc1)c1ccccc1O ZINC000815560847 1130999484 /nfs/dbraw/zinc/99/94/84/1130999484.db2.gz RRUVYQJGQLNXGH-GOSISDBHSA-N 1 0 299.414 3.692 20 10 CHCDRO CC[C@H](C[NH2+][C@H](C)c1c(C)cc(C)cc1O)N1CCCC1 ZINC000815559031 1130999584 /nfs/dbraw/zinc/99/95/84/1130999584.db2.gz VLUIMONXODHCLU-HZPDHXFCSA-N 1 0 290.451 3.534 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@H]2Cc3ccccc3O2)c(O)c1 ZINC000815556045 1130999774 /nfs/dbraw/zinc/99/97/74/1130999774.db2.gz NBAAKHPOEFICDT-GOEBONIOSA-N 1 0 297.398 3.663 20 10 CHCDRO CCC(CC)(CCO)C[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000815586010 1131003552 /nfs/dbraw/zinc/00/35/52/1131003552.db2.gz XMYFAXIDBDRKFY-HNNXBMFYSA-N 1 0 293.451 3.848 20 10 CHCDRO CCc1ccc(C[N@@H+]2CCC[C@@](C)(F)CC2)c(O)c1 ZINC001236784337 1131006002 /nfs/dbraw/zinc/00/60/02/1131006002.db2.gz UYGCCFPFUWBDIX-MRXNPFEDSA-N 1 0 265.372 3.669 20 10 CHCDRO CCc1ccc(C[N@@H+]2CC[C@@H](Oc3ccccc3)C2)c(O)c1 ZINC001236790741 1131007159 /nfs/dbraw/zinc/00/71/59/1131007159.db2.gz XSAOCLRWPDYRAX-GOSISDBHSA-N 1 0 297.398 3.608 20 10 CHCDRO CCc1ccc(C[N@H+](C)Cc2ccc(F)cc2F)c(O)c1 ZINC001236789644 1131007353 /nfs/dbraw/zinc/00/73/53/1131007353.db2.gz CRLNJJPGTZGYEL-UHFFFAOYSA-N 1 0 291.341 3.865 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC=C(C)C2)cc1C(C)C ZINC000797823170 1131007842 /nfs/dbraw/zinc/00/78/42/1131007842.db2.gz MIUJMKBGPDHTGC-UHFFFAOYSA-N 1 0 259.393 3.976 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CC[C@H](C)C[C@H]2C)c(Cl)c1 ZINC001236800750 1131009336 /nfs/dbraw/zinc/00/93/36/1131009336.db2.gz AZPUYJHMRADJCG-WDEREUQCSA-N 1 0 283.799 3.675 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+][C@@H]2CC23CCCC3)c(O)c1 ZINC000815620707 1131009758 /nfs/dbraw/zinc/00/97/58/1131009758.db2.gz YXWKLCJVDJJGRL-UKRRQHHQSA-N 1 0 259.393 3.992 20 10 CHCDRO CCCN1CCC[C@H]1C[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000815626088 1131010885 /nfs/dbraw/zinc/01/08/85/1131010885.db2.gz VIVCLPHFAQGDRR-CVEARBPZSA-N 1 0 290.451 3.534 20 10 CHCDRO CSc1ccc(CC[NH2+]Cc2cc(C)ccc2O)cc1 ZINC000797879311 1131011530 /nfs/dbraw/zinc/01/15/30/1131011530.db2.gz JJWDIBQWRLJSRD-UHFFFAOYSA-N 1 0 287.428 3.755 20 10 CHCDRO COc1cc(C)c(C[N@@H+]2CC[C@@H](C)C(F)(F)CC2)c(O)c1 ZINC001236808100 1131011955 /nfs/dbraw/zinc/01/19/55/1131011955.db2.gz MILJZUPAHZFALX-GFCCVEGCSA-N 1 0 299.361 3.576 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CCC(F)(F)C2)c(O)c1 ZINC000815607512 1131012594 /nfs/dbraw/zinc/01/25/94/1131012594.db2.gz AGSNJYBONMLDEQ-NWDGAFQWSA-N 1 0 269.335 3.847 20 10 CHCDRO CCC[C@@H]1CCCC[N@@H+]1Cc1c(C)cc(OC)cc1O ZINC001236812249 1131012926 /nfs/dbraw/zinc/01/29/26/1131012926.db2.gz BAOYVTRRASUMCQ-CQSZACIVSA-N 1 0 277.408 3.864 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2cc[nH]c(=O)c2)c(O)c1C ZINC000815642452 1131013791 /nfs/dbraw/zinc/01/37/91/1131013791.db2.gz BQKUGEDVRYKAKV-STQMWFEESA-N 1 0 286.375 3.521 20 10 CHCDRO CC[C@@H]([NH2+]CC[C@H](C)F)c1cc(Cl)ccc1O ZINC000815645531 1131014772 /nfs/dbraw/zinc/01/47/72/1131014772.db2.gz IWZSHSLKZRXUJR-JOYOIKCWSA-N 1 0 259.752 3.834 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](C)c2cc[nH]c(=O)c2)cc1 ZINC000815643309 1131015861 /nfs/dbraw/zinc/01/58/61/1131015861.db2.gz ZGZMEEUYHZCXKN-KBPBESRZSA-N 1 0 299.418 3.655 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1cc(Cl)cc(C)c1O)C(C)(C)O ZINC000815651726 1131018373 /nfs/dbraw/zinc/01/83/73/1131018373.db2.gz BIVDRHYQIRHYRX-ZWNOBZJWSA-N 1 0 285.815 3.554 20 10 CHCDRO CC[C@H]([NH2+][C@@H](CC)C(C)(C)O)c1cc(Cl)ccc1O ZINC000815651881 1131018617 /nfs/dbraw/zinc/01/86/17/1131018617.db2.gz HLCALNUGIDHDPS-JSGCOSHPSA-N 1 0 285.815 3.636 20 10 CHCDRO Oc1cc2ccccc2cc1C[N@@H+]1CC[C@@]2(C1)CCCOC2 ZINC001236832642 1131019245 /nfs/dbraw/zinc/01/92/45/1131019245.db2.gz JPVYHKGZDHRKOA-LJQANCHMSA-N 1 0 297.398 3.548 20 10 CHCDRO CCC[N@H+](Cc1cc2ccccc2cc1O)C1CCOCC1 ZINC001236834813 1131019578 /nfs/dbraw/zinc/01/95/78/1131019578.db2.gz DGWCNCDFPSGIKE-UHFFFAOYSA-N 1 0 299.414 3.936 20 10 CHCDRO CC1CC[NH+](Cc2cc3ccccc3cc2O)CC1 ZINC001236840907 1131020957 /nfs/dbraw/zinc/02/09/57/1131020957.db2.gz SLSOKWMLDGAQFX-UHFFFAOYSA-N 1 0 255.361 3.777 20 10 CHCDRO Cc1cccc(C[NH2+][C@H]2C[C@H](c3ccccc3F)C2)c1O ZINC000798086567 1131025045 /nfs/dbraw/zinc/02/50/45/1131025045.db2.gz UARIAOUIJOMXNL-SHTZXODSSA-N 1 0 285.362 3.876 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CCC[C@@H]3CCCC[C@H]32)c(O)c1 ZINC001237042043 1131037605 /nfs/dbraw/zinc/03/76/05/1131037605.db2.gz DPWWKKQNAOAYEG-WMLDXEAASA-N 1 0 289.419 3.946 20 10 CHCDRO CC(C)c1ccc(C[N@@H+]2CCCC[C@@H](F)C2)c(O)c1 ZINC001237045003 1131040168 /nfs/dbraw/zinc/04/01/68/1131040168.db2.gz GZIPMQKDAIMAPE-OAHLLOKOSA-N 1 0 265.372 3.840 20 10 CHCDRO CC(C)c1ccc(C[N@H+](C)C[C@@H]2CC2(C)C)c(O)c1 ZINC001237050132 1131041762 /nfs/dbraw/zinc/04/17/62/1131041762.db2.gz YTNFIDLPGGLUPX-HNNXBMFYSA-N 1 0 261.409 3.994 20 10 CHCDRO CC(C)c1ccc(C[N@H+](CC2CC2)C2CC2)c(O)c1 ZINC001237056308 1131042148 /nfs/dbraw/zinc/04/21/48/1131042148.db2.gz WZHMNZGKMGGZML-UHFFFAOYSA-N 1 0 259.393 3.890 20 10 CHCDRO CC(C)c1ccc(C[N@@H+]2CC[C@@H]3CCCO[C@H]3C2)c(O)c1 ZINC001237051950 1131042222 /nfs/dbraw/zinc/04/22/22/1131042222.db2.gz PNSBNGDZCXIBFF-KSSFIOAISA-N 1 0 289.419 3.517 20 10 CHCDRO CC(C)O[C@@H]1CC[N@H+](Cc2ccc(C(C)C)cc2O)C1 ZINC001237051558 1131042305 /nfs/dbraw/zinc/04/23/05/1131042305.db2.gz OBRDQWFKTPOAME-MRXNPFEDSA-N 1 0 277.408 3.515 20 10 CHCDRO Cc1ncccc1C[N@@H+](C)Cc1ccc(C(C)C)cc1O ZINC001237055338 1131043342 /nfs/dbraw/zinc/04/33/42/1131043342.db2.gz MJQHKODLCNEYMW-UHFFFAOYSA-N 1 0 284.403 3.851 20 10 CHCDRO CC(C)c1ccc(C[N@H+](C)Cc2cncs2)c(O)c1 ZINC001237055413 1131043649 /nfs/dbraw/zinc/04/36/49/1131043649.db2.gz OGPLGGWFIYBMQE-UHFFFAOYSA-N 1 0 276.405 3.604 20 10 CHCDRO C[N@@H+](Cc1cc(C(F)(F)F)ccc1O)C[C@@H]1CC1(C)C ZINC001237140985 1131058398 /nfs/dbraw/zinc/05/83/98/1131058398.db2.gz QCTZZQSNCOJWNB-LBPRGKRZSA-N 1 0 287.325 3.889 20 10 CHCDRO C[N@@H+](Cc1ccc2ccccc2c1O)C[C@H]1CCCCO1 ZINC000816495746 1131100238 /nfs/dbraw/zinc/10/02/38/1131100238.db2.gz IGUHHGQBYWKEQO-MRXNPFEDSA-N 1 0 285.387 3.546 20 10 CHCDRO CC[C@@H]1CCC[N@@H+]1Cc1ccc2ccccc2c1O ZINC000816495130 1131100906 /nfs/dbraw/zinc/10/09/06/1131100906.db2.gz LNXLPWKBPCKNDA-OAHLLOKOSA-N 1 0 255.361 3.920 20 10 CHCDRO CSC[C@@H]1CCC[N@@H+]1Cc1ccc2ccccc2c1O ZINC000816516993 1131104113 /nfs/dbraw/zinc/10/41/13/1131104113.db2.gz ZPMFEQNNKBKNMB-HNNXBMFYSA-N 1 0 287.428 3.873 20 10 CHCDRO Cc1cccc(O)c1C[NH+]1CCC(Cc2ccncc2)CC1 ZINC001237491116 1131104267 /nfs/dbraw/zinc/10/42/67/1131104267.db2.gz GVCMESGEUQLKEX-UHFFFAOYSA-N 1 0 296.414 3.550 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2c(C)cccc2O)cc1C ZINC001237492010 1131104774 /nfs/dbraw/zinc/10/47/74/1131104774.db2.gz NRKGLONPVLOBBK-UHFFFAOYSA-N 1 0 269.388 3.949 20 10 CHCDRO COc1ccccc1C[C@H](C)[N@H+](C)Cc1c(C)cccc1O ZINC001237492108 1131104907 /nfs/dbraw/zinc/10/49/07/1131104907.db2.gz OJMUWRSLEHTHIP-HNNXBMFYSA-N 1 0 299.414 3.772 20 10 CHCDRO Oc1c(C[NH2+]Cc2ccc(F)cc2)ccc2ccccc21 ZINC000816529229 1131107896 /nfs/dbraw/zinc/10/78/96/1131107896.db2.gz LFFMOXHGSUQIPI-UHFFFAOYSA-N 1 0 281.330 3.974 20 10 CHCDRO C[C@H]1CC[C@@H]([NH2+]Cc2ccc3ccccc3c2O)C1 ZINC000816584972 1131108825 /nfs/dbraw/zinc/10/88/25/1131108825.db2.gz XWRMFUOHZNCXBV-SWLSCSKDSA-N 1 0 255.361 3.824 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@H](C)Cc1ccc(O)cc1 ZINC000816592180 1131109775 /nfs/dbraw/zinc/10/97/75/1131109775.db2.gz BGINNFBBDYQURH-OAHLLOKOSA-N 1 0 298.430 3.699 20 10 CHCDRO CO[C@@]1(C)CCC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816594573 1131109815 /nfs/dbraw/zinc/10/98/15/1131109815.db2.gz IVFJQVYRWFOQBS-SFHVURJKSA-N 1 0 285.387 3.546 20 10 CHCDRO C[N@H+](CCc1ccncc1)Cc1ccc2ccccc2c1O ZINC000816568349 1131113180 /nfs/dbraw/zinc/11/31/80/1131113180.db2.gz DTIUSBMROSHIJV-UHFFFAOYSA-N 1 0 292.382 3.615 20 10 CHCDRO C[N@H+](Cc1ccc(O)cc1)Cc1ccc2ccccc2c1O ZINC000816611014 1131115547 /nfs/dbraw/zinc/11/55/47/1131115547.db2.gz FXUNDYYBILGKNS-UHFFFAOYSA-N 1 0 293.366 3.883 20 10 CHCDRO CC(C)[C@@H]1C[N@H+](Cc2ccc3ccccc3c2O)CCCO1 ZINC000816674582 1131123761 /nfs/dbraw/zinc/12/37/61/1131123761.db2.gz DNJSOHVBHIKFGX-SFHVURJKSA-N 1 0 299.414 3.792 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H]3CCC[C@H]3C2)c1O ZINC001237679729 1131126255 /nfs/dbraw/zinc/12/62/55/1131126255.db2.gz LGHYBRSJIKRUTR-STQMWFEESA-N 1 0 279.811 3.976 20 10 CHCDRO COCC[C@H]1CCCC[N@@H+]1Cc1cc(Cl)cc(C)c1O ZINC001237687914 1131128187 /nfs/dbraw/zinc/12/81/87/1131128187.db2.gz YGFBMKPHAVFYLV-OAHLLOKOSA-N 1 0 297.826 3.745 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2cc(F)cc(Cl)c2[O-])[C@H](C)C1 ZINC001237798438 1131140722 /nfs/dbraw/zinc/14/07/22/1131140722.db2.gz FNHVHSHUHITTEJ-NXEZZACHSA-N 1 0 271.763 3.805 20 10 CHCDRO C[N@H+](Cc1ccoc1)Cc1ccc(N2CCCC2)cc1 ZINC001116442360 1131147008 /nfs/dbraw/zinc/14/70/08/1131147008.db2.gz SSVCGNVQRVOMJP-UHFFFAOYSA-N 1 0 270.376 3.512 20 10 CHCDRO C[C@H]1CCC[N@H+](Cc2cc(F)c(Cl)cc2[O-])CC1 ZINC001237934564 1131152607 /nfs/dbraw/zinc/15/26/07/1131152607.db2.gz KQHHNAXOCVFAIX-JTQLQIEISA-N 1 0 271.763 3.807 20 10 CHCDRO CC[C@@H]1CCCC[N@@H+]1Cc1cc(F)c(Cl)cc1[O-] ZINC001237939395 1131153310 /nfs/dbraw/zinc/15/33/10/1131153310.db2.gz BFYTUDPHSNSKNO-LLVKDONJSA-N 1 0 271.763 3.949 20 10 CHCDRO CC[N@H+](Cc1ccsc1C)Cc1ccccc1O ZINC001237968248 1131157004 /nfs/dbraw/zinc/15/70/04/1131157004.db2.gz MILHUACGXQBALD-UHFFFAOYSA-N 1 0 261.390 3.784 20 10 CHCDRO c1cc(C[NH2+]Cc2ccc3c(c2)CCO3)cc(C2CC2)c1 ZINC000817407101 1131159058 /nfs/dbraw/zinc/15/90/58/1131159058.db2.gz CXRMCAILTMTIGR-UHFFFAOYSA-N 1 0 279.383 3.789 20 10 CHCDRO Cc1cc(C[NH2+]C/C=C/c2ccc(N(C)C)cc2)cc(C)n1 ZINC000817410095 1131160054 /nfs/dbraw/zinc/16/00/54/1131160054.db2.gz JHQJGLDPFMSAPI-AATRIKPKSA-N 1 0 295.430 3.567 20 10 CHCDRO Cc1cc(F)cc(C[N@H+]2Cc3ccccc3C[C@H]2C)c1O ZINC001238069281 1131167167 /nfs/dbraw/zinc/16/71/67/1131167167.db2.gz IFNOSJCYFPHKKT-CYBMUJFWSA-N 1 0 285.362 3.787 20 10 CHCDRO CC[C@@H]1C[C@H]([NH2+][C@H](C)c2c(C)cc(C)cc2O)CCO1 ZINC000817584887 1131173109 /nfs/dbraw/zinc/17/31/09/1131173109.db2.gz ABBHNMFZOKGZNL-RBSFLKMASA-N 1 0 277.408 3.617 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C2CCC([NH+](C)C)CC2)c(O)c1 ZINC000817586831 1131174068 /nfs/dbraw/zinc/17/40/68/1131174068.db2.gz SQZOFCTYKSHCOF-QQFBHYJXSA-N 1 0 290.451 3.532 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CC23CCSCC3)c(O)c1 ZINC000817589587 1131175152 /nfs/dbraw/zinc/17/51/52/1131175152.db2.gz OQAKKOIVPSPAOI-KGLIPLIRSA-N 1 0 291.460 3.885 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CC12CCSCC2)c1ccccc1O ZINC000817590658 1131175357 /nfs/dbraw/zinc/17/53/57/1131175357.db2.gz ZOXZNMYCHBQCKV-CHWSQXEVSA-N 1 0 277.433 3.576 20 10 CHCDRO CC1(C)C[C@H]([NH2+]CCc2ccc(N)cc2)c2ccccc21 ZINC000817955755 1131190117 /nfs/dbraw/zinc/19/01/17/1131190117.db2.gz HAPMFWOHSMMZKQ-SFHVURJKSA-N 1 0 280.415 3.824 20 10 CHCDRO CC(C)C[C@H](CN)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000817957541 1131191504 /nfs/dbraw/zinc/19/15/04/1131191504.db2.gz CRVAWRICIIVTHS-UKRRQHHQSA-N 1 0 286.419 3.569 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](CN)C2CCCCC2)c(O)c1C ZINC000817957618 1131191550 /nfs/dbraw/zinc/19/15/50/1131191550.db2.gz DFNINISITYHVCI-YOEHRIQHSA-N 1 0 290.451 3.567 20 10 CHCDRO CC(C)[C@@H]1CCC[C@H]([NH2+]CCc2ccc(N)cc2)C1 ZINC000817957739 1131191599 /nfs/dbraw/zinc/19/15/99/1131191599.db2.gz OUVSABQXWQGLSA-WBVHZDCISA-N 1 0 260.425 3.616 20 10 CHCDRO CCCC[C@@H](CN)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000817962243 1131192186 /nfs/dbraw/zinc/19/21/86/1131192186.db2.gz JUWINJSGYVBXRE-HIFRSBDPSA-N 1 0 286.419 3.714 20 10 CHCDRO CCCC[C@@H](CN)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000817962245 1131193050 /nfs/dbraw/zinc/19/30/50/1131193050.db2.gz JUWINJSGYVBXRE-ZFWWWQNUSA-N 1 0 286.419 3.714 20 10 CHCDRO Oc1c(C[NH2+]C/C=C/C2CC2)ccc2ccccc21 ZINC001117722384 1131194173 /nfs/dbraw/zinc/19/41/73/1131194173.db2.gz VATQOOUHPCZUBD-ONEGZZNKSA-N 1 0 253.345 3.601 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H](CN)C2CCCC2)c1O ZINC000817981433 1131195140 /nfs/dbraw/zinc/19/51/40/1131195140.db2.gz JHMWOXYRISLVQX-XHDPSFHLSA-N 1 0 296.842 3.522 20 10 CHCDRO Cc1cc(N)cc(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)c1 ZINC000817981116 1131195354 /nfs/dbraw/zinc/19/53/54/1131195354.db2.gz QFACUKSCEHEPLB-NSHDSACASA-N 1 0 290.794 3.787 20 10 CHCDRO COc1ccc(N2CC[C@H](C[NH2+][C@H](C)CC(C)C)C2)cc1 ZINC000818220086 1131205292 /nfs/dbraw/zinc/20/52/92/1131205292.db2.gz IXACIJBNHPOLSU-HZPDHXFCSA-N 1 0 290.451 3.546 20 10 CHCDRO Cc1cc(N)cc(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)c1 ZINC001118058855 1131208331 /nfs/dbraw/zinc/20/83/31/1131208331.db2.gz ICWBLGQDKJRKQT-XJKSGUPXSA-N 1 0 296.414 3.929 20 10 CHCDRO Cc1cc(Br)cc([C@@H](C)[NH2+][C@H]2CC23CC3)c1O ZINC000818355370 1131210728 /nfs/dbraw/zinc/21/07/28/1131210728.db2.gz DORZBRTWZYHRAG-SKDRFNHKSA-N 1 0 296.208 3.666 20 10 CHCDRO Cc1cc(C[NH2+]CCCSc2nccs2)cs1 ZINC000823937705 1131448624 /nfs/dbraw/zinc/44/86/24/1131448624.db2.gz HBAWYZFOGHJJQD-UHFFFAOYSA-N 1 0 284.475 3.785 20 10 CHCDRO c1csc(SCCC[NH2+][C@@H]2CCCC23CCC3)n1 ZINC000823937628 1131448798 /nfs/dbraw/zinc/44/87/98/1131448798.db2.gz DYOOJPINXKFKTR-GFCCVEGCSA-N 1 0 282.478 3.938 20 10 CHCDRO Oc1ccc(-c2ccccc2)cc1C[N@@H+]1CC[C@@H](F)C1 ZINC000824572514 1131474428 /nfs/dbraw/zinc/47/44/28/1131474428.db2.gz YUBKPTKPLNMRIC-MRXNPFEDSA-N 1 0 271.335 3.603 20 10 CHCDRO C[C@@H](CCCO)C[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000824603146 1131476182 /nfs/dbraw/zinc/47/61/82/1131476182.db2.gz LIYLRIIHBDLYIM-HNNXBMFYSA-N 1 0 299.414 3.557 20 10 CHCDRO c1cc(N2CCCCC2)ccc1C[NH+]1CC2CC(C2)C1 ZINC001138220424 1131478880 /nfs/dbraw/zinc/47/88/80/1131478880.db2.gz BYKMIEAAKVKGOL-UHFFFAOYSA-N 1 0 270.420 3.519 20 10 CHCDRO COc1ccc(C[NH2+]C[C@@]2(C)CC2(Cl)Cl)cc1C ZINC000824764729 1131481892 /nfs/dbraw/zinc/48/18/92/1131481892.db2.gz CRIILRSUNYYXIQ-CYBMUJFWSA-N 1 0 288.218 3.677 20 10 CHCDRO Cc1c(C[NH+]2CCCCCC2)c2ccccc2n1C ZINC001138252562 1131482303 /nfs/dbraw/zinc/48/23/03/1131482303.db2.gz LONWEHZSHDZSAO-UHFFFAOYSA-N 1 0 256.393 3.863 20 10 CHCDRO Cc1c(C[N@H+](C)C2CCCC2)c2ccccc2n1C ZINC001138256903 1131483341 /nfs/dbraw/zinc/48/33/41/1131483341.db2.gz OUZWNKUNUWBVHE-UHFFFAOYSA-N 1 0 256.393 3.861 20 10 CHCDRO CCOC[C@H]1CCC[N@H+](Cc2cc(Cl)c(C)cc2O)C1 ZINC000824814968 1131486031 /nfs/dbraw/zinc/48/60/31/1131486031.db2.gz XFAYPEFOLJIEQC-ZDUSSCGKSA-N 1 0 297.826 3.603 20 10 CHCDRO CN1CCCc2cc(C[N@@H+]3CCC34CCCCC4)ccc21 ZINC001138354597 1131493537 /nfs/dbraw/zinc/49/35/37/1131493537.db2.gz OOXKSYOZKOEKJE-UHFFFAOYSA-N 1 0 284.447 3.978 20 10 CHCDRO CN1CCCc2cc(C[N@@H+]3CCc4ccccc4C3)ccc21 ZINC001138354557 1131493585 /nfs/dbraw/zinc/49/35/85/1131493585.db2.gz NCPDTMQDSUPBRX-UHFFFAOYSA-N 1 0 292.426 3.627 20 10 CHCDRO CN1CCCc2cc(C[N@H+]3C[C@@H]4CCCC[C@@H]4C3)ccc21 ZINC001138354685 1131493822 /nfs/dbraw/zinc/49/38/22/1131493822.db2.gz PTVKESFNLJYYMK-HDICACEKSA-N 1 0 284.447 3.691 20 10 CHCDRO CN1CCCc2cc(CN3Cc4cccc(F)c4C3)ccc21 ZINC001138356076 1131494240 /nfs/dbraw/zinc/49/42/40/1131494240.db2.gz GWAJIYYBEMFTAL-UHFFFAOYSA-N 1 0 296.389 3.724 20 10 CHCDRO CCN(CC)c1ccc(C[NH+]2CC3(CCC3)C2)c(OC)c1 ZINC001138386497 1131497281 /nfs/dbraw/zinc/49/72/81/1131497281.db2.gz OPCBHVOSASCLRX-UHFFFAOYSA-N 1 0 288.435 3.527 20 10 CHCDRO CCN(CC)c1ccc(C[NH+]2C3CCC2CC3)c(OC)c1 ZINC001138390181 1131498464 /nfs/dbraw/zinc/49/84/64/1131498464.db2.gz OUQUSSFKFZBOCA-UHFFFAOYSA-N 1 0 288.435 3.668 20 10 CHCDRO CC[C@@H]([NH2+]CC(C)(C)C1(O)CCCC1)c1ccccc1O ZINC000825240629 1131503818 /nfs/dbraw/zinc/50/38/18/1131503818.db2.gz OTTOCHIZTJYUPN-OAHLLOKOSA-N 1 0 291.435 3.764 20 10 CHCDRO CCN(C)c1ccc(C[NH2+]C2(C3CCC3)CC2)cc1 ZINC000844419121 1131560182 /nfs/dbraw/zinc/56/01/82/1131560182.db2.gz WFNPMAPYRYXXSL-UHFFFAOYSA-N 1 0 258.409 3.565 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CNc2ccccc2C1)c1ccc(C)cc1O ZINC000844921627 1131608211 /nfs/dbraw/zinc/60/82/11/1131608211.db2.gz QQXSGPPSTGKUPS-WBVHZDCISA-N 1 0 296.414 3.778 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]CCc1ccco1 ZINC000035661583 1131609072 /nfs/dbraw/zinc/60/90/72/1131609072.db2.gz BJXVTXCKXGPNIA-TZMCWYRMSA-N 1 0 271.360 3.674 20 10 CHCDRO CC[N@H+](Cc1cnc(Cl)c(C)c1)Cc1ccccc1O ZINC001139546695 1131615974 /nfs/dbraw/zinc/61/59/74/1131615974.db2.gz MNWUOZLZNQBILT-UHFFFAOYSA-N 1 0 290.794 3.771 20 10 CHCDRO Cc1cc(C[N@@H+]2CC[C@@H]3CCC[C@H]3C2)ccc1N(C)C ZINC001139671509 1131626934 /nfs/dbraw/zinc/62/69/34/1131626934.db2.gz XDKOWSAJNPVEBH-IRXDYDNUSA-N 1 0 272.436 3.683 20 10 CHCDRO Cc1cc(C[NH+]2CCCCCCC2)ccc1N(C)C ZINC001139673482 1131627474 /nfs/dbraw/zinc/62/74/74/1131627474.db2.gz RXCROAZHIAGITL-UHFFFAOYSA-N 1 0 260.425 3.827 20 10 CHCDRO Cc1cc(C[N@H+]2CCC[C@@H]2C(C)C)ccc1N(C)C ZINC001139673164 1131627802 /nfs/dbraw/zinc/62/78/02/1131627802.db2.gz ATWHQSWPNSPCRZ-MRXNPFEDSA-N 1 0 260.425 3.681 20 10 CHCDRO CCc1cccc(C[NH2+]Cc2ccc(N(C)C)cc2)c1 ZINC000845921788 1131668260 /nfs/dbraw/zinc/66/82/60/1131668260.db2.gz QXYQKFYIDPCVCO-UHFFFAOYSA-N 1 0 268.404 3.605 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CS[C@H](C(C)C)C2)c1 ZINC000845972280 1131674142 /nfs/dbraw/zinc/67/41/42/1131674142.db2.gz QQWHYLLVCZGNPT-MKBNYLNASA-N 1 0 295.448 3.582 20 10 CHCDRO Cc1ccc(C)c(C[NH+]2C3CCCC2CCC3)c1O ZINC001140184016 1131674193 /nfs/dbraw/zinc/67/41/93/1131674193.db2.gz JYYMVDSXLZRYLZ-UHFFFAOYSA-N 1 0 259.393 3.916 20 10 CHCDRO CC[C@H](OCC[NH2+]Cc1cccc(C)c1O)c1ccccc1 ZINC000846020526 1131678455 /nfs/dbraw/zinc/67/84/55/1131678455.db2.gz JUGXMPMRVUBQTF-SFHVURJKSA-N 1 0 299.414 3.958 20 10 CHCDRO Cc1cccc(C[NH2+]Cc2cc(Cl)ccc2O)c1C ZINC000846058693 1131679495 /nfs/dbraw/zinc/67/94/95/1131679495.db2.gz RSDCNGCITBDUCU-UHFFFAOYSA-N 1 0 275.779 3.952 20 10 CHCDRO C[C@H](C[NH2+][C@@H]1CCc2cccc(O)c21)c1cccc(F)c1 ZINC000834537486 1131681880 /nfs/dbraw/zinc/68/18/80/1131681880.db2.gz DQLRHDPYAOAKRL-MLGOLLRUSA-N 1 0 285.362 3.912 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)[C@](C)(O)c1ccccc1)c1ccccc1O ZINC000846044038 1131683797 /nfs/dbraw/zinc/68/37/97/1131683797.db2.gz NKUKJLGRTLLUSH-FNHZYXHNSA-N 1 0 299.414 3.729 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]C[C@@H]1CCc3ccccc31)CC2 ZINC000834578536 1131684839 /nfs/dbraw/zinc/68/48/39/1131684839.db2.gz UCXVYKPBYHLKJV-RDJZCZTQSA-N 1 0 279.383 3.699 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@H]1CSc3ccccc31)CC2 ZINC000834594649 1131686329 /nfs/dbraw/zinc/68/63/29/1131686329.db2.gz SACNCIQUGBFEEP-KGLIPLIRSA-N 1 0 283.396 3.816 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]CC1(c3cccc(F)c3)CC1)CC2 ZINC000834598601 1131686838 /nfs/dbraw/zinc/68/68/38/1131686838.db2.gz RGJMKLKKGPYUKT-INIZCTEOSA-N 1 0 297.373 3.840 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]Cc2cccc(CC)c2)c1 ZINC000846100946 1131689663 /nfs/dbraw/zinc/68/96/63/1131689663.db2.gz WDIBFOVKCSHJFK-UHFFFAOYSA-N 1 0 285.387 3.643 20 10 CHCDRO COc1cccc(C[C@@H](C)[NH2+][C@@H]2CCc3cccc(O)c32)c1 ZINC000834646013 1131689889 /nfs/dbraw/zinc/68/98/89/1131689889.db2.gz UEMHDZJZBNLVBQ-CXAGYDPISA-N 1 0 297.398 3.609 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@@H]1CCc3ccc(F)cc31)CC2 ZINC000834640880 1131690102 /nfs/dbraw/zinc/69/01/02/1131690102.db2.gz SAQPWIFGYPBFLC-CVEARBPZSA-N 1 0 283.346 3.796 20 10 CHCDRO CC[C@H](C)C[C@H](C)[NH2+][C@H](C)c1cccc(OC)c1O ZINC000846155032 1131691895 /nfs/dbraw/zinc/69/18/95/1131691895.db2.gz OTQBOJYYBBXLPP-RWMBFGLXSA-N 1 0 265.397 3.876 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]C2CC(C(C)(C)C)C2)c1O ZINC000846169032 1131692732 /nfs/dbraw/zinc/69/27/32/1131692732.db2.gz FIOLKORRRNDMOS-HIFPTAJRSA-N 1 0 277.408 3.876 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CCCCCCSC)c1O ZINC000846161678 1131692877 /nfs/dbraw/zinc/69/28/77/1131692877.db2.gz ANYYEYVBYSEZOO-CYBMUJFWSA-N 1 0 297.464 3.975 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CCCCCSC)c1O ZINC000846165829 1131693006 /nfs/dbraw/zinc/69/30/06/1131693006.db2.gz ZKGRMRCAKPYNLF-GFCCVEGCSA-N 1 0 283.437 3.585 20 10 CHCDRO COc1cccc([C@H](C)Nc2cc(C3CC3)ccn2)c1O ZINC000846168376 1131693155 /nfs/dbraw/zinc/69/31/55/1131693155.db2.gz AJPAMCSOMHOTNS-NSHDSACASA-N 1 0 284.359 3.846 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]Cc2cccc(Cl)c2)c1O ZINC000846138479 1131693543 /nfs/dbraw/zinc/69/35/43/1131693543.db2.gz SILDNRMIIHWZEQ-LLVKDONJSA-N 1 0 291.778 3.905 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@@H](C)CCc2ccco2)c1O ZINC000846138961 1131693667 /nfs/dbraw/zinc/69/36/67/1131693667.db2.gz YRVPKXHBJSKXSX-QWHCGFSZSA-N 1 0 289.375 3.666 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]C2CCCCCC2)c1O ZINC000846135481 1131693802 /nfs/dbraw/zinc/69/38/02/1131693802.db2.gz CXTXNDDIAIXOOC-LBPRGKRZSA-N 1 0 263.381 3.774 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@H](c1cccnc1)C1CC1)CC2 ZINC000834693478 1131694190 /nfs/dbraw/zinc/69/41/90/1131694190.db2.gz OWSOUMZZFFBLED-QAPCUYQASA-N 1 0 280.371 3.515 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H](C)c2cnccc2C)c1O ZINC000846145906 1131694866 /nfs/dbraw/zinc/69/48/66/1131694866.db2.gz DHOPDBBFWHIKDK-STQMWFEESA-N 1 0 286.375 3.516 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H](C)C2CCCC2)c1O ZINC000846144846 1131695102 /nfs/dbraw/zinc/69/51/02/1131695102.db2.gz MINVRIHSPWSSHZ-RYUDHWBXSA-N 1 0 263.381 3.630 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H](C)COCC2CC2)c1O ZINC000846205826 1131695812 /nfs/dbraw/zinc/69/58/12/1131695812.db2.gz UHRDEJMCPIAMKY-RYUDHWBXSA-N 1 0 297.826 3.820 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]C1(c3ccc(F)cc3)CC1)CC2 ZINC000834722742 1131698176 /nfs/dbraw/zinc/69/81/76/1131698176.db2.gz YTZVRJQADUWPAN-HNNXBMFYSA-N 1 0 283.346 3.798 20 10 CHCDRO CO[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000846202765 1131699907 /nfs/dbraw/zinc/69/99/07/1131699907.db2.gz QZDPWMUPBIIPQV-PSOPSSQASA-N 1 0 283.799 3.654 20 10 CHCDRO Oc1cccc(Cl)c1C[N@H+](C1CCC1)C1CCOCC1 ZINC001140342327 1131703427 /nfs/dbraw/zinc/70/34/27/1131703427.db2.gz DGEXTHHYMWBWOF-UHFFFAOYSA-N 1 0 295.810 3.579 20 10 CHCDRO CC[C@@H](CC(F)(F)F)[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000834765455 1131703724 /nfs/dbraw/zinc/70/37/24/1131703724.db2.gz MJKRQBOTBZWNRI-WDEREUQCSA-N 1 0 273.298 3.700 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CCCC2CCOCC2)c(O)c1 ZINC000834819321 1131707534 /nfs/dbraw/zinc/70/75/34/1131707534.db2.gz UNUVXEWBAZNYJV-HNNXBMFYSA-N 1 0 291.435 3.866 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccnc(C)c2)c(O)c1 ZINC000834859884 1131714318 /nfs/dbraw/zinc/71/43/18/1131714318.db2.gz LGTPCOLAXDKOAO-CQSZACIVSA-N 1 0 270.376 3.563 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@](C)(CC)OC)cc1 ZINC000834882173 1131716818 /nfs/dbraw/zinc/71/68/18/1131716818.db2.gz KCWNCMILNGCCMS-PBHICJAKSA-N 1 0 278.440 3.608 20 10 CHCDRO CC[C@](C)(C[NH2+][C@@H](C)c1cc(Cl)ccc1O)OC ZINC000834883162 1131717412 /nfs/dbraw/zinc/71/74/12/1131717412.db2.gz ZOWPICLAQJKAPE-IINYFYTJSA-N 1 0 271.788 3.511 20 10 CHCDRO CC[C@H]([NH2+]CC1(CF)CCOCC1)c1ccc(C)cc1O ZINC000834884957 1131718744 /nfs/dbraw/zinc/71/87/44/1131718744.db2.gz FMLIJMHOIMVNCE-HNNXBMFYSA-N 1 0 295.398 3.508 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCc2ncccc2C)cc1 ZINC000834887138 1131719659 /nfs/dbraw/zinc/71/96/59/1131719659.db2.gz YLTTYRHWYMYVRV-MRXNPFEDSA-N 1 0 297.446 3.739 20 10 CHCDRO COCC1(C[NH2+][C@@H](C)c2ccc(C)cc2O)CCCC1 ZINC000834905835 1131728516 /nfs/dbraw/zinc/72/85/16/1131728516.db2.gz LRYLHIJRWNGRQB-AWEZNQCLSA-N 1 0 277.408 3.558 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCC[C@H]2CCOC2)cc1 ZINC000834905960 1131728857 /nfs/dbraw/zinc/72/88/57/1131728857.db2.gz VOYNKDFUYZWDFV-CVEARBPZSA-N 1 0 290.451 3.610 20 10 CHCDRO CCO[C@@H]1CCC[C@H]1[NH2+][C@@H](CC)c1ccc(N(C)C)cc1 ZINC000834913139 1131732057 /nfs/dbraw/zinc/73/20/57/1131732057.db2.gz OPEBQRHKGXTAOC-RCCFBDPRSA-N 1 0 290.451 3.751 20 10 CHCDRO CCC(C)(C)OCC[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000834915595 1131733657 /nfs/dbraw/zinc/73/36/57/1131733657.db2.gz RYODOXIOUQFSIP-CQSZACIVSA-N 1 0 279.424 3.865 20 10 CHCDRO COc1ccc2c(c1)CN(Cc1ccc(Cl)cc1O)C2 ZINC001140466636 1131752691 /nfs/dbraw/zinc/75/26/91/1131752691.db2.gz IUODUQDFIPBFMK-UHFFFAOYSA-N 1 0 289.762 3.570 20 10 CHCDRO CN(C)c1ccc(/C=C/C[N@H+](C)CCOC(C)(C)C)cc1 ZINC000835027326 1131759630 /nfs/dbraw/zinc/75/96/30/1131759630.db2.gz CQJZKHYFRVXWSH-BQYQJAHWSA-N 1 0 290.451 3.513 20 10 CHCDRO CC(C)[N@H+](C/C=C/c1ccc(N(C)C)cc1)C1CC1 ZINC000835026001 1131760010 /nfs/dbraw/zinc/76/00/10/1131760010.db2.gz PTSXBCFOEUXNBR-AATRIKPKSA-N 1 0 258.409 3.639 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]C(C2CC2)C2CC2)cc1 ZINC000835036581 1131761439 /nfs/dbraw/zinc/76/14/39/1131761439.db2.gz MMPFUQCQWJVPBI-ARJAWSKDSA-N 1 0 270.420 3.544 20 10 CHCDRO C[C@H](C[NH2+]C/C=C\c1ccc(N(C)C)cc1)c1ccncc1 ZINC000835043904 1131762496 /nfs/dbraw/zinc/76/24/96/1131762496.db2.gz VTIGGJCHXKKWDS-YIEVGGLXSA-N 1 0 295.430 3.554 20 10 CHCDRO C[C@@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)C1CCC1 ZINC000835042175 1131762818 /nfs/dbraw/zinc/76/28/18/1131762818.db2.gz RVSOKHDGFWDUST-VBROQKIQSA-N 1 0 258.409 3.544 20 10 CHCDRO CS[C@@H]1CC[C@H]([NH2+]C/C=C\c2ccc(N(C)C)cc2)C1 ZINC000835044265 1131763805 /nfs/dbraw/zinc/76/38/05/1131763805.db2.gz YPUWRFKVWAIYPL-XHRFTGCISA-N 1 0 290.476 3.640 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+][C@@H]2CCC2(C)C)cc1 ZINC000835052705 1131766483 /nfs/dbraw/zinc/76/64/83/1131766483.db2.gz GXOGBVHYDZSGBI-SQRWCISFSA-N 1 0 258.409 3.544 20 10 CHCDRO C[C@@H]1CC[C@H](C[NH2+]Cc2cc(-c3ccccc3)ccc2O)O1 ZINC000835088834 1131771655 /nfs/dbraw/zinc/77/16/55/1131771655.db2.gz VIPOMLSSWNAOCV-RDTXWAMCSA-N 1 0 297.398 3.716 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CCCOC(C)(C)C)cc1 ZINC001203048430 1131799856 /nfs/dbraw/zinc/79/98/56/1131799856.db2.gz QJQSWVAYEHRKAL-UHFFFAOYSA-N 1 0 292.467 3.828 20 10 CHCDRO Cc1ccc(O)c(CN(C)Cc2csc(C(C)C)n2)c1 ZINC001140622721 1131830847 /nfs/dbraw/zinc/83/08/47/1131830847.db2.gz DEDRCKLWVIGZLY-UHFFFAOYSA-N 1 0 290.432 3.913 20 10 CHCDRO Cc1ccc(O)c(C[N@H+](C)CC/C=C/c2cccnc2)c1 ZINC001140623351 1131833119 /nfs/dbraw/zinc/83/31/19/1131833119.db2.gz MQYYJUJOFBHDDQ-ZZXKWVIFSA-N 1 0 282.387 3.631 20 10 CHCDRO CCN(CC)c1ccc(C[NH+]2CCCCCC2)c(O)c1 ZINC001140850024 1131945778 /nfs/dbraw/zinc/94/57/78/1131945778.db2.gz AUFRRGBFXGSEKP-UHFFFAOYSA-N 1 0 276.424 3.614 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@](C)(F)C2)c(O)c1 ZINC001140850082 1131945942 /nfs/dbraw/zinc/94/59/42/1131945942.db2.gz CTAZQJVHIVRVDK-KRWDZBQOSA-N 1 0 294.414 3.562 20 10 CHCDRO CC[C@H]([NH2+]CC(CC)(CC)CO)c1ccc(N(C)C)cc1 ZINC000773102535 1131946678 /nfs/dbraw/zinc/94/66/78/1131946678.db2.gz ODUWDFJYROCJBV-KRWDZBQOSA-N 1 0 292.467 3.592 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCCC[C@H](C)C2)c(O)c1 ZINC001140850768 1131948116 /nfs/dbraw/zinc/94/81/16/1131948116.db2.gz TVMOFZRQPVMMCW-HNNXBMFYSA-N 1 0 290.451 3.860 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCCC[C@H](F)C2)c(O)c1 ZINC001140851014 1131948163 /nfs/dbraw/zinc/94/81/63/1131948163.db2.gz YJONHSMRHSFGAJ-HNNXBMFYSA-N 1 0 294.414 3.562 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)CC2CCCC2)c(O)c1 ZINC001140855502 1131948825 /nfs/dbraw/zinc/94/88/25/1131948825.db2.gz BSRTZIBUJIUXMB-UHFFFAOYSA-N 1 0 290.451 3.860 20 10 CHCDRO CN(C)c1ccc(CN2CCCC[C@@H](F)C2)c(Cl)c1 ZINC001140922547 1131964426 /nfs/dbraw/zinc/96/44/26/1131964426.db2.gz UGOJGBLFGZBVCU-CYBMUJFWSA-N 1 0 284.806 3.730 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC(C)(C)C2)c(Cl)c1 ZINC001140924127 1131965969 /nfs/dbraw/zinc/96/59/69/1131965969.db2.gz MHLDHZXYYDALIG-UHFFFAOYSA-N 1 0 266.816 3.638 20 10 CHCDRO Cc1ccc(C[NH+]2CCC(C(C)(C)C)CC2)c(O)c1 ZINC001140947844 1131969605 /nfs/dbraw/zinc/96/96/05/1131969605.db2.gz HXSTVLMAIBYMIT-UHFFFAOYSA-N 1 0 261.409 3.959 20 10 CHCDRO Cc1cccc(CC[N@@H+](C)Cc2ccc(C)cc2O)c1 ZINC001140950683 1131970097 /nfs/dbraw/zinc/97/00/97/1131970097.db2.gz CLSPOZGYLXKGEV-UHFFFAOYSA-N 1 0 269.388 3.684 20 10 CHCDRO Cc1ccc(C[N@@H+]2CCC[C@@H]3CCCC[C@@H]32)c(O)c1 ZINC001140951121 1131971182 /nfs/dbraw/zinc/97/11/82/1131971182.db2.gz ZOSNWXPCVLPRJK-HOCLYGCPSA-N 1 0 259.393 3.855 20 10 CHCDRO CC[N@H+](Cc1ccc(F)cc1)Cc1ccc(C)cc1O ZINC001140951019 1131972049 /nfs/dbraw/zinc/97/20/49/1131972049.db2.gz ULTMRPIJLQMVAQ-UHFFFAOYSA-N 1 0 273.351 3.862 20 10 CHCDRO CC(C)C1CC([NH2+]Cc2cc(Br)ccc2O)C1 ZINC000714670968 1131974759 /nfs/dbraw/zinc/97/47/59/1131974759.db2.gz WRGMAWQIEPICPF-UHFFFAOYSA-N 1 0 298.224 3.679 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCc2cccc(F)c2)c1 ZINC000036778522 1131975158 /nfs/dbraw/zinc/97/51/58/1131975158.db2.gz NIGMUMFOZWKUBS-ZDUSSCGKSA-N 1 0 273.351 3.733 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CC12CC2)c1ccc2ccccc2c1O ZINC000715220333 1131981637 /nfs/dbraw/zinc/98/16/37/1131981637.db2.gz AKTUDJAGSGGHIL-XHDPSFHLSA-N 1 0 253.345 3.749 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)Cc2cccs2)c1 ZINC000036992895 1131985540 /nfs/dbraw/zinc/98/55/40/1131985540.db2.gz REXXBAJHFPVKSL-VXGBXAGGSA-N 1 0 291.416 3.744 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)Cc2ccco2)c1 ZINC000036994202 1131986780 /nfs/dbraw/zinc/98/67/80/1131986780.db2.gz ZKHAOBYBTYHTKW-QWHCGFSZSA-N 1 0 259.349 3.575 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccns2)c(O)c1 ZINC000715966743 1132000816 /nfs/dbraw/zinc/00/08/16/1132000816.db2.gz OTINCXQRUSSSBO-WDEREUQCSA-N 1 0 262.378 3.569 20 10 CHCDRO Cc1cccc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2)c1 ZINC000037233612 1132023200 /nfs/dbraw/zinc/02/32/00/1132023200.db2.gz AIKDWSPXUFTZCR-HNNXBMFYSA-N 1 0 268.404 3.912 20 10 CHCDRO C[C@H]1CC[C@H]([N@H+](C)Cc2ccc3c(c2)OCCN3C)CC1 ZINC001141145371 1132028723 /nfs/dbraw/zinc/02/87/23/1132028723.db2.gz AYYWADOWAKEAJN-KOMQPUFPSA-N 1 0 288.435 3.526 20 10 CHCDRO Oc1ccc(O)c(C[N@@H+]2CCCC[C@H]2c2ccccc2)c1 ZINC001141156306 1132029073 /nfs/dbraw/zinc/02/90/73/1132029073.db2.gz JENCVKRRTPAYLB-KRWDZBQOSA-N 1 0 283.371 3.825 20 10 CHCDRO CC[C@H]1CCCC[C@H]1[NH2+]Cc1ccc2c(c1)CCO2 ZINC000037363327 1132030548 /nfs/dbraw/zinc/03/05/48/1132030548.db2.gz KQMFJXMIXSBONM-GOEBONIOSA-N 1 0 259.393 3.680 20 10 CHCDRO Cc1cc(C)c(C[NH2+][C@@H]2CCc3c(C)cccc3C2)c(O)c1 ZINC001171561363 1132055164 /nfs/dbraw/zinc/05/51/64/1132055164.db2.gz YESXSCILXHSQKY-QGZVFWFLSA-N 1 0 295.426 3.965 20 10 CHCDRO Cc1cccc2c1CC[C@H]([N@H+](C)Cc1ccccc1O)C2 ZINC001171574870 1132062163 /nfs/dbraw/zinc/06/21/63/1132062163.db2.gz QMJIFDATIWHGSX-KRWDZBQOSA-N 1 0 281.399 3.690 20 10 CHCDRO Cc1ccc(CC[C@@H](C)[NH2+]Cc2ccccc2O)cc1 ZINC001171655247 1132069212 /nfs/dbraw/zinc/06/92/12/1132069212.db2.gz HAIRGWGIHUANMW-OAHLLOKOSA-N 1 0 269.388 3.812 20 10 CHCDRO C[C@H]([NH2+][C@H]1Cc2cccc(F)c2C1)c1ccc(N(C)C)cc1 ZINC001171780537 1132099954 /nfs/dbraw/zinc/09/99/54/1132099954.db2.gz MLVHVJMDICJCLR-BBRMVZONSA-N 1 0 298.405 3.710 20 10 CHCDRO C[C@@H]1CC[C@H]([N@@H+]2CCc3cccc(O)c3C2)C[C@@H]1C ZINC001172379573 1132170949 /nfs/dbraw/zinc/17/09/49/1132170949.db2.gz ORFCPCVCZOOULJ-IPYPFGDCSA-N 1 0 259.393 3.575 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H](C)CCCc2cccnc2)cc1C ZINC000839149563 1132183964 /nfs/dbraw/zinc/18/39/64/1132183964.db2.gz DTAPVVJLCLVTPB-INIZCTEOSA-N 1 0 298.430 3.905 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]C2CCC(C(F)F)CC2)c1 ZINC000839179532 1132188328 /nfs/dbraw/zinc/18/83/28/1132188328.db2.gz KQMCHQWNCRFUQW-UHFFFAOYSA-N 1 0 299.361 3.704 20 10 CHCDRO CC[C@H]([NH2+]Cc1cnc(C)o1)c1cc(Cl)ccc1O ZINC000840795151 1132287976 /nfs/dbraw/zinc/28/79/76/1132287976.db2.gz USRHWIVKONDFSX-ZDUSSCGKSA-N 1 0 280.755 3.583 20 10 CHCDRO CC(C)(C)c1ccncc1C[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000840857496 1132295651 /nfs/dbraw/zinc/29/56/51/1132295651.db2.gz MLUARALHCUGINL-MRXNPFEDSA-N 1 0 296.414 3.862 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1C[C@H](C)O[C@H]1C)c1ccc(N(C)C)cc1 ZINC000840874049 1132298628 /nfs/dbraw/zinc/29/86/28/1132298628.db2.gz WJVMUPNJXWRPHV-DNUAJFIVSA-N 1 0 290.451 3.607 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1C[C@@H](C)O[C@H]1C)c1cc(Cl)ccc1O ZINC000840873080 1132298764 /nfs/dbraw/zinc/29/87/64/1132298764.db2.gz QQEMLXISZUKMSK-YXMPFFBPSA-N 1 0 297.826 3.900 20 10 CHCDRO Oc1ccc(C[NH2+]C2CCC3(CCCC3)CC2)c(O)c1 ZINC001172726502 1132299206 /nfs/dbraw/zinc/29/92/06/1132299206.db2.gz WEZBNEZGDIXVNQ-UHFFFAOYSA-N 1 0 275.392 3.690 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+][C@@H](C)c1ccncc1 ZINC000840893346 1132305864 /nfs/dbraw/zinc/30/58/64/1132305864.db2.gz IUPYFOIHOQZYLD-CVEARBPZSA-N 1 0 297.446 3.738 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCC[C@H](CO)C1)c1cc(Cl)ccc1O ZINC000840893279 1132306167 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ZINC001231586363 1132318450 /nfs/dbraw/zinc/31/84/50/1132318450.db2.gz FWOLVBZJZHIFIH-LJQANCHMSA-N 1 0 297.398 3.690 20 10 CHCDRO Cc1cccc(C[N@H+](C)CC/C=C/c2cccnc2)c1O ZINC001231595107 1132321699 /nfs/dbraw/zinc/32/16/99/1132321699.db2.gz SKRNPDQQCZXRQC-FPYGCLRLSA-N 1 0 282.387 3.631 20 10 CHCDRO Cc1cc2cc(C[NH2+]CCc3ccc(N)cc3)oc2cc1C ZINC000841035222 1132321696 /nfs/dbraw/zinc/32/16/96/1132321696.db2.gz LVKNUAGCAHSFEE-UHFFFAOYSA-N 1 0 294.398 3.964 20 10 CHCDRO CCSc1cccc(C[NH2+]CCc2ccc(N)cc2)c1 ZINC000841034698 1132322021 /nfs/dbraw/zinc/32/20/21/1132322021.db2.gz JQPBFSITFVUPRG-UHFFFAOYSA-N 1 0 286.444 3.713 20 10 CHCDRO Cc1cccc(C[N@H+]2CC[C@H](Oc3ccccc3C)C2)c1O ZINC001231593330 1132322159 /nfs/dbraw/zinc/32/21/59/1132322159.db2.gz UMOYMPFOEDIFQB-KRWDZBQOSA-N 1 0 297.398 3.662 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CCCc3cc(N)ccc32)cc1C ZINC000841057141 1132324350 /nfs/dbraw/zinc/32/43/50/1132324350.db2.gz BYJDRQUUSWMGMQ-GOSISDBHSA-N 1 0 296.414 3.753 20 10 CHCDRO C[NH2+]Cc1cccc(NCc2cc(Cl)cc(C)c2O)c1 ZINC000841043766 1132325087 /nfs/dbraw/zinc/32/50/87/1132325087.db2.gz TVFBQWPZTMYESS-UHFFFAOYSA-N 1 0 290.794 3.686 20 10 CHCDRO Cc1ccc2c(c1)C[C@H]([NH2+][C@H](C)c1ccccc1O)CC2 ZINC001172835653 1132326915 /nfs/dbraw/zinc/32/69/15/1132326915.db2.gz ONGDMDLTXDGTHJ-RHSMWYFYSA-N 1 0 281.399 3.909 20 10 CHCDRO CCCC[NH+](CCCC)Cc1cc(OC)c(O)cc1O ZINC001231636040 1132332496 /nfs/dbraw/zinc/33/24/96/1132332496.db2.gz PLRROWHMQXIVQV-UHFFFAOYSA-N 1 0 281.396 3.509 20 10 CHCDRO COc1ccc2c(c1)C[N@@H+](Cc1c(C)cc(C)cc1O)CC2 ZINC001231843462 1132375429 /nfs/dbraw/zinc/37/54/29/1132375429.db2.gz ZLWVDZHLASXZME-UHFFFAOYSA-N 1 0 297.398 3.576 20 10 CHCDRO Cc1ccc2c(c1)C[N@@H+](Cc1c(C)cc(C)cc1O)CC2 ZINC001231842466 1132377194 /nfs/dbraw/zinc/37/71/94/1132377194.db2.gz MXSZBWRFUYIQRV-UHFFFAOYSA-N 1 0 281.399 3.876 20 10 CHCDRO Cc1cc(C)c(C[N@H+](C)CC/C=C/c2cccnc2)c(O)c1 ZINC001231849448 1132377698 /nfs/dbraw/zinc/37/76/98/1132377698.db2.gz QPTBLRCQVXYQHQ-QPJJXVBHSA-N 1 0 296.414 3.939 20 10 CHCDRO Cc1cc(C)c(C[N@H+](C)CCC(=O)c2ccccc2)c(O)c1 ZINC001231846080 1132377875 /nfs/dbraw/zinc/37/78/75/1132377875.db2.gz FSCHDGRQAJWBOB-UHFFFAOYSA-N 1 0 297.398 3.714 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCC[C@H]3CCC[C@H]32)c(O)c1 ZINC001231846956 1132378514 /nfs/dbraw/zinc/37/85/14/1132378514.db2.gz TYPFBKJYSMBKNF-GDBMZVCRSA-N 1 0 259.393 3.774 20 10 CHCDRO COc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@@H](C)[C@@H](C)C1 ZINC001231849410 1132378681 /nfs/dbraw/zinc/37/86/81/1132378681.db2.gz SGSBCSGXVOAHJA-CABCVRRESA-N 1 0 290.451 3.629 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)cc1OC)C1CCCCC1 ZINC001231849078 1132379286 /nfs/dbraw/zinc/37/92/86/1132379286.db2.gz NKVBDJAQGGLVJA-UHFFFAOYSA-N 1 0 290.451 3.916 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CC[C@H]3CCC[C@H]3C2)c(O)c1 ZINC001231844627 1132380008 /nfs/dbraw/zinc/38/00/08/1132380008.db2.gz OKYLYKCFJVBIDA-CABCVRRESA-N 1 0 259.393 3.631 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)c1ccc(Cl)cc1O)c1cccnc1 ZINC000841743427 1132386988 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Cc1ccc(O)c([C@H](C)[NH2+][C@H]2COCc3ccccc32)c1 ZINC000841758353 1132394960 /nfs/dbraw/zinc/39/49/60/1132394960.db2.gz AOKMYHVAFOGHOJ-GUYCJALGSA-N 1 0 283.371 3.623 20 10 CHCDRO CC[C@@H]1CC[C@H]([NH2+][C@@H](C)c2ccc(N(C)C)cc2)C1 ZINC001173269249 1132434524 /nfs/dbraw/zinc/43/45/24/1132434524.db2.gz UJFYTAYSXNCDTR-LZWOXQAQSA-N 1 0 260.425 3.982 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CCC[C@@H](C)CC2)cc1Cl ZINC001232263825 1132445261 /nfs/dbraw/zinc/44/52/61/1132445261.db2.gz APVHAWIFCIGABZ-LLVKDONJSA-N 1 0 283.799 3.676 20 10 CHCDRO C[N@H+](Cc1csc(Cl)c1)Cc1ccccc1O ZINC001142775745 1132446401 /nfs/dbraw/zinc/44/64/01/1132446401.db2.gz KMABGBXGYVQPAU-UHFFFAOYSA-N 1 0 267.781 3.739 20 10 CHCDRO COc1cc(O)c(C[N@H+]2C[C@@H]3CCCC[C@@H]3C2)cc1Cl ZINC001232266591 1132446624 /nfs/dbraw/zinc/44/66/24/1132446624.db2.gz PLWHVYIKGYPSHS-TXEJJXNPSA-N 1 0 295.810 3.676 20 10 CHCDRO CCSC[C@@H](C)[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001173305402 1132448200 /nfs/dbraw/zinc/44/82/00/1132448200.db2.gz OCRLARGLXCOFBA-OAHLLOKOSA-N 1 0 292.492 3.860 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+][C@@H]2CC[C@@H]3C[C@@H]3C2)cc1 ZINC000842777733 1132461158 /nfs/dbraw/zinc/46/11/58/1132461158.db2.gz CVLKNQNBHMPCQP-OTLMLMNOSA-N 1 0 270.420 3.544 20 10 CHCDRO COc1ccccc1C1([NH2+][C@@H]2CCc3cccc(O)c32)CC1 ZINC000842900766 1132474199 /nfs/dbraw/zinc/47/41/99/1132474199.db2.gz HMWMEBGRKGEBJI-OAHLLOKOSA-N 1 0 295.382 3.667 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H](C)CC(F)F)c(O)c1 ZINC000842892781 1132474642 /nfs/dbraw/zinc/47/46/42/1132474642.db2.gz FFNPPZVBTOXSBV-CMPLNLGQSA-N 1 0 271.351 3.951 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H]2CCS[C@H]2C)cc1 ZINC000842926924 1132475824 /nfs/dbraw/zinc/47/58/24/1132475824.db2.gz BEWKNZYZNQPNMD-XEZPLFJOSA-N 1 0 278.465 3.687 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2C[C@@H](OC(C)(C)C)C2)c(O)c1 ZINC000842922912 1132476467 /nfs/dbraw/zinc/47/64/67/1132476467.db2.gz ZEINNIVLROWQKB-MELADBBJSA-N 1 0 277.408 3.697 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCS[C@H]1C)c1ccc(C)cc1O ZINC000842929646 1132478104 /nfs/dbraw/zinc/47/81/04/1132478104.db2.gz PLRZZYMKWXPDDU-FPMFFAJLSA-N 1 0 265.422 3.635 20 10 CHCDRO CC(C)(C)c1cccc(C[NH+]2C[C@@H]3CCC[C@H]3C2)c1O ZINC001143103658 1132501965 /nfs/dbraw/zinc/50/19/65/1132501965.db2.gz IMRPGZHJXRSSQD-KBPBESRZSA-N 1 0 273.420 3.922 20 10 CHCDRO CC(C)(C)c1cccc(C[N@@H+]2C[C@@H]3C[C@H]2C[C@@H]3F)c1O ZINC001143111678 1132503918 /nfs/dbraw/zinc/50/39/18/1132503918.db2.gz FFZXVQRXZIJDIT-YDHLFZDLSA-N 1 0 277.383 3.622 20 10 CHCDRO Oc1cccc2c1C[N@H+](Cc1ccc3ncsc3c1)CC2 ZINC001232743349 1132514951 /nfs/dbraw/zinc/51/49/51/1132514951.db2.gz SOGZLJCRWUXFSC-UHFFFAOYSA-N 1 0 296.395 3.560 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC[C@H]3CCCC[C@H]32)c(O)c1 ZINC001232840451 1132528502 /nfs/dbraw/zinc/52/85/02/1132528502.db2.gz XOSMRRLOCKPUFL-RHSMWYFYSA-N 1 0 288.435 3.613 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CCCC[C@H]2C2CCC2)c1 ZINC000843437337 1132535102 /nfs/dbraw/zinc/53/51/02/1132535102.db2.gz CIINJVYYTJEMEI-INIZCTEOSA-N 1 0 275.392 3.555 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cnc(C)c(C)c1 ZINC001233161409 1132573751 /nfs/dbraw/zinc/57/37/51/1132573751.db2.gz AUEPGMDNUWTYPP-UHFFFAOYSA-N 1 0 297.446 3.787 20 10 CHCDRO CC(C)(C)c1ccc(O)c(C[NH+]2CCC(F)(F)CC2)c1 ZINC001233283365 1132594110 /nfs/dbraw/zinc/59/41/10/1132594110.db2.gz DOFGXYUGFCWFLW-UHFFFAOYSA-N 1 0 283.362 3.921 20 10 CHCDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CC[C@@](C)(F)[C@@H](F)C2)c1 ZINC001233284355 1132594539 /nfs/dbraw/zinc/59/45/39/1132594539.db2.gz RGOGZTSGITZDOF-DOTOQJQBSA-N 1 0 297.389 3.962 20 10 CHCDRO CC(C)[C@@H]1C[N@H+](Cc2cc(C(C)(C)C)ccc2O)CCO1 ZINC001233287112 1132597415 /nfs/dbraw/zinc/59/74/15/1132597415.db2.gz WXZZJOQZJGVKDT-KRWDZBQOSA-N 1 0 291.435 3.547 20 10 CHCDRO Oc1cc(C(F)(F)F)ccc1C[N@@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC001233451510 1132624541 /nfs/dbraw/zinc/62/45/41/1132624541.db2.gz NBXQVYYKSBLXFN-PHIMTYICSA-N 1 0 285.309 3.643 20 10 CHCDRO Nc1ccc(Nc2ccc(C[NH+]3CCCCC3)cc2)cc1 ZINC001159448944 1132846736 /nfs/dbraw/zinc/84/67/36/1132846736.db2.gz BLQQIWFTRCPUPX-UHFFFAOYSA-N 1 0 281.403 3.998 20 10 CHCDRO Cc1c[nH+]ccc1Nc1cc(Cl)c(C)c(Cl)c1O ZINC001174538739 1132898993 /nfs/dbraw/zinc/89/89/93/1132898993.db2.gz OIIRJRRPRBZWIE-UHFFFAOYSA-N 1 0 283.158 3.876 20 10 CHCDRO COc1cc[nH+]c(NCc2cc3ccccc3cc2O)c1 ZINC001160207296 1132945661 /nfs/dbraw/zinc/94/56/61/1132945661.db2.gz VZAWJPMZJGBOGH-UHFFFAOYSA-N 1 0 280.327 3.561 20 10 CHCDRO Cc1cccc(C[NH2+]C(C)(C)c2ccnc(Cl)c2)c1O ZINC001160771239 1132980607 /nfs/dbraw/zinc/98/06/07/1132980607.db2.gz PETHVNAWMWHTPK-UHFFFAOYSA-N 1 0 290.794 3.774 20 10 CHCDRO Cc1cc(C)c(CNc2[nH+]ccc3c2ccn3C)c(O)c1 ZINC001160808181 1132981613 /nfs/dbraw/zinc/98/16/13/1132981613.db2.gz NXMLTPOZUDOHPP-UHFFFAOYSA-N 1 0 281.359 3.508 20 10 CHCDRO Cc1cc(C)c(CNc2cc(C)c(C)c[nH+]2)c(O)c1 ZINC001160811085 1132982832 /nfs/dbraw/zinc/98/28/32/1132982832.db2.gz FDGGJYQJWKSPJT-UHFFFAOYSA-N 1 0 256.349 3.633 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC[C@H]3CCCC[C@H]3C2)c1 ZINC000251167489 1133124656 /nfs/dbraw/zinc/12/46/56/1133124656.db2.gz OTAORSCZHKPULD-CABCVRRESA-N 1 0 259.393 3.713 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C/C=C\c2cccc(F)c2)c1 ZINC001206715342 1133265373 /nfs/dbraw/zinc/26/53/73/1133265373.db2.gz QTSNFVMDRRUEJQ-HYXAFXHYSA-N 1 0 271.335 3.643 20 10 CHCDRO C[C@H]([NH2+]Cc1cc(F)cc2cccnc21)c1ccccc1O ZINC001203536200 1133338248 /nfs/dbraw/zinc/33/82/48/1133338248.db2.gz IKRWFGFEUPHERX-LBPRGKRZSA-N 1 0 296.345 3.930 20 10 CHCDRO COc1ccccc1[C@H](C)[N@H+](C)Cc1ccccc1O ZINC001203558466 1133341067 /nfs/dbraw/zinc/34/10/67/1133341067.db2.gz IFYLIIQVFJRSOQ-ZDUSSCGKSA-N 1 0 271.360 3.594 20 10 CHCDRO COc1ccc(C[NH+]2CCC3(CC[C@H](F)C3)CC2)c(O)c1 ZINC001203629167 1133347047 /nfs/dbraw/zinc/34/70/47/1133347047.db2.gz ROVJGUMLXJRWTM-AWEZNQCLSA-N 1 0 293.382 3.505 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@H+]1C[C@H]2[C@H](CCC2(F)F)C1 ZINC001203652054 1133347267 /nfs/dbraw/zinc/34/72/67/1133347267.db2.gz ZSHXDEXJIMECHR-SKDRFNHKSA-N 1 0 287.737 3.523 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]C2(C3CC3)CCC2)cc1 ZINC001203665554 1133351693 /nfs/dbraw/zinc/35/16/93/1133351693.db2.gz OMFOPMWPFQROMP-HYXAFXHYSA-N 1 0 270.420 3.688 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH+]1CC(c2ccccc2)C1 ZINC001203664291 1133351941 /nfs/dbraw/zinc/35/19/41/1133351941.db2.gz WJFTXBABJHISLN-UHFFFAOYSA-N 1 0 273.763 3.645 20 10 CHCDRO CCCC[N@H+](Cc1ccccc1)Cc1ccc(O)c(O)c1 ZINC001203879397 1133377949 /nfs/dbraw/zinc/37/79/49/1133377949.db2.gz PHMSLLPMSNLIAZ-UHFFFAOYSA-N 1 0 285.387 3.900 20 10 CHCDRO Oc1ccc(C[N@@H+]2CCC[C@H](Cc3ccccc3)C2)cc1O ZINC001203879661 1133377968 /nfs/dbraw/zinc/37/79/68/1133377968.db2.gz WXSBSOSWWQFCOZ-MRXNPFEDSA-N 1 0 297.398 3.553 20 10 CHCDRO CC[N@H+](Cc1cccc(C)c1)Cc1ccccc1O ZINC001203892464 1133381509 /nfs/dbraw/zinc/38/15/09/1133381509.db2.gz NBBXBJPSASPIOV-UHFFFAOYSA-N 1 0 255.361 3.723 20 10 CHCDRO COC1CC[NH+](Cc2ccc(N(C)C)c3ccccc23)CC1 ZINC001204232584 1133422238 /nfs/dbraw/zinc/42/22/38/1133422238.db2.gz FQYHSJZPPWXQRS-UHFFFAOYSA-N 1 0 298.430 3.517 20 10 CHCDRO CN(C)c1ccc(C[NH+]2CC(C)(C)C2)c2ccccc21 ZINC001204234370 1133422292 /nfs/dbraw/zinc/42/22/92/1133422292.db2.gz ZNSLEGKCPMXSKG-UHFFFAOYSA-N 1 0 268.404 3.748 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2C[C@@H]3C[C@@H]3[C@H](F)C2)c2ccccc21 ZINC001204236976 1133422913 /nfs/dbraw/zinc/42/29/13/1133422913.db2.gz ZATNEDKKHYKRLF-JCGIZDLHSA-N 1 0 298.405 3.696 20 10 CHCDRO CC(C)CC[NH+](CCC(C)C)Cc1ccc(O)cc1O ZINC001204277624 1133427360 /nfs/dbraw/zinc/42/73/60/1133427360.db2.gz HDXGKTRBYJMKGY-UHFFFAOYSA-N 1 0 279.424 3.992 20 10 CHCDRO Cc1[nH]c2ccccc2c1C[N@@H+]1CCc2cccc(O)c2C1 ZINC001204292721 1133430565 /nfs/dbraw/zinc/43/05/65/1133430565.db2.gz JOCNUVSWYCKYSP-UHFFFAOYSA-N 1 0 292.382 3.740 20 10 CHCDRO CCCCC1CC[NH+](Cc2cc(O)c(O)c(OC)c2)CC1 ZINC001204347006 1133438393 /nfs/dbraw/zinc/43/83/93/1133438393.db2.gz KQCZQILOFUSTSO-UHFFFAOYSA-N 1 0 293.407 3.509 20 10 CHCDRO Cc1cc(C[N@@H+](C)Cc2ccc(N(C)C)cc2)ccc1F ZINC001205198791 1133545299 /nfs/dbraw/zinc/54/52/99/1133545299.db2.gz QMRMZKBFEVHHRW-UHFFFAOYSA-N 1 0 286.394 3.832 20 10 CHCDRO Oc1cccc2c1CC[C@H]2[NH2+]Cc1ccc(Cl)cc1O ZINC001206005711 1133641092 /nfs/dbraw/zinc/64/10/92/1133641092.db2.gz PPYZQZJMHBUZIM-CQSZACIVSA-N 1 0 289.762 3.528 20 10 CHCDRO CC(C)[C@H]1[N@H+](Cc2cc(F)c(N(C)C)cc2F)CC1(C)C ZINC001206040947 1133646133 /nfs/dbraw/zinc/64/61/33/1133646133.db2.gz QRXYWZJUPQVAHA-MRXNPFEDSA-N 1 0 296.405 3.897 20 10 CHCDRO CCC1(c2ccccc2)C[NH+](Cc2ccc(C)cc2O)C1 ZINC001206225215 1133672453 /nfs/dbraw/zinc/67/24/53/1133672453.db2.gz ZSPSJCDEVJASMF-UHFFFAOYSA-N 1 0 281.399 3.864 20 10 CHCDRO COC[C@H]1CCCC[N@@H+]1Cc1cc(C(C)C)ccc1O ZINC001206271512 1133680069 /nfs/dbraw/zinc/68/00/69/1133680069.db2.gz ZQHFKIROYAKYOV-MRXNPFEDSA-N 1 0 277.408 3.517 20 10 CHCDRO CCCC[C@@H](C)[NH2+]C[C@H](c1ccc(N(C)C)cc1)N(C)C ZINC001207748299 1133845258 /nfs/dbraw/zinc/84/52/58/1133845258.db2.gz IKMQNYJVPMIUKV-CRAIPNDOSA-N 1 0 291.483 3.524 20 10 CHCDRO CC[N@H+](CCCc1ccncc1)Cc1ccc(N(C)C)cc1 ZINC001209188983 1133985080 /nfs/dbraw/zinc/98/50/80/1133985080.db2.gz CEYCEMOUUFLOFD-UHFFFAOYSA-N 1 0 297.446 3.602 20 10 CHCDRO Cc1ccc2[nH]cc(C[N@@H+](C)Cc3ccccc3O)c2c1 ZINC001209495324 1134030023 /nfs/dbraw/zinc/03/00/23/1134030023.db2.gz RTMOGHYKMUVGMY-UHFFFAOYSA-N 1 0 280.371 3.814 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(C[N@H+]2CCOC[C@@H](C)C2)cc1 ZINC001209518977 1134034638 /nfs/dbraw/zinc/03/46/38/1134034638.db2.gz OTZKYTUCSATTKK-HNNXBMFYSA-N 1 0 298.430 3.562 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)Cc1cnc(Cl)cc1C ZINC001209633021 1134045715 /nfs/dbraw/zinc/04/57/15/1134045715.db2.gz FFKKYFQTEICXGH-UHFFFAOYSA-N 1 0 290.794 3.771 20 10 CHCDRO CCc1cc(Nc2cc(C(F)(F)F)ccc2O)cc[nH+]1 ZINC001209980333 1134115681 /nfs/dbraw/zinc/11/56/81/1134115681.db2.gz MWYALUIFQZLSPN-UHFFFAOYSA-N 1 0 282.265 3.534 20 10 CHCDRO C[C@@H]([NH2+]Cc1cc(F)cc(F)c1)c1ccccc1O ZINC000183397823 1134655454 /nfs/dbraw/zinc/65/54/54/1134655454.db2.gz CQTHUPSFYXWGMU-SNVBAGLBSA-N 1 0 263.287 3.521 20 10 CHCDRO O=C1C=CC=CC1=NNc1ccccc1O[C@@H]1CCC[NH2+]C1 ZINC001217961631 1135031422 /nfs/dbraw/zinc/03/14/22/1135031422.db2.gz HFGFXOBVPWABQO-ZIPFOMIPSA-N 1 0 297.358 3.938 20 10 CHCDRO c1ccc(/N=N/c2ccc(O[C@H]3CC[NH2+]C3)cc2)cc1 ZINC001218181184 1135063947 /nfs/dbraw/zinc/06/39/47/1135063947.db2.gz DGYUWTUXBWITDO-RUNIHZNKSA-N 1 0 267.332 3.843 20 10 CHCDRO O=C1C=CC=CC1=NNc1ccccc1O[C@H]1CCC[NH2+]C1 ZINC001218283431 1135078935 /nfs/dbraw/zinc/07/89/35/1135078935.db2.gz HFGFXOBVPWABQO-XEXOPBTESA-N 1 0 297.358 3.938 20 10 CHCDRO C[C@H]1[NH2+]C[C@@H]1Oc1ccc(NN=C2C=CC(=O)C=C2)cc1 ZINC001218391994 1135098613 /nfs/dbraw/zinc/09/86/13/1135098613.db2.gz NUGPGVLCFVCOCG-BZNIZROVSA-N 1 0 283.331 3.547 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]Cc1ccc(C#N)cc1 ZINC000314693419 1135147526 /nfs/dbraw/zinc/14/75/26/1135147526.db2.gz LVYYUDXWELTYSZ-CZUORRHYSA-N 1 0 292.382 3.910 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(F)cc1 ZINC000020095287 170994677 /nfs/dbraw/zinc/99/46/77/170994677.db2.gz QBROXOABHOZPQV-ZDUSSCGKSA-N 1 0 272.367 3.743 20 10 CHCDRO COc1cccc(C[NH2+][C@@H](C)c2ccc(Cl)cc2)c1O ZINC000020121943 171001871 /nfs/dbraw/zinc/00/18/71/171001871.db2.gz RIYAQNSEIKXUBL-NSHDSACASA-N 1 0 291.778 3.905 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@@H](C)c1cccnc1 ZINC000020127809 171013840 /nfs/dbraw/zinc/01/38/40/171013840.db2.gz CURACHQIEXDXDQ-VNHYZAJKSA-N 1 0 282.387 3.995 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]C[C@H](C)c2ccccc2)c1 ZINC000020137300 171024852 /nfs/dbraw/zinc/02/48/52/171024852.db2.gz MEQXPZUOCXBGOY-UONOGXRCSA-N 1 0 285.387 3.855 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2)cc1 ZINC000020146032 171031917 /nfs/dbraw/zinc/03/19/17/171031917.db2.gz NAGVPFLPHBOMSF-OAHLLOKOSA-N 1 0 268.404 3.912 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](C(C)C)N1CCCC1)c1ccccc1O ZINC000020200855 171064710 /nfs/dbraw/zinc/06/47/10/171064710.db2.gz ICJJXKUDPNNBEQ-SJORKVTESA-N 1 0 290.451 3.553 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](C(C)C)N1CCCC1)c1ccccc1O ZINC000020200861 171064930 /nfs/dbraw/zinc/06/49/30/171064930.db2.gz ICJJXKUDPNNBEQ-DLBZAZTESA-N 1 0 290.451 3.553 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(Cl)cc2)c1 ZINC000020209785 171073255 /nfs/dbraw/zinc/07/32/55/171073255.db2.gz SKDXRCNRHCHLMH-LLVKDONJSA-N 1 0 291.778 3.905 20 10 CHCDRO CC(C)CCC[C@H](C)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000037362840 173151704 /nfs/dbraw/zinc/15/17/04/173151704.db2.gz PMYJREVAPHZKBG-AWEZNQCLSA-N 1 0 261.409 3.926 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCCOC1)c1ccc2ccccc2c1O ZINC000038044030 174051366 /nfs/dbraw/zinc/05/13/66/174051366.db2.gz DCWDXJCFMJODSX-KBPBESRZSA-N 1 0 285.387 3.623 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(C)ccc1O)c1ccccc1 ZINC000071409101 176156644 /nfs/dbraw/zinc/15/66/44/176156644.db2.gz FMERCNGCENDTDP-INIZCTEOSA-N 1 0 255.361 3.942 20 10 CHCDRO CC[C@H](COC)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000079758228 260176179 /nfs/dbraw/zinc/17/61/79/260176179.db2.gz AXJILDIAQNQPLA-GXTWGEPZSA-N 1 0 273.376 3.621 20 10 CHCDRO COCC[C@@H](C)[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000152694307 261068320 /nfs/dbraw/zinc/06/83/20/261068320.db2.gz UFZALAKKLDFOJL-CVEARBPZSA-N 1 0 290.451 3.753 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](O)c1ccccc1)c1ccc(N(C)C)cc1 ZINC000153830886 261083456 /nfs/dbraw/zinc/08/34/56/261083456.db2.gz XGQNBEUTKMSXTM-MOPGFXCFSA-N 1 0 298.430 3.527 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2cccc(O)c2)cc1 ZINC000154404999 261090972 /nfs/dbraw/zinc/09/09/72/261090972.db2.gz AWWXITNQTGOBHA-AWEZNQCLSA-N 1 0 284.403 3.699 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cccc(O)c1)c1ccc(N(C)C)cc1 ZINC000154422760 261091557 /nfs/dbraw/zinc/09/15/57/261091557.db2.gz ZVNKDTOZROEVDB-GOSISDBHSA-N 1 0 284.403 3.699 20 10 CHCDRO CC[C@@H]([NH2+]CC(CC)(CC)CCO)c1ccccc1O ZINC000156159790 261115140 /nfs/dbraw/zinc/11/51/40/261115140.db2.gz KULRGVQVBUSKTR-OAHLLOKOSA-N 1 0 279.424 3.622 20 10 CHCDRO CCc1noc(CC)c1C[NH2+][C@H](CC)c1ccccc1O ZINC000156306227 261120229 /nfs/dbraw/zinc/12/02/29/261120229.db2.gz LWUBGRFDRABNOP-CQSZACIVSA-N 1 0 288.391 3.746 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)C[C@H](O)c1ccccc1)c1ccccc1O ZINC000156413825 261123093 /nfs/dbraw/zinc/12/30/93/261123093.db2.gz PZTRCASRBPAFSQ-YJLNNSPDSA-N 1 0 299.414 3.945 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](C)[C@H](C)c2cccnc2)cc1C ZINC000183718278 261986478 /nfs/dbraw/zinc/98/64/78/261986478.db2.gz XZCNTVCGXXUZGQ-CQSZACIVSA-N 1 0 270.376 3.597 20 10 CHCDRO Cc1cncc([C@H](C)[NH2+]Cc2ccc(N3CCCC3)cc2)c1 ZINC000184276596 262014812 /nfs/dbraw/zinc/01/48/12/262014812.db2.gz NNPHZWPABIWWRL-INIZCTEOSA-N 1 0 295.430 3.841 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccccn1)c1cc(Cl)ccc1O ZINC000184845549 262031076 /nfs/dbraw/zinc/03/10/76/262031076.db2.gz JSOIYQYCKJDTOH-MNOVXSKESA-N 1 0 276.767 3.852 20 10 CHCDRO CO[C@@H](C[NH2+][C@H](C)c1cc(C)ccc1O)c1ccccc1 ZINC000185101670 262041249 /nfs/dbraw/zinc/04/12/49/262041249.db2.gz KHZNLPPSRRRSCI-KDOFPFPSSA-N 1 0 285.387 3.739 20 10 CHCDRO COc1cc(C[NH2+][C@H](C)c2ccc(C)cc2O)ccc1C ZINC000185193481 262045286 /nfs/dbraw/zinc/04/52/86/262045286.db2.gz CBANVZDPLCLUNK-CQSZACIVSA-N 1 0 285.387 3.868 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H](C)Cc2ccc(O)cc2)c1 ZINC000185351569 262051936 /nfs/dbraw/zinc/05/19/36/262051936.db2.gz OLWNIBXIKYWFBI-ZIAGYGMSSA-N 1 0 285.387 3.688 20 10 CHCDRO CCc1nc([C@H](C)[NH2+][C@H](C)c2cc(F)ccc2O)cs1 ZINC000185427198 262054281 /nfs/dbraw/zinc/05/42/81/262054281.db2.gz NRBKNZBDTTVXBA-ZJUUUORDSA-N 1 0 294.395 3.962 20 10 CHCDRO Cc1noc(C)c1C[C@@H](C)[NH2+][C@H](C)c1cc(C)ccc1O ZINC000185501281 262056701 /nfs/dbraw/zinc/05/67/01/262056701.db2.gz YVHMUEKIMIWALI-VXGBXAGGSA-N 1 0 288.391 3.587 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2nc(C3CC3)cs2)c1 ZINC000186117304 262079999 /nfs/dbraw/zinc/07/99/99/262079999.db2.gz PPODJHJJHFVDFK-LLVKDONJSA-N 1 0 288.416 3.885 20 10 CHCDRO CCOCCC1(C[NH2+][C@H](C)c2cc(F)ccc2O)CCC1 ZINC000186116184 262080064 /nfs/dbraw/zinc/08/00/64/262080064.db2.gz BGEOGTBAFZNUHF-CYBMUJFWSA-N 1 0 295.398 3.779 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCOC3(CCCC3)C2)c1 ZINC000186129067 262080727 /nfs/dbraw/zinc/08/07/27/262080727.db2.gz FTQATLPYURFWKM-HUUCEWRRSA-N 1 0 289.419 3.843 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCOC3(CCCC3)C2)c(O)c1 ZINC000186129723 262081294 /nfs/dbraw/zinc/08/12/94/262081294.db2.gz YJIVNXFTHZRFDI-LSDHHAIUSA-N 1 0 289.419 3.843 20 10 CHCDRO CCOCCC1(C[NH2+][C@@H](C)c2cc(C)ccc2O)CC1 ZINC000186155254 262081688 /nfs/dbraw/zinc/08/16/88/262081688.db2.gz JHWCCNIMYBBJFA-AWEZNQCLSA-N 1 0 277.408 3.558 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]C[C@H]2CCCC(F)(F)C2)c1 ZINC000282071841 263074162 /nfs/dbraw/zinc/07/41/62/263074162.db2.gz QPKJLBSNKWYQQH-LBPRGKRZSA-N 1 0 299.361 3.706 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1cc(C)ccc1O)c1ccncc1 ZINC000185540878 327840483 /nfs/dbraw/zinc/84/04/83/327840483.db2.gz WDFDXUUCWFLESV-BBRMVZONSA-N 1 0 270.376 3.898 20 10 CHCDRO [O-]c1c(Cl)cccc1C[N@@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000271843426 328198188 /nfs/dbraw/zinc/19/81/88/328198188.db2.gz UHAJFIKNKHNQDO-CQSZACIVSA-N 1 0 276.767 3.711 20 10 CHCDRO Oc1ccccc1C[NH2+][C@H]1C[C@H](c2ccccc2F)C1 ZINC000280743574 328236296 /nfs/dbraw/zinc/23/62/96/328236296.db2.gz XCWZCJLRIRLVMI-HDJSIYSDSA-N 1 0 271.335 3.567 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]C[C@H]1CCC(F)(F)C1 ZINC000281607688 328240268 /nfs/dbraw/zinc/24/02/68/328240268.db2.gz KLQOFDJKUDCROS-VIFPVBQESA-N 1 0 275.726 3.571 20 10 CHCDRO COc1ccc2c(c1)OCC[C@@H]2[NH2+][C@H](C)c1ccccc1O ZINC000378629400 329057178 /nfs/dbraw/zinc/05/71/78/329057178.db2.gz DJZVSASDSGFIDJ-WBMJQRKESA-N 1 0 299.370 3.575 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]CC[C@@H]2CCCOC2)c1O ZINC000527925534 330296441 /nfs/dbraw/zinc/29/64/41/330296441.db2.gz MLGQMLYJFKPDKF-OLZOCXBDSA-N 1 0 297.826 3.821 20 10 CHCDRO COCCC1CC[NH+]([C@@H](C)c2ccc(Cl)cc2O)CC1 ZINC000527935869 330298101 /nfs/dbraw/zinc/29/81/01/330298101.db2.gz MVFAFOWOGABDDX-LBPRGKRZSA-N 1 0 297.826 3.855 20 10 CHCDRO Cc1ncccc1C[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000527983409 330298431 /nfs/dbraw/zinc/29/84/31/330298431.db2.gz AAIXWNOHSNDOJQ-NSHDSACASA-N 1 0 276.767 3.600 20 10 CHCDRO C[C@H]([NH2+][C@H]1[C@@H](C)[C@H](C)O[C@H]1C)c1cc(Cl)ccc1O ZINC000528003896 330300348 /nfs/dbraw/zinc/30/03/48/330300348.db2.gz PBUSEUASCXHYLF-DMZJWBPISA-N 1 0 283.799 3.508 20 10 CHCDRO C[C@H]([NH2+][C@H](c1ccccn1)C1CCC1)c1ccccc1O ZINC000527969833 330301574 /nfs/dbraw/zinc/30/15/74/330301574.db2.gz RUWQXENOIGXSBL-UGSOOPFHSA-N 1 0 282.387 3.979 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)c1ncccc1F)c1ccc(Cl)cc1O ZINC000528038145 330303324 /nfs/dbraw/zinc/30/33/24/330303324.db2.gz QUOCTTLDFXAMFV-UWVGGRQHSA-N 1 0 294.757 3.992 20 10 CHCDRO CCc1cnc(C[NH2+][C@@H](CC)c2ccccc2O)s1 ZINC000156090092 330718922 /nfs/dbraw/zinc/71/89/22/330718922.db2.gz NWGZLTKTQZCPDA-ZDUSSCGKSA-N 1 0 276.405 3.652 20 10 CHCDRO COc1ccc(F)cc1[C@@H](C)[NH2+]Cc1cc(F)ccc1O ZINC000226585233 333265566 /nfs/dbraw/zinc/26/55/66/333265566.db2.gz QPQJHJYOHRTTNR-SNVBAGLBSA-N 1 0 293.313 3.530 20 10 CHCDRO CC[C@@H]([NH2+]CCCc1nccs1)c1ccccc1O ZINC000274967219 334785980 /nfs/dbraw/zinc/78/59/80/334785980.db2.gz XMRCGALYKJNTDE-CYBMUJFWSA-N 1 0 276.405 3.522 20 10 CHCDRO CCC[C@H](CCO)C[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000280224673 521094905 /nfs/dbraw/zinc/09/49/05/521094905.db2.gz UYVYKWDNNNPRMT-ZBFHGGJFSA-N 1 0 279.424 3.540 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](C)C2CCC(F)(F)CC2)c1 ZINC000290262285 521141106 /nfs/dbraw/zinc/14/11/06/521141106.db2.gz WUOKCAXMEVGTDX-UHFFFAOYSA-N 1 0 299.361 3.801 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](C)[C@@H](C)c2ccco2)c1 ZINC000131125370 521144296 /nfs/dbraw/zinc/14/42/96/521144296.db2.gz KFYFXAUVSBQIAW-LBPRGKRZSA-N 1 0 275.348 3.577 20 10 CHCDRO CCC[C@H]([NH2+][C@H](C)c1ccccc1O)[C@@H](O)c1ccccc1 ZINC000279999928 521175447 /nfs/dbraw/zinc/17/54/47/521175447.db2.gz FXIVTEMKRQUFPM-LJHODMEESA-N 1 0 299.414 3.945 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H](C)c2cc(F)ccc2O)c1 ZINC000094617617 521372171 /nfs/dbraw/zinc/37/21/71/521372171.db2.gz YAZKKVJERGBGNC-LBPRGKRZSA-N 1 0 289.350 3.781 20 10 CHCDRO CCCc1nc(C)c(C[NH2+][C@@H](C)c2ccc(C)cc2O)o1 ZINC000293276061 521498400 /nfs/dbraw/zinc/49/84/00/521498400.db2.gz CPJZUDLYWUNRLG-LBPRGKRZSA-N 1 0 288.391 3.800 20 10 CHCDRO CCOC(CC[NH2+][C@H](CC)c1ccc(C)cc1O)OCC ZINC000279932905 521629705 /nfs/dbraw/zinc/62/97/05/521629705.db2.gz ATTIUQZOHMNDBC-OAHLLOKOSA-N 1 0 295.423 3.531 20 10 CHCDRO CCSCC[C@@H](C)[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000297909352 521713875 /nfs/dbraw/zinc/71/38/75/521713875.db2.gz WPELOYYUNPNNMW-DGCLKSJQSA-N 1 0 265.422 3.501 20 10 CHCDRO CC[C@@H](CCO)C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000094936316 522509650 /nfs/dbraw/zinc/50/96/50/522509650.db2.gz BAEKVJVUDXQGJY-KGLIPLIRSA-N 1 0 287.403 3.605 20 10 CHCDRO CC[C@H]([NH2+]CC[C@H]1CCO[C@@H](C)C1)c1ccc(C)cc1O ZINC000280288068 522599410 /nfs/dbraw/zinc/59/94/10/522599410.db2.gz ZATOHAIZAJOIRU-ZOBUZTSGSA-N 1 0 291.435 3.947 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(OC)cc1)c1ccc(C)cc1O ZINC000280159013 522648140 /nfs/dbraw/zinc/64/81/40/522648140.db2.gz QQLRWPMSYYNFDQ-KRWDZBQOSA-N 1 0 285.387 3.950 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)[C@@H]1CCCCO1)c1ccc(C)cc1O ZINC000280276149 522692953 /nfs/dbraw/zinc/69/29/53/522692953.db2.gz YFHPSYOGWGQRQU-QRTARXTBSA-N 1 0 277.408 3.699 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1[C@@H]2CCO[C@H]2C1(C)C)c1ccc(C)cc1O ZINC000280241345 522727528 /nfs/dbraw/zinc/72/75/28/522727528.db2.gz VZZWYIJTPPGMRU-XJNFMUPTSA-N 1 0 289.419 3.555 20 10 CHCDRO CC[C@@H]([NH2+]C1CC(F)(F)C1)c1ccc(C)cc1O ZINC000280235628 522808139 /nfs/dbraw/zinc/80/81/39/522808139.db2.gz VOTKALGEXANAQA-GFCCVEGCSA-N 1 0 255.308 3.539 20 10 CHCDRO CO[C@@H](C[NH2+]Cc1ccccc1O)c1ccc(Cl)cc1 ZINC000266174631 523537260 /nfs/dbraw/zinc/53/72/60/523537260.db2.gz SLLYNHSUTOEVPZ-INIZCTEOSA-N 1 0 291.778 3.523 20 10 CHCDRO Cc1cccc(C[N@@H+](C)C2CCC(F)(F)CC2)c1O ZINC000290222481 524376438 /nfs/dbraw/zinc/37/64/38/524376438.db2.gz RVLCFFUYJTWKCK-UHFFFAOYSA-N 1 0 269.335 3.710 20 10 CHCDRO C[C@H](Cc1ccsc1)[NH2+]Cc1cc(Cl)ccc1O ZINC000049154916 524762147 /nfs/dbraw/zinc/76/21/47/524762147.db2.gz VBYXZGGIELBVNE-SNVBAGLBSA-N 1 0 281.808 3.828 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H]2CCC[C@H](C(F)(F)F)C2)c1 ZINC000071407915 525355676 /nfs/dbraw/zinc/35/56/76/525355676.db2.gz WMPYGTADAPGMGI-STQMWFEESA-N 1 0 287.325 3.911 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccccc2C)c(O)c1 ZINC000037718943 525733753 /nfs/dbraw/zinc/73/37/53/525733753.db2.gz BEIWNBGOGDYSRP-CQSZACIVSA-N 1 0 255.361 3.860 20 10 CHCDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]C[C@@H]1CCCOC1 ZINC000263717965 526337427 /nfs/dbraw/zinc/33/74/27/526337427.db2.gz VOKGZEMVFJKBAP-HNNXBMFYSA-N 1 0 297.398 3.575 20 10 CHCDRO Oc1ccccc1C[NH2+][C@@H]1CCSc2ccccc21 ZINC000037128026 526373901 /nfs/dbraw/zinc/37/39/01/526373901.db2.gz FILHRTJBUYWXPE-CQSZACIVSA-N 1 0 271.385 3.719 20 10 CHCDRO CCOc1cccc(C[N@H+](C)[C@@H](C)CCSCC)c1O ZINC000093870952 1120892370 /nfs/dbraw/zinc/89/23/70/1120892370.db2.gz YHOZVIJTDHBBNO-ZDUSSCGKSA-N 1 0 297.464 3.754 20 10 CHCDRO CC[C@@H]([NH2+]CCN(CC)C1CC1)c1cc(Cl)ccc1O ZINC000775499413 1122627905 /nfs/dbraw/zinc/62/79/05/1122627905.db2.gz CXYKKNBNAREFLU-OAHLLOKOSA-N 1 0 296.842 3.571 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CC2SCCS2)cc1 ZINC000850560777 1123291931 /nfs/dbraw/zinc/29/19/31/1123291931.db2.gz OJZNFLUIYOZDIC-LBPRGKRZSA-N 1 0 296.505 3.599 20 10 CHCDRO CC[N@H+](Cc1cc(C)cs1)Cc1ccccc1O ZINC001137158008 1125287575 /nfs/dbraw/zinc/28/75/75/1125287575.db2.gz ACLHQJHHGYFBNB-UHFFFAOYSA-N 1 0 261.390 3.784 20 10 CHCDRO CC[C@H]([NH2+]CC1(CC)COC1)c1cc(Cl)ccc1O ZINC000834898464 1131721699 /nfs/dbraw/zinc/72/16/99/1131721699.db2.gz DKSLDMJLUYGHQY-ZDUSSCGKSA-N 1 0 283.799 3.513 20 10 CHCDRO Cc1cc(O)c(CN2CC[C@](C)(F)[C@H](F)C2)cc1Cl ZINC001231868666 1132385119 /nfs/dbraw/zinc/38/51/19/1132385119.db2.gz VZFCSVJBRITMFE-KGLIPLIRSA-N 1 0 289.753 3.626 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@](C)(F)C2)cc1Cl ZINC001231867380 1132383124 /nfs/dbraw/zinc/38/31/24/1132383124.db2.gz JVZQMAKZWOXEEY-CQSZACIVSA-N 1 0 271.763 3.678 20 10 CHCDRO CCC[C@@H](C[NH2+]Cc1cc(C(C)C)ccc1O)OCC ZINC001206800729 1133750204 /nfs/dbraw/zinc/75/02/04/1133750204.db2.gz MAYAASFNMUOICZ-INIZCTEOSA-N 1 0 279.424 3.810 20 10 CHCDRO COc1ccc(CC[C@@H](C)[NH2+]Cc2ccccc2O)cc1 ZINC000134230736 1125543949 /nfs/dbraw/zinc/54/39/49/1125543949.db2.gz CPEGTZYRARTYBP-CQSZACIVSA-N 1 0 285.387 3.512 20 10 CHCDRO C[C@H](Cc1ccco1)[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841743610 1125568869 /nfs/dbraw/zinc/56/88/69/1125568869.db2.gz IRSLPNZIVHZYNZ-GHMZBOCLSA-N 1 0 279.767 3.920 20 10 CHCDRO CCCC[NH2+][C@@H](C)c1cc(Br)ccc1O ZINC000134902527 1125569987 /nfs/dbraw/zinc/56/99/87/1125569987.db2.gz OFNOMJZINCGGQB-VIFPVBQESA-N 1 0 272.186 3.605 20 10 CHCDRO Oc1c(C[NH2+]C[C@@H]2CC[C@@H](C3CC3)O2)ccc2ccccc21 ZINC000897506279 1125595846 /nfs/dbraw/zinc/59/58/46/1125595846.db2.gz XSZMREPTMKWGHU-WMZOPIPTSA-N 1 0 297.398 3.593 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]Cc1cscc1Cl)CC2 ZINC000886657837 1125703367 /nfs/dbraw/zinc/70/33/67/1125703367.db2.gz FVWNUGAXXCZVMV-GFCCVEGCSA-N 1 0 279.792 3.884 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CCC[C@@H]2CCCC[C@H]21 ZINC000300415979 1125719955 /nfs/dbraw/zinc/71/99/55/1125719955.db2.gz AWPDXFIRAFBXBC-SWLSCSKDSA-N 1 0 263.356 3.686 20 10 CHCDRO CCOCCC1(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)CC1 ZINC000090722850 1125745237 /nfs/dbraw/zinc/74/52/37/1125745237.db2.gz IEOJUDOJUCCYBD-HNNXBMFYSA-N 1 0 290.451 3.610 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@@H](C)CCC=C(C)C)c1 ZINC000089726260 1129249786 /nfs/dbraw/zinc/24/97/86/1129249786.db2.gz ZRXNYBSLTTVHLX-ZDUSSCGKSA-N 1 0 263.381 3.625 20 10 CHCDRO Oc1ccc(Br)cc1C[N@@H+]1CCC[C@H]1C1CC1 ZINC000769328507 1129902564 /nfs/dbraw/zinc/90/25/64/1129902564.db2.gz JBUIZISCSBMMOK-ZDUSSCGKSA-N 1 0 296.208 3.529 20 10 CHCDRO COc1ccc([C@@H](C)[NH2+]Cc2ccc(OC)c(C)c2)cc1 ZINC000088218642 1129200035 /nfs/dbraw/zinc/20/00/35/1129200035.db2.gz ONXSAULWLBCOAS-CQSZACIVSA-N 1 0 285.387 3.863 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2cncs2)c1 ZINC000903312759 1130152121 /nfs/dbraw/zinc/15/21/21/1130152121.db2.gz YOBWFOSZOPBKEN-GHMZBOCLSA-N 1 0 262.378 3.569 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)Cc2ccc(F)cc2)cc1 ZINC000302741692 1126740813 /nfs/dbraw/zinc/74/08/13/1126740813.db2.gz QSFHACIYCLTDHF-UHFFFAOYSA-N 1 0 272.367 3.524 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H](C)CCc2ccc(O)cc2)c1O ZINC000158133915 1126747536 /nfs/dbraw/zinc/74/75/36/1126747536.db2.gz ZFUYNZLUQKAGHS-AWEZNQCLSA-N 1 0 285.387 3.517 20 10 CHCDRO C[C@@H]([NH2+]Cc1cccnc1)c1ccc(N2CCCCC2)cc1 ZINC000151099438 1126750452 /nfs/dbraw/zinc/75/04/52/1126750452.db2.gz GQRWYARACBTFJC-MRXNPFEDSA-N 1 0 295.430 3.923 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccoc1)c1ccc(N(C)C)cc1 ZINC000178475628 1126814611 /nfs/dbraw/zinc/81/46/11/1126814611.db2.gz OJUCYSYRKNRJAN-MRXNPFEDSA-N 1 0 258.365 3.587 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[NH2+][C@H]1CC[C@@H]1C1CC1 ZINC000797905576 1126823803 /nfs/dbraw/zinc/82/38/03/1126823803.db2.gz NJMLXSAOYAWIPT-MSOLQXFVSA-N 1 0 270.420 3.565 20 10 CHCDRO CCc1nc(C)c([C@@H](C)[N@H+](C)Cc2ccccc2O)s1 ZINC000179579021 1126831201 /nfs/dbraw/zinc/83/12/01/1126831201.db2.gz ZPWFWTKPFRQMPP-GFCCVEGCSA-N 1 0 290.432 3.913 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCCOc2ccccc21)c1ccccc1O ZINC000183475579 1126887635 /nfs/dbraw/zinc/88/76/35/1126887635.db2.gz FVTLYRJLIXAYPS-CZUORRHYSA-N 1 0 283.371 3.957 20 10 CHCDRO CCOCCC1(C[NH2+][C@@H](C)c2ccccc2O)CCC1 ZINC000183618949 1126889270 /nfs/dbraw/zinc/88/92/70/1126889270.db2.gz VMXILMKYMFPCNH-AWEZNQCLSA-N 1 0 277.408 3.640 20 10 CHCDRO COc1cc(C)cc(C[NH2+][C@H](C)c2ccccc2O)c1 ZINC000183626253 1126889305 /nfs/dbraw/zinc/88/93/05/1126889305.db2.gz PWNFHSKSNOFJAT-CYBMUJFWSA-N 1 0 271.360 3.560 20 10 CHCDRO C[C@H]([NH2+]C1(c2ccccc2F)CC1)c1ccccc1O ZINC000183660970 1126890105 /nfs/dbraw/zinc/89/01/05/1126890105.db2.gz CMAPTBVBYUDBKH-LBPRGKRZSA-N 1 0 271.335 3.871 20 10 CHCDRO Cc1cccc(C[NH2+]Cc2ccc(C(F)F)cc2)c1O ZINC000184987472 1126898284 /nfs/dbraw/zinc/89/82/84/1126898284.db2.gz VASGFNAXUGYBFU-UHFFFAOYSA-N 1 0 277.314 3.928 20 10 CHCDRO COC(C)(C)C[C@@H](C)[NH2+][C@H](C)c1ccc(C)cc1O ZINC000185564776 1126900559 /nfs/dbraw/zinc/90/05/59/1126900559.db2.gz BTCXRNYNKLCSOK-CHWSQXEVSA-N 1 0 265.397 3.555 20 10 CHCDRO COc1ccc(F)cc1C[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000187596937 1126912070 /nfs/dbraw/zinc/91/20/70/1126912070.db2.gz BIQNXPJNHNYTAJ-LBPRGKRZSA-N 1 0 289.350 3.699 20 10 CHCDRO CCC[N@H+](Cc1cncc(C)c1)Cc1ccccc1O ZINC000189908189 1126935720 /nfs/dbraw/zinc/93/57/20/1126935720.db2.gz SCXGYBMXCHOXPK-UHFFFAOYSA-N 1 0 270.376 3.508 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H](C)c2cccc(O)c2)cc1C ZINC000195454885 1126979965 /nfs/dbraw/zinc/97/99/65/1126979965.db2.gz GFZCVEPPXPIBFX-ZDUSSCGKSA-N 1 0 271.360 3.565 20 10 CHCDRO COC[C@H]1CC[N@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000271154576 1127070596 /nfs/dbraw/zinc/07/05/96/1127070596.db2.gz CLUVRJSJXMCSOG-HNNXBMFYSA-N 1 0 297.398 3.528 20 10 CHCDRO COC[C@@H]1CC[N@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000271154579 1127071395 /nfs/dbraw/zinc/07/13/95/1127071395.db2.gz CLUVRJSJXMCSOG-OAHLLOKOSA-N 1 0 297.398 3.528 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(N2CCSCC2)cc1)C1CC1 ZINC000163632603 1127126267 /nfs/dbraw/zinc/12/62/67/1127126267.db2.gz YDBSIQJFVIPKBY-QGZVFWFLSA-N 1 0 290.476 3.518 20 10 CHCDRO Cc1cc(NCc2ccccc2O)c2ccccc2[nH+]1 ZINC000163770424 1127142875 /nfs/dbraw/zinc/14/28/75/1127142875.db2.gz HENUQCURZHZJCK-UHFFFAOYSA-N 1 0 264.328 3.861 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CCCCOC(C)C)c(O)c1 ZINC000285165737 1127218500 /nfs/dbraw/zinc/21/85/00/1127218500.db2.gz MRYWZKHDMZGURD-OAHLLOKOSA-N 1 0 279.424 3.865 20 10 CHCDRO COCCC(C)(C)C[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000285462797 1127230366 /nfs/dbraw/zinc/23/03/66/1127230366.db2.gz ZZPAEEPIMQKFGQ-CQSZACIVSA-N 1 0 279.424 3.722 20 10 CHCDRO COC[C@H]([NH2+]Cc1ccccc1O)c1cccc(Cl)c1 ZINC000288570703 1127347983 /nfs/dbraw/zinc/34/79/83/1127347983.db2.gz NAYZACXIVROLTC-HNNXBMFYSA-N 1 0 291.778 3.523 20 10 CHCDRO CC(C)C[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000167344416 1127355121 /nfs/dbraw/zinc/35/51/21/1127355121.db2.gz GNSAFXNAGDMMMS-UHFFFAOYSA-N 1 0 274.330 3.517 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CC(C)(C)OC1(C)C)c1ccccc1O ZINC000157881558 1127401092 /nfs/dbraw/zinc/40/10/92/1127401092.db2.gz OATQJUNYPQJBKZ-ZFWWWQNUSA-N 1 0 277.408 3.779 20 10 CHCDRO Cc1cccc(C[NH2+]CC(C)(C)c2ccccc2)c1O ZINC000158103255 1127436933 /nfs/dbraw/zinc/43/69/33/1127436933.db2.gz ILUDZAYMWIVCGL-UHFFFAOYSA-N 1 0 269.388 3.768 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CC[C@H]2CCCCO2)cc1 ZINC000227336364 1127471376 /nfs/dbraw/zinc/47/13/76/1127471376.db2.gz MDFZZCJXALLNLV-GOSISDBHSA-N 1 0 290.451 3.582 20 10 CHCDRO CCc1noc(C)c1C[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000293835229 1127523769 /nfs/dbraw/zinc/52/37/69/1127523769.db2.gz XJWORSYINMPQFR-GFCCVEGCSA-N 1 0 288.391 3.719 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+][C@H]2CCCC[C@@H]2C)c1O ZINC000228669739 1127582656 /nfs/dbraw/zinc/58/26/56/1127582656.db2.gz GCLKTHRNRQOHNM-GWCFXTLKSA-N 1 0 283.799 3.723 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1OCCc2ccccc21)c1ccccc1O ZINC000362488599 1127638995 /nfs/dbraw/zinc/63/89/95/1127638995.db2.gz RVMJOJRSDLWNFO-IEBWSBKVSA-N 1 0 297.398 3.747 20 10 CHCDRO CCCOc1ccc(C[NH2+][C@@H]2CCc3cccc(O)c32)cc1 ZINC000296179934 1127664599 /nfs/dbraw/zinc/66/45/99/1127664599.db2.gz YCKKOGXNESKNFQ-QGZVFWFLSA-N 1 0 297.398 3.958 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CCc3cc(F)ccc3C2)cc1C ZINC001168415399 1127673331 /nfs/dbraw/zinc/67/33/31/1127673331.db2.gz PKIBXOTUQNBCDR-GOSISDBHSA-N 1 0 299.389 3.790 20 10 CHCDRO C[C@@H]1C[C@@H]([NH2+][C@H]2CCc3cccc(O)c32)c2ccccc2O1 ZINC000296658045 1127681061 /nfs/dbraw/zinc/68/10/61/1127681061.db2.gz ZMMHMXLNFWCFPT-UHOFOFEASA-N 1 0 295.382 3.881 20 10 CHCDRO C[C@@H]([NH2+]CC(C)(C)c1ccccn1)c1cc(F)ccc1O ZINC000297397447 1127695159 /nfs/dbraw/zinc/69/51/59/1127695159.db2.gz SGIOGEVEGWKLAQ-GFCCVEGCSA-N 1 0 288.366 3.555 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1cn[nH]c1)c1ccc2ccccc2c1O ZINC000230669591 1127771082 /nfs/dbraw/zinc/77/10/82/1127771082.db2.gz DCYVUZTYZJFNJR-NWDGAFQWSA-N 1 0 281.359 3.680 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]C[C@H]2CCC[C@H]2C)c1O ZINC000230659109 1127771519 /nfs/dbraw/zinc/77/15/19/1127771519.db2.gz KPIBWMDBRLKETC-GHMZBOCLSA-N 1 0 283.799 3.580 20 10 CHCDRO CCOc1cccc(C[NH2+]CC(CC)(CC)SC)c1O ZINC000230708368 1127772237 /nfs/dbraw/zinc/77/22/37/1127772237.db2.gz VOXFYMSCAHBFBT-UHFFFAOYSA-N 1 0 297.464 3.802 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CCC[C@H]3CCC[C@@H]32)c1O ZINC000230929810 1127784695 /nfs/dbraw/zinc/78/46/95/1127784695.db2.gz SKMCTMWNNIIWDB-RISCZKNCSA-N 1 0 295.810 3.819 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CC(C)(C)CCOC)cc1 ZINC000230867675 1127784977 /nfs/dbraw/zinc/78/49/77/1127784977.db2.gz TVUVSNDCCBCZLN-UHFFFAOYSA-N 1 0 292.467 3.685 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)CC(F)(F)F)c1 ZINC000231790777 1127854139 /nfs/dbraw/zinc/85/41/39/1127854139.db2.gz HGPXKSMSXYSZBR-ZJUUUORDSA-N 1 0 261.287 3.692 20 10 CHCDRO CCc1ccccc1C[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000312843477 1128093889 /nfs/dbraw/zinc/09/38/89/1128093889.db2.gz PIPXMSCTTJTAOY-MRXNPFEDSA-N 1 0 267.372 3.732 20 10 CHCDRO C[C@@H]([NH2+]CC1CCC1)c1ccc(Br)cc1O ZINC000134915748 1128127951 /nfs/dbraw/zinc/12/79/51/1128127951.db2.gz PBIOQWHIFSGTSP-SECBINFHSA-N 1 0 284.197 3.605 20 10 CHCDRO C[C@@H]1CCC[C@H]([NH2+]Cc2cc(Cl)ccc2O)[C@H]1C ZINC000252180554 1128129823 /nfs/dbraw/zinc/12/98/23/1128129823.db2.gz PYNDCJHKCHYMQX-SUNKGSAMSA-N 1 0 267.800 3.960 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]C[C@@H]1CCCCC1(F)F)CC2 ZINC000297211822 1129225273 /nfs/dbraw/zinc/22/52/73/1129225273.db2.gz GRNLYSRGFRLSDI-STQMWFEESA-N 1 0 281.346 3.795 20 10 CHCDRO C[C@H]1C[C@H]([NH2+]Cc2ccc(N(C)C)cc2)C[C@@H](C)C1 ZINC000252211370 1128187519 /nfs/dbraw/zinc/18/75/19/1128187519.db2.gz YEXOPWGKLGSNMO-FOLVSLTJSA-N 1 0 260.425 3.667 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc3c(c2)C[C@H](C)O3)c1 ZINC000926921004 1128203303 /nfs/dbraw/zinc/20/33/03/1128203303.db2.gz UHTQUZNACPOKPS-UONOGXRCSA-N 1 0 297.398 3.875 20 10 CHCDRO Cc1cnc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)c(C)c1 ZINC000926954264 1128205967 /nfs/dbraw/zinc/20/59/67/1128205967.db2.gz IXGKTIHVRKSMKF-OAHLLOKOSA-N 1 0 283.419 3.615 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCCC2(CCC2)O1)c1ccccc1O ZINC000927016791 1128208369 /nfs/dbraw/zinc/20/83/69/1128208369.db2.gz KZRQOFWMIKXVLQ-KBPBESRZSA-N 1 0 275.392 3.535 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](C2CC2)[C@@H]2CCCOC2)c(O)c1 ZINC000927069476 1128215569 /nfs/dbraw/zinc/21/55/69/1128215569.db2.gz MZIWWHFHWUWBIW-JOQOYGCGSA-N 1 0 289.419 3.556 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C1CC1)[C@@H]1CCCOC1)c1ccccc1O ZINC000927069898 1128215812 /nfs/dbraw/zinc/21/58/12/1128215812.db2.gz ODOTZMVWJSCACP-HFTRVMKXSA-N 1 0 289.419 3.638 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CC(C)(C)OC2(C)C)c1 ZINC000927099174 1128217466 /nfs/dbraw/zinc/21/74/66/1128217466.db2.gz ARHJSROEALQHRU-ZIAGYGMSSA-N 1 0 291.435 3.945 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC[C@H]2CCC3(CCC3)O2)c(O)c1 ZINC000927128864 1128220639 /nfs/dbraw/zinc/22/06/39/1128220639.db2.gz MZUZQGZIZDTFIB-HUUCEWRRSA-N 1 0 289.419 3.843 20 10 CHCDRO CC[C@@H](c1ccccc1OC)[N@H+](C)Cc1ccccc1O ZINC000777824833 1128288233 /nfs/dbraw/zinc/28/82/33/1128288233.db2.gz HNARFBUSBHDNGF-INIZCTEOSA-N 1 0 285.387 3.984 20 10 CHCDRO CCCN(CCC)c1ccc(C[NH2+]C(C)(C)[C@H](C)O)cc1 ZINC000762627766 1128311703 /nfs/dbraw/zinc/31/17/03/1128311703.db2.gz IFZVPVSBMKZPCG-HNNXBMFYSA-N 1 0 292.467 3.562 20 10 CHCDRO CSc1ccccc1[C@@H](C)[NH2+]Cc1ccccc1O ZINC000282129111 1128376007 /nfs/dbraw/zinc/37/60/07/1128376007.db2.gz VKRPNNZUZHWYFC-GFCCVEGCSA-N 1 0 273.401 3.965 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+][C@H](C(C)C)C2CC2)c1O ZINC000324570093 1128387309 /nfs/dbraw/zinc/38/73/09/1128387309.db2.gz VAEYBPIZIWWYOF-CQSZACIVSA-N 1 0 283.799 3.578 20 10 CHCDRO COc1ccc2ccc(O)c(C[N@@H+]3CC[C@@H](C4CC4)C3)c2c1 ZINC000763330283 1128392203 /nfs/dbraw/zinc/39/22/03/1128392203.db2.gz CGFXEVZJZVTYEO-OAHLLOKOSA-N 1 0 297.398 3.786 20 10 CHCDRO CCC[N@H+](Cc1ccc(C)nc1)Cc1ccccc1O ZINC000153810463 1128402988 /nfs/dbraw/zinc/40/29/88/1128402988.db2.gz LIBWBWRDIHVCGX-UHFFFAOYSA-N 1 0 270.376 3.508 20 10 CHCDRO CCC[C@H](C)CC[C@@H](C)[NH2+]CCc1ccc(O)c(O)c1 ZINC001257466692 1128453861 /nfs/dbraw/zinc/45/38/61/1128453861.db2.gz FEVAIQICHYQQEU-UONOGXRCSA-N 1 0 279.424 3.835 20 10 CHCDRO c1csc([C@@H]([NH2+]Cc2ccc3c(c2)CCO3)C2CC2)c1 ZINC000917394107 1128497230 /nfs/dbraw/zinc/49/72/30/1128497230.db2.gz QJQUXXLLPRENDN-KRWDZBQOSA-N 1 0 285.412 3.924 20 10 CHCDRO C[C@@H]1CC[C@]2(CC[N@H+](Cc3c(O)ccc4ccncc43)C2)C1 ZINC000781585509 1128569082 /nfs/dbraw/zinc/56/90/82/1128569082.db2.gz GOYDXGNFMNBJGY-KUHUBIRLSA-N 1 0 296.414 3.953 20 10 CHCDRO COc1cc(C[N@@H+]2CC[C@]3(CC[C@H](C)C3)C2)c(O)cc1C ZINC000781587665 1128574109 /nfs/dbraw/zinc/57/41/09/1128574109.db2.gz RANHMXZFQDTQKD-UGSOOPFHSA-N 1 0 289.419 3.721 20 10 CHCDRO CCCC[C@@H](COC)[NH2+][C@H](CC)c1ccccc1O ZINC000155902454 1128618576 /nfs/dbraw/zinc/61/85/76/1128618576.db2.gz QGRVAMHXXVSULJ-DZGCQCFKSA-N 1 0 265.397 3.638 20 10 CHCDRO C[N@H+](Cc1ccc(Cl)s1)Cc1cc(F)ccc1O ZINC000778994374 1128674392 /nfs/dbraw/zinc/67/43/92/1128674392.db2.gz CFRKPZJWQYMFHJ-UHFFFAOYSA-N 1 0 285.771 3.878 20 10 CHCDRO Cc1cc(Br)cc([C@@H](C)[NH2+]C2CC=CC2)c1O ZINC000779026838 1128688881 /nfs/dbraw/zinc/68/88/81/1128688881.db2.gz GQKOFKQISRHRBQ-SNVBAGLBSA-N 1 0 296.208 3.832 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]Cc2ccc(C)o2)cc1 ZINC000048327007 1128699516 /nfs/dbraw/zinc/69/95/16/1128699516.db2.gz GIELCGLUGHNVHZ-UHFFFAOYSA-N 1 0 272.392 3.724 20 10 CHCDRO COc1ccc([C@H]([NH2+]Cc2ccccc2O)C2CC2)cc1 ZINC000134225762 1128706048 /nfs/dbraw/zinc/70/60/48/1128706048.db2.gz YDMCFWNBUQBXFE-GOSISDBHSA-N 1 0 283.371 3.642 20 10 CHCDRO COc1ccc(CN[C@@H](C)c2ncc(C)s2)cc1C ZINC000134905627 1128713217 /nfs/dbraw/zinc/71/32/17/1128713217.db2.gz UGHBJNFDDFCKFA-LBPRGKRZSA-N 1 0 276.405 3.619 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCC[C@@H]1CCO)c1cc(Cl)ccc1O ZINC000779089654 1128727144 /nfs/dbraw/zinc/72/71/44/1128727144.db2.gz VDXZVYGFVZWRIV-BYCMXARLSA-N 1 0 297.826 3.637 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCCNc2ccccc2)c(O)c1 ZINC000185489510 1117827745 /nfs/dbraw/zinc/82/77/45/1117827745.db2.gz AUQTWDZVZXLAOQ-OAHLLOKOSA-N 1 0 284.403 3.853 20 10 CHCDRO CCCC[C@@H](COC)[NH2+][C@H](C)c1ccc(C)cc1O ZINC000185494670 1117829651 /nfs/dbraw/zinc/82/96/51/1117829651.db2.gz ZYCGQRNFRUQWIF-KGLIPLIRSA-N 1 0 265.397 3.556 20 10 CHCDRO CCO[C@@H]1C[C@H]([NH2+][C@@H](C)c2ccc(C)cc2O)C12CCC2 ZINC000185551616 1117844957 /nfs/dbraw/zinc/84/49/57/1117844957.db2.gz DQXOMZZTRKUNTH-RRQGHBQHSA-N 1 0 289.419 3.699 20 10 CHCDRO CC(C)=CC[N@H+](Cc1ccco1)Cc1ccccc1O ZINC000072952731 1117852871 /nfs/dbraw/zinc/85/28/71/1117852871.db2.gz LDRKQQUKOLAGKE-UHFFFAOYSA-N 1 0 271.360 3.954 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@H]2C2CCC2)cc1C ZINC000728199986 1117868976 /nfs/dbraw/zinc/86/89/76/1117868976.db2.gz OUZUVQLZWMWYBG-MRXNPFEDSA-N 1 0 259.393 3.774 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H](CCO)C2CCCCC2)c(O)c1 ZINC000185829216 1117913869 /nfs/dbraw/zinc/91/38/69/1117913869.db2.gz ADJGUEVBYKQSQR-PBHICJAKSA-N 1 0 291.435 3.683 20 10 CHCDRO C[C@@H]([NH2+][C@H](CCO)C1CCCCC1)c1cc(F)ccc1O ZINC000185829593 1117914086 /nfs/dbraw/zinc/91/40/86/1117914086.db2.gz PVQRICXYYLIYQF-MLGOLLRUSA-N 1 0 295.398 3.513 20 10 CHCDRO C[C@H]1CCCC[N@H+](Cc2cc(Br)ccc2O)C1 ZINC000705477090 1117973347 /nfs/dbraw/zinc/97/33/47/1117973347.db2.gz LJZWTYPWCPJRRZ-NSHDSACASA-N 1 0 298.224 3.777 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H](C)Oc2ccccc2)c(O)c1 ZINC000186041090 1117974912 /nfs/dbraw/zinc/97/49/12/1117974912.db2.gz JJJJHWJPLZTNNC-GJZGRUSLSA-N 1 0 285.387 3.819 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000179575801 1128747836 /nfs/dbraw/zinc/74/78/36/1128747836.db2.gz MTJPDPXSBOJCMI-QGZVFWFLSA-N 1 0 257.377 3.715 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)c2ccccc2)cc1C ZINC000035052572 1117992331 /nfs/dbraw/zinc/99/23/31/1117992331.db2.gz FLENQNQJJDNCLO-CQSZACIVSA-N 1 0 255.361 3.854 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2ccccc2O)[C@H](c2ccco2)C1 ZINC000179582876 1128748565 /nfs/dbraw/zinc/74/85/65/1128748565.db2.gz OCOGKZNCGYAXLV-HIFRSBDPSA-N 1 0 271.360 3.958 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@H](C)c2ccccc2O)c1 ZINC000037771113 1118038070 /nfs/dbraw/zinc/03/80/70/1118038070.db2.gz OAOKAGQRUFATSS-CHWSQXEVSA-N 1 0 271.360 3.813 20 10 CHCDRO COCCC[N@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000179646626 1128752493 /nfs/dbraw/zinc/75/24/93/1128752493.db2.gz DSALDWSMZQOSCQ-MRXNPFEDSA-N 1 0 299.414 3.992 20 10 CHCDRO C[C@@H]1CC[C@H](C)C[N@H+]1Cc1cc(Cl)ccc1O ZINC000211564861 1118074735 /nfs/dbraw/zinc/07/47/35/1118074735.db2.gz DIVBQGAHOYJBMM-WDEREUQCSA-N 1 0 253.773 3.666 20 10 CHCDRO COc1ccccc1C[N@H+](Cc1cccc(C)c1O)C1CC1 ZINC000179679387 1128754070 /nfs/dbraw/zinc/75/40/70/1128754070.db2.gz YTEYLIFZOXYBOY-UHFFFAOYSA-N 1 0 297.398 3.874 20 10 CHCDRO Cc1ccc(OCC[NH2+][C@H](C)c2ccc(N(C)C)cc2)cc1 ZINC000764591644 1118101324 /nfs/dbraw/zinc/10/13/24/1118101324.db2.gz YEGDWGSITLWOJM-MRXNPFEDSA-N 1 0 298.430 3.791 20 10 CHCDRO COc1ccc(C[NH2+]Cc2c(O)cccc2Cl)c(C)c1 ZINC000765259487 1118141117 /nfs/dbraw/zinc/14/11/17/1118141117.db2.gz FEPKLVMHPGJXLK-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccc(O)cc1)c1ccc(N(C)C)cc1 ZINC000765349756 1118146964 /nfs/dbraw/zinc/14/69/64/1118146964.db2.gz OCKVKGYAOQDYRJ-IBGZPJMESA-N 1 0 298.430 3.742 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccoc1C)c1ccc(N(C)C)cc1 ZINC000765395292 1118148113 /nfs/dbraw/zinc/14/81/13/1118148113.db2.gz GMKLODPUQOYGRK-QGZVFWFLSA-N 1 0 272.392 3.895 20 10 CHCDRO CCCCOCC[NH2+][C@@H](C)c1ccc(N(C)CC)cc1 ZINC000765454207 1118153255 /nfs/dbraw/zinc/15/32/55/1118153255.db2.gz BXSYGAMTSJMIRW-HNNXBMFYSA-N 1 0 278.440 3.610 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CCC(O)(CC)CC)cc1 ZINC000788076595 1118159732 /nfs/dbraw/zinc/15/97/32/1118159732.db2.gz DNBQRQVQZBLFHT-UHFFFAOYSA-N 1 0 292.467 3.564 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCC2(COC)CC2)cc1 ZINC000842895208 1118160224 /nfs/dbraw/zinc/16/02/24/1118160224.db2.gz UHQCNZUBLDQGBW-OAHLLOKOSA-N 1 0 290.451 3.610 20 10 CHCDRO CC[C@H]([NH2+]CCN(CC)C(C)C)c1ccc(N(C)C)cc1 ZINC000765626675 1118184760 /nfs/dbraw/zinc/18/47/60/1118184760.db2.gz ALFXXNGAYARNFB-SFHVURJKSA-N 1 0 291.483 3.524 20 10 CHCDRO C[C@H]([NH2+]CC1(C2CC2)CCC1)c1cc(F)ccc1O ZINC000186156618 1118198649 /nfs/dbraw/zinc/19/86/49/1118198649.db2.gz OPMXZRKDSQGKKP-NSHDSACASA-N 1 0 263.356 3.762 20 10 CHCDRO Fc1ccc(C[NH2+]Cc2ccc3c(c2)CCCO3)cc1F ZINC000921597448 1118204061 /nfs/dbraw/zinc/20/40/61/1118204061.db2.gz ZOUAXNCHIXRICU-UHFFFAOYSA-N 1 0 289.325 3.580 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)c2cnc(C)s2)cc1C ZINC000090407131 1118212109 /nfs/dbraw/zinc/21/21/09/1118212109.db2.gz CPQLLPZGLDYGTJ-LLVKDONJSA-N 1 0 276.405 3.619 20 10 CHCDRO COc1ccc(CC(C)(C)[NH2+]Cc2cccc(C)c2O)cc1 ZINC000188940089 1128765624 /nfs/dbraw/zinc/76/56/24/1128765624.db2.gz TUEDINVBVGCDDJ-UHFFFAOYSA-N 1 0 299.414 3.820 20 10 CHCDRO Cc1ccc(C)c(C[NH+]2CC3(C2)CCCCC3)c1O ZINC001140184549 1118254994 /nfs/dbraw/zinc/25/49/94/1118254994.db2.gz ZDVUUWIWKNCJQA-UHFFFAOYSA-N 1 0 259.393 3.775 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](C)CN(CC)CC)cc1 ZINC000765765573 1118267914 /nfs/dbraw/zinc/26/79/14/1118267914.db2.gz GWVDUNGJCPIVRN-JKSUJKDBSA-N 1 0 291.483 3.524 20 10 CHCDRO CC[N@H+](Cc1cc(F)ccc1O)[C@H](C)c1cccc(O)c1 ZINC000179942740 1128767378 /nfs/dbraw/zinc/76/73/78/1128767378.db2.gz SBZHNAUZWJSCRY-GFCCVEGCSA-N 1 0 289.350 3.820 20 10 CHCDRO Cc1cc(C)cc(C[NH2+]Cc2c(O)cccc2Cl)c1 ZINC000693172145 1118319109 /nfs/dbraw/zinc/31/91/09/1118319109.db2.gz YZPQIWARUGJHOL-UHFFFAOYSA-N 1 0 275.779 3.952 20 10 CHCDRO CCC[N@H+](Cc1ccccc1O)Cc1cc(F)ccc1O ZINC000180015990 1128772869 /nfs/dbraw/zinc/77/28/69/1128772869.db2.gz HZSYYVJTEPATRM-UHFFFAOYSA-N 1 0 289.350 3.649 20 10 CHCDRO COc1ccc(C[NH2+]Cc2cccc(Cl)c2)cc1C ZINC000049943182 1118381511 /nfs/dbraw/zinc/38/15/11/1118381511.db2.gz DZUVMQNKLCZAEG-UHFFFAOYSA-N 1 0 275.779 3.947 20 10 CHCDRO COc1c(C)cc(C[N@H+](C)Cc2ccccc2O)cc1C ZINC000091956702 1118515649 /nfs/dbraw/zinc/51/56/49/1118515649.db2.gz PFYMZEMPDJGSPJ-UHFFFAOYSA-N 1 0 285.387 3.650 20 10 CHCDRO CC[C@H](C)[C@@H](C[NH2+][C@H](C)c1ccc(C)c(C)c1O)OC ZINC000834856013 1118586213 /nfs/dbraw/zinc/58/62/13/1118586213.db2.gz KDWVZWSNDBWKDN-SGIREYDYSA-N 1 0 279.424 3.721 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(F)cc2F)c1 ZINC000051016599 1118605011 /nfs/dbraw/zinc/60/50/11/1118605011.db2.gz ICKOGDGCFWUXET-JTQLQIEISA-N 1 0 293.313 3.530 20 10 CHCDRO C[C@H]1CCCC[N@@H+]1Cc1c(O)cccc1Br ZINC000707135418 1118641171 /nfs/dbraw/zinc/64/11/71/1118641171.db2.gz SITMCVRUCZPDMH-JTQLQIEISA-N 1 0 284.197 3.529 20 10 CHCDRO CC[C@@H]1CC[C@@H](C)[N@@H+]1Cc1c(O)cccc1Br ZINC000707138796 1118642719 /nfs/dbraw/zinc/64/27/19/1118642719.db2.gz HODGWVMYVMZYHB-GHMZBOCLSA-N 1 0 298.224 3.918 20 10 CHCDRO CCC1CC[NH+](Cc2c(O)cccc2Br)CC1 ZINC000707145005 1118647473 /nfs/dbraw/zinc/64/74/73/1118647473.db2.gz DICVRVABMCCLNP-UHFFFAOYSA-N 1 0 298.224 3.777 20 10 CHCDRO C[C@H]1CC[N@H+](Cc2c(O)cccc2Br)[C@@H](C)C1 ZINC000707145799 1118648131 /nfs/dbraw/zinc/64/81/31/1118648131.db2.gz HJJZHDSLWDVUJY-QWRGUYRKSA-N 1 0 298.224 3.775 20 10 CHCDRO COc1cc(C)cc(C[N@@H+]2CCC[C@H]2C2CCCC2)c1O ZINC000754727911 1118648191 /nfs/dbraw/zinc/64/81/91/1118648191.db2.gz SIACTZRIQZTRSY-INIZCTEOSA-N 1 0 289.419 3.864 20 10 CHCDRO C[C@@H]1CC[C@H](C)C[N@H+]1Cc1c(O)cccc1Br ZINC000707146236 1118648249 /nfs/dbraw/zinc/64/82/49/1118648249.db2.gz KLNFQHYYTWAKHP-WDEREUQCSA-N 1 0 298.224 3.775 20 10 CHCDRO Cc1cccc(C[N@H+](C[C@@H]2CCCO2)C2CCCC2)c1O ZINC000180455985 1128792418 /nfs/dbraw/zinc/79/24/18/1128792418.db2.gz XKCNQXUDHWUOIO-KRWDZBQOSA-N 1 0 289.419 3.624 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1ccc(N(C)CC)cc1)[C@@H]1CCCO1 ZINC000090859397 1118662859 /nfs/dbraw/zinc/66/28/59/1118662859.db2.gz SGXMGMSAAIOPLD-WBAXXEDZSA-N 1 0 290.451 3.751 20 10 CHCDRO CC(C)Cc1ccc(C[N@H+](C)Cc2ccccc2O)cn1 ZINC000891714045 1118749629 /nfs/dbraw/zinc/74/96/29/1118749629.db2.gz PWYDCTWUMHLQNG-UHFFFAOYSA-N 1 0 284.403 3.618 20 10 CHCDRO COc1ccccc1/C=C\C[N@H+](C)Cc1ccccc1O ZINC000255392321 1118753330 /nfs/dbraw/zinc/75/33/30/1118753330.db2.gz ORGBDMBQRRGJNB-YFHOEESVSA-N 1 0 283.371 3.546 20 10 CHCDRO Cc1cccc(C[N@H+]2CCCC[C@@H]2c2cccn2C)c1O ZINC000180638134 1128801455 /nfs/dbraw/zinc/80/14/55/1128801455.db2.gz JNKFNBXGNGMNRL-QGZVFWFLSA-N 1 0 284.403 3.766 20 10 CHCDRO CCS[C@H]1CC[C@@H]([N@H+](C)Cc2cc(OC)ccc2O)C1 ZINC000180668289 1128801581 /nfs/dbraw/zinc/80/15/81/1128801581.db2.gz ODWQRYCQDXHAOW-HIFRSBDPSA-N 1 0 295.448 3.507 20 10 CHCDRO Oc1ccccc1C[NH2+]Cc1ccc(C2CCC2)cc1 ZINC000276884757 1118832090 /nfs/dbraw/zinc/83/20/90/1118832090.db2.gz FHLRXQDGGUWNJU-UHFFFAOYSA-N 1 0 267.372 3.950 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)CCSC)c1ccccc1O ZINC000129683979 1118880411 /nfs/dbraw/zinc/88/04/11/1118880411.db2.gz DMEUGFPGKAJMBB-YPMHNXCESA-N 1 0 253.411 3.575 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCc3ccccc3C2)c(O)c1 ZINC000051630739 1119061924 /nfs/dbraw/zinc/06/19/24/1119061924.db2.gz IRQWBDUFNAHYGW-WMLDXEAASA-N 1 0 281.399 3.909 20 10 CHCDRO C[C@@H]1CCC[C@@H]([N@H+](C)Cc2cc(F)ccc2O)C1 ZINC000226562205 1119157420 /nfs/dbraw/zinc/15/74/20/1119157420.db2.gz AWELTMRVDQJAAH-BXUZGUMPSA-N 1 0 251.345 3.542 20 10 CHCDRO C[C@H]1CCC[C@H](C[NH2+]Cc2c(O)cccc2Cl)C1 ZINC000226646791 1119255801 /nfs/dbraw/zinc/25/58/01/1119255801.db2.gz KJJDTBUTIJDDQR-RYUDHWBXSA-N 1 0 267.800 3.962 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCc3cccc(Cl)c3C2)c1 ZINC001140623667 1119295356 /nfs/dbraw/zinc/29/53/56/1119295356.db2.gz OQIHJEJMCOSSNT-UHFFFAOYSA-N 1 0 287.790 3.912 20 10 CHCDRO Cc1cnc(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)s1 ZINC000230664067 1119412996 /nfs/dbraw/zinc/41/29/96/1119412996.db2.gz VEOXKQXTQDYYJK-PWSUYJOCSA-N 1 0 288.416 3.804 20 10 CHCDRO COc1ccccc1[C@@H](C)[NH2+]Cc1cccc(C)c1O ZINC000158065121 1119430511 /nfs/dbraw/zinc/43/05/11/1119430511.db2.gz JRONVOZKSCJWOI-CYBMUJFWSA-N 1 0 271.360 3.560 20 10 CHCDRO CCOCC[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000161940805 1119431246 /nfs/dbraw/zinc/43/12/46/1119431246.db2.gz MDIJHXJEQLJROP-MRXNPFEDSA-N 1 0 290.451 3.754 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]CCCc1ccccc1)CC2 ZINC000383379743 1119611068 /nfs/dbraw/zinc/61/10/68/1119611068.db2.gz MKNBDHIJKWYFHQ-INIZCTEOSA-N 1 0 267.372 3.602 20 10 CHCDRO C[C@@H](c1ccco1)[N@H+](Cc1ccccc1O)C1CC1 ZINC000179563310 1119751243 /nfs/dbraw/zinc/75/12/43/1119751243.db2.gz FEEXUNUJIQECHP-LBPRGKRZSA-N 1 0 257.333 3.711 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCC[C@H]1c1cccc(F)c1 ZINC000179557369 1119751997 /nfs/dbraw/zinc/75/19/97/1119751997.db2.gz CQJYBRKSIAWKCI-INIZCTEOSA-N 1 0 271.335 3.868 20 10 CHCDRO CCCCCC[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC000151875278 1119779771 /nfs/dbraw/zinc/77/97/71/1119779771.db2.gz HYIWZFUJRGFSAW-UHFFFAOYSA-N 1 0 290.451 3.834 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccn(C2CCCC2)n1)c1ccccc1O ZINC000179900402 1119792231 /nfs/dbraw/zinc/79/22/31/1119792231.db2.gz KYDOMZSYAMRVLS-CYBMUJFWSA-N 1 0 285.391 3.555 20 10 CHCDRO CCc1ccc(C[N@H+](C)Cc2ccc(O)c(C)c2O)cc1 ZINC001140747449 1119794156 /nfs/dbraw/zinc/79/41/56/1119794156.db2.gz DOZOCJPOEBVQLN-UHFFFAOYSA-N 1 0 285.387 3.601 20 10 CHCDRO CCc1ccc(C(C)(C)[NH2+]Cc2cccc(OC)c2O)cc1 ZINC000177597782 1119830794 /nfs/dbraw/zinc/83/07/94/1119830794.db2.gz ZOCCVEWYTKXFSS-UHFFFAOYSA-N 1 0 299.414 3.988 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)CCCOC)cc1F ZINC000178035696 1119903284 /nfs/dbraw/zinc/90/32/84/1119903284.db2.gz MBSNXPSWHONGGY-AWEZNQCLSA-N 1 0 296.430 3.577 20 10 CHCDRO Cc1nc2c(s1)[C@@H]([NH2+][C@H](C)c1ccccc1O)CCC2 ZINC000376351227 1119951755 /nfs/dbraw/zinc/95/17/55/1119951755.db2.gz JXXNQBQJUFMWSV-MFKMUULPSA-N 1 0 288.416 3.885 20 10 CHCDRO Cc1cncc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)c1 ZINC000785442682 1120073013 /nfs/dbraw/zinc/07/30/13/1120073013.db2.gz URRPKBAWMFVVLC-UHFFFAOYSA-N 1 0 297.446 3.867 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCCC(F)(F)C1)c1ccc(N(C)C)cc1 ZINC000695064582 1120099872 /nfs/dbraw/zinc/09/98/72/1120099872.db2.gz GFBUNNTUYVMQFH-JSGCOSHPSA-N 1 0 282.378 3.981 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCCC(F)(F)C2)c1 ZINC000695081283 1120100866 /nfs/dbraw/zinc/10/08/66/1120100866.db2.gz FHLBXTJLZRRLDM-GHMZBOCLSA-N 1 0 285.334 3.629 20 10 CHCDRO CCCC[N@H+](CCOCC(C)C)Cc1ccccc1O ZINC000801594676 1128890583 /nfs/dbraw/zinc/89/05/83/1128890583.db2.gz KGTGABDRUZHESX-UHFFFAOYSA-N 1 0 279.424 3.667 20 10 CHCDRO CCOc1cccc(C[NH2+][C@H](C)C(C)(C)CC)c1O ZINC000695107776 1120106997 /nfs/dbraw/zinc/10/69/97/1120106997.db2.gz OWGDXXHGKSDHNW-GFCCVEGCSA-N 1 0 265.397 3.705 20 10 CHCDRO COc1ccc(C[NH2+][C@H]2CCCC(F)(F)C2)cc1C ZINC000695126344 1120112222 /nfs/dbraw/zinc/11/22/22/1120112222.db2.gz MLSBTXFEJHSTOL-ZDUSSCGKSA-N 1 0 269.335 3.671 20 10 CHCDRO c1ccc(C2([NH2+]Cc3ccc4c(c3)CCO4)CCC2)cc1 ZINC000236620786 1120112979 /nfs/dbraw/zinc/11/29/79/1120112979.db2.gz UMAVVBCDVVRKBG-UHFFFAOYSA-N 1 0 279.383 3.791 20 10 CHCDRO Cc1ccc(C[N@H+](C)Cc2cccc(Cl)c2)c(O)c1 ZINC001140950186 1120133649 /nfs/dbraw/zinc/13/36/49/1120133649.db2.gz UNXSHIBIARMEPN-UHFFFAOYSA-N 1 0 275.779 3.986 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCCOC(C)(C)C)c(O)c1 ZINC000695281356 1120183678 /nfs/dbraw/zinc/18/36/78/1120183678.db2.gz RSZKCOQKXNWLCD-CYBMUJFWSA-N 1 0 265.397 3.556 20 10 CHCDRO COc1cccc(C[NH2+]CC(C)(C)C2=CCCC2)c1O ZINC000308767446 1120199912 /nfs/dbraw/zinc/19/99/12/1120199912.db2.gz HBMKUVPNPAOFTM-UHFFFAOYSA-N 1 0 275.392 3.627 20 10 CHCDRO CC[C@H](C)[C@@](C)(O)C[NH2+][C@@H](C)c1ccc(N(C)CC)cc1 ZINC000765945624 1120239560 /nfs/dbraw/zinc/23/95/60/1120239560.db2.gz LBCATBONRZWXET-MPGHIAIKSA-N 1 0 292.467 3.590 20 10 CHCDRO C[C@@H]([NH2+]CCc1cc(F)ccc1F)c1ccccc1O ZINC000183542403 1120343302 /nfs/dbraw/zinc/34/33/02/1120343302.db2.gz LAMXQBJHIFMULZ-LLVKDONJSA-N 1 0 277.314 3.564 20 10 CHCDRO COC1(C[NH2+][C@H](C)c2cc(F)ccc2O)CCCCC1 ZINC000186508944 1120349582 /nfs/dbraw/zinc/34/95/82/1120349582.db2.gz ODXPVXFZHQNEHR-GFCCVEGCSA-N 1 0 281.371 3.531 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CCC[C@@H](CCF)C1 ZINC000689880406 1120351643 /nfs/dbraw/zinc/35/16/43/1120351643.db2.gz GNYACUJBCDKFAZ-NSHDSACASA-N 1 0 271.763 3.617 20 10 CHCDRO C[C@H]([NH2+]Cc1cscn1)c1cc2c(cc1O)CCCC2 ZINC000185246606 1120374184 /nfs/dbraw/zinc/37/41/84/1120374184.db2.gz PYUJMZCXOVCLCF-NSHDSACASA-N 1 0 288.416 3.578 20 10 CHCDRO CCO[C@@H](CC[NH2+][C@@H](C)c1ccc(C)cc1O)C(C)C ZINC000185625668 1120380945 /nfs/dbraw/zinc/38/09/45/1120380945.db2.gz NQLAJFCRNSUABY-YOEHRIQHSA-N 1 0 279.424 3.802 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccc(C)o1)c1ccccc1O ZINC000689792774 1120380805 /nfs/dbraw/zinc/38/08/05/1120380805.db2.gz GFQPEMIDSUSPTP-OAHLLOKOSA-N 1 0 259.349 3.577 20 10 CHCDRO C[C@H](COc1ccccc1)[NH2+][C@H](C)c1cc(F)ccc1O ZINC000756496696 1120387924 /nfs/dbraw/zinc/38/79/24/1120387924.db2.gz XLDOYJKZEXYRJY-CHWSQXEVSA-N 1 0 289.350 3.649 20 10 CHCDRO C[C@@H](CCC1CC1)[NH2+]CCCSc1nccs1 ZINC000186345973 1120396422 /nfs/dbraw/zinc/39/64/22/1120396422.db2.gz MVKQRFJGEQLHCK-NSHDSACASA-N 1 0 270.467 3.794 20 10 CHCDRO COc1ccc(C[NH2+]Cc2cc(C)ccc2O)cc1Cl ZINC000132343320 1120404662 /nfs/dbraw/zinc/40/46/62/1120404662.db2.gz SGPGVPAPVISEKU-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]C2CCC3(CC3)CC2)c1 ZINC000695758567 1120440964 /nfs/dbraw/zinc/44/09/64/1120440964.db2.gz GKDUCEJERXUSMG-LBPRGKRZSA-N 1 0 275.392 3.774 20 10 CHCDRO Cc1ncccc1C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000728774461 1120440980 /nfs/dbraw/zinc/44/09/80/1120440980.db2.gz DPQGKHQFZJFRHZ-UHFFFAOYSA-N 1 0 295.430 3.670 20 10 CHCDRO COc1cccc(C[NH2+][C@@H]2CCC[C@@H](C(C)C)C2)c1O ZINC000728777070 1120456947 /nfs/dbraw/zinc/45/69/47/1120456947.db2.gz YAQOUPLUVLNKJD-UKRRQHHQSA-N 1 0 277.408 3.705 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1cc(F)cc(F)c1[O-])C1CCCC1 ZINC000756571911 1120539826 /nfs/dbraw/zinc/53/98/26/1120539826.db2.gz HAEHWAVDNWSHHV-ZJUUUORDSA-N 1 0 269.335 3.900 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1[C@H]2CCCO[C@H]2C1(C)C)c1ccccc1O ZINC000364363108 1120567542 /nfs/dbraw/zinc/56/75/42/1120567542.db2.gz NFNXGWYUKADYFJ-YALNPMBYSA-N 1 0 289.419 3.637 20 10 CHCDRO CC[C@@H]([NH2+]CC1(SC)CCC1)c1ccccc1O ZINC000193805270 1120581892 /nfs/dbraw/zinc/58/18/92/1120581892.db2.gz UTQYUQLBQDJKLN-CYBMUJFWSA-N 1 0 265.422 3.719 20 10 CHCDRO Cc1csc([C@@H](C)C[NH2+][C@@H](C)c2ccccc2O)n1 ZINC000186569589 1120586770 /nfs/dbraw/zinc/58/67/70/1120586770.db2.gz SAEBBPBEDXZSEW-JQWIXIFHSA-N 1 0 276.405 3.611 20 10 CHCDRO COc1ccc(C[NH2+][C@H]2CCCc3cccnc32)cc1C ZINC000922881002 1120617263 /nfs/dbraw/zinc/61/72/63/1120617263.db2.gz YYPWBMXAEGMVOK-INIZCTEOSA-N 1 0 282.387 3.566 20 10 CHCDRO C[C@H]([NH2+]CC[C@@H]1CC1(Cl)Cl)c1cc(F)ccc1O ZINC000857082390 1120628779 /nfs/dbraw/zinc/62/87/79/1120628779.db2.gz NDDGDQQZBHOHFI-DTWKUNHWSA-N 1 0 292.181 3.766 20 10 CHCDRO C[C@@H]([NH2+]C1Cc2ccccc2C1)c1ccc(N(C)C)cc1 ZINC000184007040 1120673358 /nfs/dbraw/zinc/67/33/58/1120673358.db2.gz OEUGCWJBYPVYME-CQSZACIVSA-N 1 0 280.415 3.571 20 10 CHCDRO COc1ccc(C)cc1C[NH2+][C@H](C)c1ccc(C)cc1O ZINC000756672845 1120685550 /nfs/dbraw/zinc/68/55/50/1120685550.db2.gz UODODUQPFUHBSQ-CQSZACIVSA-N 1 0 285.387 3.868 20 10 CHCDRO Cc1cccc2[nH]cc(CC[NH2+]Cc3cccc(C)c3O)c21 ZINC000182153854 1128937307 /nfs/dbraw/zinc/93/73/07/1128937307.db2.gz GVOLKURTEUWVMO-UHFFFAOYSA-N 1 0 294.398 3.823 20 10 CHCDRO COc1ccc(O)c(C[NH2+]C(C)(C)c2ccc(F)cc2)c1 ZINC000182154184 1128937450 /nfs/dbraw/zinc/93/74/50/1128937450.db2.gz ACSXMJKKWSOQFM-UHFFFAOYSA-N 1 0 289.350 3.565 20 10 CHCDRO C[C@@H]([NH2+]CCSC(F)(F)F)c1ccc(N(C)C)cc1 ZINC000178417966 1120763314 /nfs/dbraw/zinc/76/33/14/1120763314.db2.gz LYUGCHZMTXPZSB-SNVBAGLBSA-N 1 0 292.370 3.656 20 10 CHCDRO CC1CCN(c2ccc(C[NH2+]C3CCCC3)cc2)CC1 ZINC000075824277 1120891682 /nfs/dbraw/zinc/89/16/82/1120891682.db2.gz ZNHYGIATVUVWPW-UHFFFAOYSA-N 1 0 272.436 3.955 20 10 CHCDRO CC[C@@H]([NH2+]CCCOCC1CC1)c1ccc(N(C)C)cc1 ZINC000162872936 1120902621 /nfs/dbraw/zinc/90/26/21/1120902621.db2.gz LCBVANQUPGKKLE-GOSISDBHSA-N 1 0 290.451 3.610 20 10 CHCDRO COc1cccc(CC[NH2+][C@H](C)c2ccc(C)cc2O)c1 ZINC000185040552 1120909476 /nfs/dbraw/zinc/90/94/76/1120909476.db2.gz KJXVAFQHIDSQIS-CQSZACIVSA-N 1 0 285.387 3.603 20 10 CHCDRO CCC[N@H+](Cc1ccccc1O)Cc1cc(C)ccc1O ZINC000092705038 1120964160 /nfs/dbraw/zinc/96/41/60/1120964160.db2.gz DURFEHVQVZSJCW-UHFFFAOYSA-N 1 0 285.387 3.818 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCSC1)c1ccc2ccccc2c1O ZINC000228557413 1120970184 /nfs/dbraw/zinc/97/01/84/1120970184.db2.gz CNILKSJFFKQRKM-QWHCGFSZSA-N 1 0 287.428 3.949 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]CCc2ccccc2C)c1 ZINC000094182680 1120979784 /nfs/dbraw/zinc/97/97/84/1120979784.db2.gz ARCWBSGFBMZFQG-AWEZNQCLSA-N 1 0 285.387 3.603 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cc(C)sc2C)c1 ZINC000182321166 1128958237 /nfs/dbraw/zinc/95/82/37/1128958237.db2.gz FMXPCQPCUXHZPZ-LLVKDONJSA-N 1 0 291.416 3.930 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H](C)CC(F)F)c1 ZINC000700156051 1121086833 /nfs/dbraw/zinc/08/68/33/1121086833.db2.gz QJLZGPAMKTWBCL-WDEREUQCSA-N 1 0 257.324 3.643 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cc(C)ccc2C)c1 ZINC000182383929 1128963706 /nfs/dbraw/zinc/96/37/06/1128963706.db2.gz AJRLAHXZTBUBSS-AWEZNQCLSA-N 1 0 285.387 3.868 20 10 CHCDRO Oc1cc(Br)ccc1C[NH2+][C@@H]1CC12CCCC2 ZINC000700976210 1121129196 /nfs/dbraw/zinc/12/91/96/1121129196.db2.gz UOJIRTUTRBIRIW-CYBMUJFWSA-N 1 0 296.208 3.577 20 10 CHCDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]CC1CCSCC1 ZINC000168774104 1121143321 /nfs/dbraw/zinc/14/33/21/1121143321.db2.gz PSXOSJCXGKALKW-GXTWGEPZSA-N 1 0 291.460 3.982 20 10 CHCDRO C[N@@H+](Cc1cc(F)ccc1O)CC1CCCCC1 ZINC000226562106 1121158372 /nfs/dbraw/zinc/15/83/72/1121158372.db2.gz HOYMKDWRSBQWEP-UHFFFAOYSA-N 1 0 251.345 3.543 20 10 CHCDRO Cc1ccsc1C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000094874725 1121236556 /nfs/dbraw/zinc/23/65/56/1121236556.db2.gz GDYUOYGVTFFKNX-ZDUSSCGKSA-N 1 0 274.433 3.973 20 10 CHCDRO CCO[C@@H]1C[C@H]([NH2+]Cc2cc(C)ccc2O)C12CCCC2 ZINC000236889968 1121379474 /nfs/dbraw/zinc/37/94/74/1121379474.db2.gz ZZWAYNSHEZNTNE-DLBZAZTESA-N 1 0 289.419 3.528 20 10 CHCDRO C[N@@H+](Cc1c([O-])cccc1F)CC1CCCCC1 ZINC001137838885 1121424267 /nfs/dbraw/zinc/42/42/67/1121424267.db2.gz MCTBJORKFIJEJW-UHFFFAOYSA-N 1 0 251.345 3.543 20 10 CHCDRO Oc1ccc(C(F)(F)F)cc1C[N@@H+]1CCC2(CCC2)C1 ZINC001237140997 1128985668 /nfs/dbraw/zinc/98/56/68/1128985668.db2.gz QOQZGHXZAQBUPV-UHFFFAOYSA-N 1 0 285.309 3.787 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CC(C)(C)OC1(C)C)c1ccccc1O ZINC000709662007 1121468127 /nfs/dbraw/zinc/46/81/27/1121468127.db2.gz HGBKLWSGVCRMPH-STQMWFEESA-N 1 0 277.408 3.637 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CC(C)(C)OC1(C)C)c1ccccc1O ZINC000709662001 1121468231 /nfs/dbraw/zinc/46/82/31/1121468231.db2.gz HGBKLWSGVCRMPH-CHWSQXEVSA-N 1 0 277.408 3.637 20 10 CHCDRO CCc1cccc(C[NH2+]Cc2ccccc2Cl)c1O ZINC000709447325 1121470701 /nfs/dbraw/zinc/47/07/01/1121470701.db2.gz TWEANZOXHAUQHG-UHFFFAOYSA-N 1 0 275.779 3.898 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H]2CCOC(C)(C)C2)cc1 ZINC000246368462 1121499110 /nfs/dbraw/zinc/49/91/10/1121499110.db2.gz JAVZGDKXQGJMGP-HOCLYGCPSA-N 1 0 290.451 3.751 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@]2(C)CCOc3ccccc32)cc1C ZINC000923023495 1121513715 /nfs/dbraw/zinc/51/37/15/1121513715.db2.gz BMRRTNOJGNBEDO-LJQANCHMSA-N 1 0 297.398 3.797 20 10 CHCDRO CCO[C@H]1C[C@H]([NH2+]Cc2cc(C)ccc2O)C12CCCC2 ZINC000236986634 1121585656 /nfs/dbraw/zinc/58/56/56/1121585656.db2.gz ZZWAYNSHEZNTNE-IRXDYDNUSA-N 1 0 289.419 3.528 20 10 CHCDRO Cc1c[nH+]ccc1NCc1ccc(N2CCCC2)cc1 ZINC000192493515 1128999701 /nfs/dbraw/zinc/99/97/01/1128999701.db2.gz YUPVGTIIVGWARN-UHFFFAOYSA-N 1 0 267.376 3.602 20 10 CHCDRO COCC(C)(C)CC[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001119066883 1121704964 /nfs/dbraw/zinc/70/49/64/1121704964.db2.gz VCEDWXORHIEGCR-ZIAGYGMSSA-N 1 0 291.435 3.901 20 10 CHCDRO COCC(C)(C)CC[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001119066881 1121705677 /nfs/dbraw/zinc/70/56/77/1121705677.db2.gz VCEDWXORHIEGCR-KGLIPLIRSA-N 1 0 291.435 3.901 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]C1CCC(F)(F)CC1 ZINC000688484418 1129004023 /nfs/dbraw/zinc/00/40/23/1129004023.db2.gz WHEDATHDVSAXOV-UHFFFAOYSA-N 1 0 275.726 3.713 20 10 CHCDRO Cc1cc(O)c(C[NH2+]Cc2cccc(F)c2)c(Cl)c1 ZINC001177153777 1121716442 /nfs/dbraw/zinc/71/64/42/1121716442.db2.gz WPOGWYPQHHSCTA-UHFFFAOYSA-N 1 0 279.742 3.783 20 10 CHCDRO C[C@H]1CCCC[C@@H]1C[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001177575486 1121740186 /nfs/dbraw/zinc/74/01/86/1121740186.db2.gz JNJTYXJXXSBFST-QWHCGFSZSA-N 1 0 296.405 3.947 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CC[C@H](C)C2)cc1F ZINC001177795466 1121751113 /nfs/dbraw/zinc/75/11/13/1121751113.db2.gz TWTYXUDSQLRBLS-DZGCQCFKSA-N 1 0 278.415 3.950 20 10 CHCDRO CC1(C)CC[C@H]([NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC001178209556 1121772861 /nfs/dbraw/zinc/77/28/61/1121772861.db2.gz WSQSUMGZPDVUHU-HNNXBMFYSA-N 1 0 259.393 3.680 20 10 CHCDRO Cc1cccc(C)c1C[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001178280384 1121777224 /nfs/dbraw/zinc/77/72/24/1121777224.db2.gz AMVJWNVNKBIIPN-UHFFFAOYSA-N 1 0 281.399 3.918 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)CC(C)(C)OC)c1ccc(N(C)C)cc1 ZINC000766189602 1121781747 /nfs/dbraw/zinc/78/17/47/1121781747.db2.gz GHQWOBUKZVYRPM-PBHICJAKSA-N 1 0 292.467 3.997 20 10 CHCDRO C[N@H+](Cc1ccc(N2CCCC2)cc1)[C@@H]1C[C@H]2C[C@H]2C1 ZINC001167941402 1121786959 /nfs/dbraw/zinc/78/69/59/1121786959.db2.gz XPIIXQKIILHNKX-ALXJQNPVSA-N 1 0 270.420 3.517 20 10 CHCDRO CCCOc1ccc(C[NH2+]CC2(COC)CCC2)cc1C ZINC001178546563 1121794826 /nfs/dbraw/zinc/79/48/26/1121794826.db2.gz XBLFRSLGBATFFU-UHFFFAOYSA-N 1 0 291.435 3.690 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CCC[C@H]2C2CC2)cc1 ZINC000773749498 1121794972 /nfs/dbraw/zinc/79/49/72/1121794972.db2.gz WNMCCGGYAHRZSV-KRWDZBQOSA-N 1 0 258.409 3.517 20 10 CHCDRO CCN(C)c1ccc(C[N@H+](C)Cc2scnc2C)cc1 ZINC000773754084 1121798350 /nfs/dbraw/zinc/79/83/50/1121798350.db2.gz COGIUKKBGMGCDF-UHFFFAOYSA-N 1 0 289.448 3.540 20 10 CHCDRO CCCOc1ccc(C[NH2+]CC(C)(C)COC)cc1C ZINC001178839808 1121822346 /nfs/dbraw/zinc/82/23/46/1121822346.db2.gz HLWXQNGSPBWDJT-UHFFFAOYSA-N 1 0 279.424 3.546 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](C)CCN(C)c2ccccc2)cc1C ZINC000730803476 1121826897 /nfs/dbraw/zinc/82/68/97/1121826897.db2.gz KCLQLEMIOAMKSF-UHFFFAOYSA-N 1 0 298.430 3.577 20 10 CHCDRO CCN(C)c1ccc(C[N@H+](C)[C@H](C)c2ccncc2)cc1 ZINC000773805693 1121859942 /nfs/dbraw/zinc/85/99/42/1121859942.db2.gz FVXGYWIJLGUSEX-OAHLLOKOSA-N 1 0 283.419 3.731 20 10 CHCDRO CCOc1ccc(C[NH2+]C2(c3ccccc3)CC2)c(O)c1 ZINC000731678791 1121881722 /nfs/dbraw/zinc/88/17/22/1121881722.db2.gz PPQCCRAQRIDIGC-UHFFFAOYSA-N 1 0 283.371 3.570 20 10 CHCDRO C[C@@H]([NH2+]Cc1c[nH]nc1-c1ccccc1)c1ccccc1O ZINC001179489347 1121883281 /nfs/dbraw/zinc/88/32/81/1121883281.db2.gz KIFFVVGFKPEYAC-CYBMUJFWSA-N 1 0 293.370 3.633 20 10 CHCDRO C[C@@H]1C[C@@H]1[C@H]1C[C@H]1C[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001179592863 1121893068 /nfs/dbraw/zinc/89/30/68/1121893068.db2.gz JIJWHYPOCZDEFH-XIVBQZFQSA-N 1 0 284.447 3.669 20 10 CHCDRO Oc1ccc2ccncc2c1C[N@@H+]1CC[C@@H](c2ccco2)C1 ZINC000732184226 1121910948 /nfs/dbraw/zinc/91/09/48/1121910948.db2.gz XSONLRDOIJFQAV-CQSZACIVSA-N 1 0 294.354 3.523 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)CCC2CC2)c(Cl)c1 ZINC001179925995 1121923237 /nfs/dbraw/zinc/92/32/37/1121923237.db2.gz VIGSIGPSGQYYLO-UHFFFAOYSA-N 1 0 253.773 3.586 20 10 CHCDRO CC(C)C[N@H+](C/C=C/c1ccc(N(C)C)cc1)C1CC1 ZINC001179983702 1121933265 /nfs/dbraw/zinc/93/32/65/1121933265.db2.gz FDLXYEQLDSSQLZ-AATRIKPKSA-N 1 0 272.436 3.886 20 10 CHCDRO COc1ccc(O)c(C[N@H+](C)[C@@H](C)Cc2cccs2)c1 ZINC001180057432 1121943687 /nfs/dbraw/zinc/94/36/87/1121943687.db2.gz DERLEDZESWQZJU-LBPRGKRZSA-N 1 0 291.416 3.525 20 10 CHCDRO CC[C@]1(C)CC[N@H+](Cc2cc(Cl)c(C)cc2O)C1 ZINC001180080805 1121948898 /nfs/dbraw/zinc/94/88/98/1121948898.db2.gz GHGJQUPIQDWOEN-OAHLLOKOSA-N 1 0 267.800 3.976 20 10 CHCDRO CC(C)C[C@@H]1CC[N@H+](Cc2cc(F)c(F)cc2[O-])C1 ZINC001180267614 1121969795 /nfs/dbraw/zinc/96/97/95/1121969795.db2.gz YUTNHOKJHKSNCX-NSHDSACASA-N 1 0 269.335 3.538 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2cc(F)ccc2O)[C@H]2CCCC[C@H]12 ZINC001180271337 1121972505 /nfs/dbraw/zinc/97/25/05/1121972505.db2.gz ISFPEDDZHKSMQO-WQVCFCJDSA-N 1 0 277.383 3.932 20 10 CHCDRO C[C@H]1CCC[C@@H]([NH2+]Cc2ccc(N(C)C)c(F)c2)C1 ZINC000733323963 1121976583 /nfs/dbraw/zinc/97/65/83/1121976583.db2.gz BDBCWFFPHJTDDH-GXTWGEPZSA-N 1 0 264.388 3.560 20 10 CHCDRO CCC[NH+](CCC)CCCNCc1c(O)cccc1Cl ZINC000733327002 1121978199 /nfs/dbraw/zinc/97/81/99/1121978199.db2.gz KCUAYTOIGOFDSL-UHFFFAOYSA-N 1 0 298.858 3.647 20 10 CHCDRO C[C@@H]([NH2+]CCCc1cccc(F)c1)c1ccccc1O ZINC000183100913 1129023167 /nfs/dbraw/zinc/02/31/67/1129023167.db2.gz XJEXBIWVLGQCNQ-CYBMUJFWSA-N 1 0 273.351 3.815 20 10 CHCDRO CC[C@@](C)(C[N@H+](Cc1ccc(N(C)C)cc1)C1CC1)OC ZINC001180558792 1121998455 /nfs/dbraw/zinc/99/84/55/1121998455.db2.gz UQTCYZRSRHIFRX-SFHVURJKSA-N 1 0 290.451 3.532 20 10 CHCDRO Cc1ccc(C[N@@H+]2CC[C@H](C(F)(F)F)C2(C)C)c(O)c1 ZINC001180907535 1122022952 /nfs/dbraw/zinc/02/29/52/1122022952.db2.gz QGORDNOYBPEOOC-ZDUSSCGKSA-N 1 0 287.325 3.863 20 10 CHCDRO CC(C)c1ccc(O)c(C[N@@H+]2CCSC[C@@H]2C2CC2)c1 ZINC001181901159 1122094212 /nfs/dbraw/zinc/09/42/12/1122094212.db2.gz QTYJFXWITLAVCK-MRXNPFEDSA-N 1 0 291.460 3.843 20 10 CHCDRO COc1cc(C)c(C[N@H+](C)Cc2cccc(C)c2C)c(O)c1 ZINC001182008136 1122106328 /nfs/dbraw/zinc/10/63/28/1122106328.db2.gz QZUZEOVVGOIBSE-UHFFFAOYSA-N 1 0 299.414 3.958 20 10 CHCDRO CN(C)c1ccc(/C=C\C[N@@H+]2CCC[C@H](C3CC3)C2)cc1 ZINC001182184889 1122117234 /nfs/dbraw/zinc/11/72/34/1122117234.db2.gz USSRUMHXALVURL-AJNOYIKESA-N 1 0 284.447 3.888 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+][C@@H]2CCO[C@@H](C(C)C)C2)c1O ZINC000271812886 1122176472 /nfs/dbraw/zinc/17/64/72/1122176472.db2.gz LHXVBRCWJOUQGU-HUUCEWRRSA-N 1 0 297.826 3.647 20 10 CHCDRO COC1CCC([N@H+](C)Cc2cc(Cl)cc(C)c2O)CC1 ZINC000271898891 1122181416 /nfs/dbraw/zinc/18/14/16/1122181416.db2.gz YUXBJHLBPPIOCR-UHFFFAOYSA-N 1 0 297.826 3.743 20 10 CHCDRO CC[C@@](C)([NH2+]Cc1cc(Cl)cc(OC)c1O)C1CC1 ZINC000691638785 1122220989 /nfs/dbraw/zinc/22/09/89/1122220989.db2.gz LKZQPYNBKLOGJO-OAHLLOKOSA-N 1 0 283.799 3.723 20 10 CHCDRO Cc1ccc([C@@H](O)C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)cc1 ZINC000273299389 1122226486 /nfs/dbraw/zinc/22/64/86/1122226486.db2.gz AZPYTQZFDCMSLD-YJBOKZPZSA-N 1 0 299.414 3.702 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCO[C@H](C)C1)c1cc(Cl)ccc1O ZINC000273347897 1122228961 /nfs/dbraw/zinc/22/89/61/1122228961.db2.gz BBCFRRYUCUGDAT-GRYCIOLGSA-N 1 0 283.799 3.511 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC[C@@H]2CCO[C@@H](C)C2)c(O)c1 ZINC000273386369 1122230399 /nfs/dbraw/zinc/23/03/99/1122230399.db2.gz CTMJLAVDHLXHEI-SOUVJXGZSA-N 1 0 277.408 3.556 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC[C@H]2CCO[C@@H](C)C2)c(O)c1C ZINC000273402678 1122232001 /nfs/dbraw/zinc/23/20/01/1122232001.db2.gz GQAHHJTYNIYUKP-BPUTZDHNSA-N 1 0 291.435 3.865 20 10 CHCDRO CCOc1ccc(C[NH2+][C@H](C)c2cc(F)ccc2O)cc1 ZINC000273441269 1122233132 /nfs/dbraw/zinc/23/31/32/1122233132.db2.gz YMEJTUOYASMZRK-GFCCVEGCSA-N 1 0 289.350 3.781 20 10 CHCDRO CC(C)C[C@@H]1C[C@H]([NH2+][C@H](C)c2cc(F)ccc2O)CCO1 ZINC000273533190 1122237525 /nfs/dbraw/zinc/23/75/25/1122237525.db2.gz WTPRZZZGXVITOS-BPLDGKMQSA-N 1 0 295.398 3.776 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](O)c2ccccc2C)c(O)c1C ZINC000273568859 1122238990 /nfs/dbraw/zinc/23/89/90/1122238990.db2.gz KHKNZQHLWBAMSI-QAPCUYQASA-N 1 0 299.414 3.702 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCc3c2cccc3O)c1 ZINC000273578142 1122239683 /nfs/dbraw/zinc/23/96/83/1122239683.db2.gz MFFWYQJZVKVKRG-LRDDRELGSA-N 1 0 283.371 3.744 20 10 CHCDRO Cc1cccc(CC[C@@H](C)[NH2+]Cc2c([O-])cccc2F)c1 ZINC001183919468 1122248743 /nfs/dbraw/zinc/24/87/43/1122248743.db2.gz LICRZQOFTVCDNL-CQSZACIVSA-N 1 0 287.378 3.951 20 10 CHCDRO CCc1cccc(C[NH2+]C[C@@H]2CC(C)(C)OC2(C)C)c1O ZINC001183981079 1122250451 /nfs/dbraw/zinc/25/04/51/1122250451.db2.gz JENGWKXWFPSNIR-HNNXBMFYSA-N 1 0 291.435 3.638 20 10 CHCDRO c1csc(SCCC[NH2+][C@H]2CCCc3occc32)n1 ZINC000192880058 1129043271 /nfs/dbraw/zinc/04/32/71/1129043271.db2.gz FGOWBOAFNXGGIF-LBPRGKRZSA-N 1 0 294.445 3.886 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(C#N)cc1F)c1ccccc1O ZINC000183322036 1129045237 /nfs/dbraw/zinc/04/52/37/1129045237.db2.gz HWQSOBIPDJTDBR-MRXNPFEDSA-N 1 0 284.334 3.644 20 10 CHCDRO C[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000071205982 1129045738 /nfs/dbraw/zinc/04/57/38/1129045738.db2.gz JOMHWVSPUWTPTI-QAPCUYQASA-N 1 0 272.436 3.955 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCC[C@H]2C)cc1 ZINC000071205993 1129045785 /nfs/dbraw/zinc/04/57/85/1129045785.db2.gz ILMJYGSBMUZUDR-PBHICJAKSA-N 1 0 260.425 3.811 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCC[C@H]2C)cc1 ZINC000071205992 1129046076 /nfs/dbraw/zinc/04/60/76/1129046076.db2.gz ILMJYGSBMUZUDR-RHSMWYFYSA-N 1 0 260.425 3.811 20 10 CHCDRO COc1cc(C[N@H+](C)Cc2ccc(N(C)C)cc2)ccc1C ZINC000774815208 1122312859 /nfs/dbraw/zinc/31/28/59/1122312859.db2.gz RDDHZLBFFXQNIY-UHFFFAOYSA-N 1 0 298.430 3.702 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](c1ccccc1)N(C)C)c1ccccc1O ZINC000192907386 1129046303 /nfs/dbraw/zinc/04/63/03/1129046303.db2.gz XQMRTVSJKPDIMO-MSOLQXFVSA-N 1 0 298.430 3.736 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)C[C@H]2CCC=CO2)cc1 ZINC000774820872 1122316882 /nfs/dbraw/zinc/31/68/82/1122316882.db2.gz IMCQTRRUZUPQCG-GOSISDBHSA-N 1 0 288.435 3.657 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H]2CC=CCC2)cc1Cl ZINC000825298095 1122427148 /nfs/dbraw/zinc/42/71/48/1122427148.db2.gz UWVJTRIEZILGMH-GFCCVEGCSA-N 1 0 251.757 3.552 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccc(N(C)C)cc1)c1ccccc1O ZINC000155545291 1122428839 /nfs/dbraw/zinc/42/88/39/1122428839.db2.gz UDTAGQCEOGLRKF-SFHVURJKSA-N 1 0 298.430 3.742 20 10 CHCDRO CCCN(Cc1ncc(CC)s1)c1ccc(C[NH3+])cc1 ZINC000775140973 1122440016 /nfs/dbraw/zinc/44/00/16/1122440016.db2.gz RTMGASXDUZXZBL-UHFFFAOYSA-N 1 0 289.448 3.581 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@H](C)CC1CCOCC1 ZINC000775140976 1122440162 /nfs/dbraw/zinc/44/01/62/1122440162.db2.gz RUKYIJPVCXOBCR-OAHLLOKOSA-N 1 0 290.451 3.567 20 10 CHCDRO C[C@H](Cc1ccccc1F)[NH2+][C@@H](C)c1ccccc1O ZINC000183438727 1129055036 /nfs/dbraw/zinc/05/50/36/1129055036.db2.gz JDIHTDPETNYSAQ-OLZOCXBDSA-N 1 0 273.351 3.813 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C[C@@H]2CCCCS2)cc1 ZINC000156318715 1122472077 /nfs/dbraw/zinc/47/20/77/1122472077.db2.gz OGAXVYOSFJUFPR-KRWDZBQOSA-N 1 0 292.492 3.908 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H]2CCCO[C@H]2CC(C)C)cc1C ZINC000775372104 1122531428 /nfs/dbraw/zinc/53/14/28/1122531428.db2.gz RRGULRZBUDOIJA-AEFFLSMTSA-N 1 0 291.435 3.692 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H]2CCCO[C@@H]2CC(C)C)cc1C ZINC000775372106 1122531479 /nfs/dbraw/zinc/53/14/79/1122531479.db2.gz RRGULRZBUDOIJA-SJLPKXTDSA-N 1 0 291.435 3.692 20 10 CHCDRO Cc1ccc(O[C@@H](C)C[NH2+][C@@H](C)c2ccccc2O)cc1 ZINC000183534486 1129060795 /nfs/dbraw/zinc/06/07/95/1129060795.db2.gz PQYHTDDFJCKIMF-GJZGRUSLSA-N 1 0 285.387 3.819 20 10 CHCDRO CC(C)COCC[N@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC001190437197 1122538127 /nfs/dbraw/zinc/53/81/27/1122538127.db2.gz UPGBSUGSISTHFM-UHFFFAOYSA-N 1 0 292.467 3.636 20 10 CHCDRO C[C@H](C[NH2+][C@@H](C)c1ccccc1O)Cc1cccs1 ZINC000183531605 1129061759 /nfs/dbraw/zinc/06/17/59/1129061759.db2.gz ISXQVXIEVWROQI-STQMWFEESA-N 1 0 275.417 3.983 20 10 CHCDRO CC[C@H]([NH2+]CCOc1ccc(C)cc1)c1ccccc1O ZINC000775412724 1122555337 /nfs/dbraw/zinc/55/53/37/1122555337.db2.gz OPVJCFPPONMUII-KRWDZBQOSA-N 1 0 285.387 3.820 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]CC[C@@H](C)c2ccccc2)c1 ZINC000071409348 1129062840 /nfs/dbraw/zinc/06/28/40/1129062840.db2.gz DKSOKRVBRYDYSS-OAHLLOKOSA-N 1 0 269.388 3.984 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CCC[C@@H]3CCC[C@@H]32)cc1 ZINC001191085825 1122576280 /nfs/dbraw/zinc/57/62/80/1122576280.db2.gz TWNJBDKKVAYKSF-WMZOPIPTSA-N 1 0 272.436 3.907 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](C)N1CCC[C@@H](C)C1)c1ccccc1O ZINC000775486518 1122616653 /nfs/dbraw/zinc/61/66/53/1122616653.db2.gz COAMLESNKKFORQ-VYDXJSESSA-N 1 0 290.451 3.553 20 10 CHCDRO CC[C@H]([NH2+]CCN(C)C1CCCCC1)c1ccccc1O ZINC000775489070 1122618218 /nfs/dbraw/zinc/61/82/18/1122618218.db2.gz MQVHPZBZBFNNGX-KRWDZBQOSA-N 1 0 290.451 3.697 20 10 CHCDRO CC[C@@H]([NH2+]CCc1c(F)cccc1F)c1ccccc1O ZINC000775490964 1122619432 /nfs/dbraw/zinc/61/94/32/1122619432.db2.gz FSBGLEMVLYSGMB-MRXNPFEDSA-N 1 0 291.341 3.954 20 10 CHCDRO CC[C@H]([NH2+]CC1CCOCC1)c1cc(Cl)ccc1O ZINC000775499574 1122627767 /nfs/dbraw/zinc/62/77/67/1122627767.db2.gz JTTXUQFZLKFNTA-AWEZNQCLSA-N 1 0 283.799 3.513 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1cnn(C)c1)c1cc(Cl)ccc1O ZINC000775508576 1122629876 /nfs/dbraw/zinc/62/98/76/1122629876.db2.gz CVEDUGRDNDCINM-IINYFYTJSA-N 1 0 293.798 3.581 20 10 CHCDRO CC[C@H]([NH2+]CCc1nccs1)c1cc(Cl)ccc1O ZINC000775500631 1122630041 /nfs/dbraw/zinc/63/00/41/1122630041.db2.gz VLYXRTKRVQTPKH-LBPRGKRZSA-N 1 0 296.823 3.786 20 10 CHCDRO CCC(CC)[C@H](O)C[NH2+][C@@H](CC)c1cc(Cl)ccc1O ZINC000775503158 1122631010 /nfs/dbraw/zinc/63/10/10/1122631010.db2.gz CTLRWNNUFFIVTQ-GOEBONIOSA-N 1 0 299.842 3.883 20 10 CHCDRO CC[C@H]([NH2+]CC(C)(C)OC)c1cc(Cl)ccc1O ZINC000775513189 1122633779 /nfs/dbraw/zinc/63/37/79/1122633779.db2.gz HNQFEPMQWBPURV-LBPRGKRZSA-N 1 0 271.788 3.511 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CC)C1CCOCC1)c1ccccc1O ZINC000775512051 1122633848 /nfs/dbraw/zinc/63/38/48/1122633848.db2.gz JNGIRTSZNAMXRX-JKSUJKDBSA-N 1 0 277.408 3.638 20 10 CHCDRO CCC[C@H](CCO)C[NH2+][C@@H](CC)c1cc(Cl)ccc1O ZINC000775512470 1122634980 /nfs/dbraw/zinc/63/49/80/1122634980.db2.gz LCWMVIJJNSLKJJ-DOMZBBRYSA-N 1 0 299.842 3.885 20 10 CHCDRO CC[C@H]([NH2+]Cc1ncccc1F)c1cc(Cl)ccc1O ZINC000775523194 1122638558 /nfs/dbraw/zinc/63/85/58/1122638558.db2.gz DWKKSNDFRPOEBA-ZDUSSCGKSA-N 1 0 294.757 3.821 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1cn[nH]c1)c1cc(Cl)ccc1O ZINC000775522934 1122639630 /nfs/dbraw/zinc/63/96/30/1122639630.db2.gz BYHGELQOQKIYFD-ZANVPECISA-N 1 0 279.771 3.571 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](C)SC)c1cc(Cl)ccc1O ZINC000775524666 1122641888 /nfs/dbraw/zinc/64/18/88/1122641888.db2.gz VRWNVBNHMLDKGY-SKDRFNHKSA-N 1 0 273.829 3.838 20 10 CHCDRO CC[C@H]([NH2+][C@H](CO)c1sccc1C)c1ccccc1O ZINC000775524498 1122642796 /nfs/dbraw/zinc/64/27/96/1122642796.db2.gz APNUEOUFYRDOHK-UONOGXRCSA-N 1 0 291.416 3.536 20 10 CHCDRO CC[C@H]([NH2+][C@@H](c1cccnc1)C1CC1)c1ccccc1O ZINC000775526626 1122643567 /nfs/dbraw/zinc/64/35/67/1122643567.db2.gz SKBALXZFDJCXLX-FUHWJXTLSA-N 1 0 282.387 3.979 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(OC)cc1F)c1ccccc1O ZINC000775526511 1122643624 /nfs/dbraw/zinc/64/36/24/1122643624.db2.gz KWBBLHSABMKOHJ-INIZCTEOSA-N 1 0 289.350 3.781 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCSC1)c1cc(Cl)ccc1O ZINC000775527537 1122644376 /nfs/dbraw/zinc/64/43/76/1122644376.db2.gz QZLQYHFIEGCUBD-PWSUYJOCSA-N 1 0 271.813 3.592 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)c1ccc(N(C)C)cc1)c1cncs1 ZINC000775580925 1122681292 /nfs/dbraw/zinc/68/12/92/1122681292.db2.gz DOMOUONRXNMYET-VXGBXAGGSA-N 1 0 275.421 3.621 20 10 CHCDRO CC[C@H]1CC[N@H+](Cc2ccc(N(C)C)c(C)c2)[C@H]1C ZINC001193603177 1122705068 /nfs/dbraw/zinc/70/50/68/1122705068.db2.gz AOLPRNGGXBKFML-HOCLYGCPSA-N 1 0 260.425 3.681 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1ccccc1O)c1c(C)noc1C ZINC000183630576 1129072769 /nfs/dbraw/zinc/07/27/69/1129072769.db2.gz JGYHBSRHWXKGNM-YGRLFVJLSA-N 1 0 274.364 3.799 20 10 CHCDRO COc1ccc(C[C@H](C)C[NH2+][C@@H](C)c2ccccc2O)cc1 ZINC000183631303 1129072904 /nfs/dbraw/zinc/07/29/04/1129072904.db2.gz ZHPGZDHWTOAVKW-GJZGRUSLSA-N 1 0 299.414 3.930 20 10 CHCDRO CCC[N@@H+](Cc1ccccc1O)C[C@H]1CCC(C)(C)O1 ZINC000775609987 1122799127 /nfs/dbraw/zinc/79/91/27/1122799127.db2.gz HVQLQENBRRPWND-OAHLLOKOSA-N 1 0 277.408 3.562 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2nc(C)cs2)c1 ZINC000080273402 1129080013 /nfs/dbraw/zinc/08/00/13/1129080013.db2.gz IIBXYNQPVZSJSB-MNOVXSKESA-N 1 0 292.404 3.578 20 10 CHCDRO CCOC(C)(C)C[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2C ZINC000159253428 1122800411 /nfs/dbraw/zinc/80/04/11/1122800411.db2.gz XEDUIJLKMHKUQR-STQMWFEESA-N 1 0 277.408 3.654 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2cc(Cl)cc(C)c2O)o1 ZINC000775642463 1122851429 /nfs/dbraw/zinc/85/14/29/1122851429.db2.gz KUXHOBYUEJRRNA-UHFFFAOYSA-N 1 0 279.767 3.887 20 10 CHCDRO COc1ccc(O)c(C[N@H+](C)Cc2ccc(Cl)s2)c1 ZINC000775645624 1122854194 /nfs/dbraw/zinc/85/41/94/1122854194.db2.gz CEMBGAMHOHBYHB-UHFFFAOYSA-N 1 0 297.807 3.748 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CCC[C@H]2Cc2ccccc2)c1 ZINC000775648093 1122856504 /nfs/dbraw/zinc/85/65/04/1122856504.db2.gz QPHOARKHUVGIHI-KRWDZBQOSA-N 1 0 297.398 3.608 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCOc3ccccc3[C@@H]2C)c1O ZINC000775657547 1122871311 /nfs/dbraw/zinc/87/13/11/1122871311.db2.gz CVAVDQRQQDIJQQ-AWEZNQCLSA-N 1 0 283.371 3.656 20 10 CHCDRO CCC1([NH2+]Cc2ccc(OC)c(OC)c2O)CCCCC1 ZINC000894737306 1122900307 /nfs/dbraw/zinc/90/03/07/1122900307.db2.gz UXOYEHXERHYDET-UHFFFAOYSA-N 1 0 293.407 3.612 20 10 CHCDRO CCC(C)(C)[N@H+](C)Cc1cc(Cl)cc(C)c1O ZINC000775689339 1122909052 /nfs/dbraw/zinc/90/90/52/1122909052.db2.gz GZTYGHHNNPUBLM-UHFFFAOYSA-N 1 0 255.789 3.974 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2CCC3(CCC3)C2)c1O ZINC000775701269 1122911758 /nfs/dbraw/zinc/91/17/58/1122911758.db2.gz QCDWNHSCKPLGEC-UHFFFAOYSA-N 1 0 265.784 3.730 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2C[C@H](c3ccccc3)C[C@@H]2C)c1 ZINC000775702331 1122913875 /nfs/dbraw/zinc/91/38/75/1122913875.db2.gz QAIALTXJPQFYDL-GOEBONIOSA-N 1 0 297.398 3.779 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+]2CCS[C@H](C)[C@H]2C)c1O ZINC000775702382 1122914251 /nfs/dbraw/zinc/91/42/51/1122914251.db2.gz RZDMJBLKPBJJJA-GHMZBOCLSA-N 1 0 285.840 3.680 20 10 CHCDRO Cc1cccc(C[N@@H+]2CC[C@H]2c2cccc(F)c2)c1O ZINC000775726649 1122926915 /nfs/dbraw/zinc/92/69/15/1122926915.db2.gz YTQAHJWSAGHSCM-INIZCTEOSA-N 1 0 271.335 3.787 20 10 CHCDRO Cc1cccc(C[N@H+]2C[C@H](C)[C@@H]2c2ccccc2)c1O ZINC000775735572 1122929020 /nfs/dbraw/zinc/92/90/20/1122929020.db2.gz WOYZNCZOUMBWTM-WMLDXEAASA-N 1 0 267.372 3.894 20 10 CHCDRO CCCC[NH+](CCCC)Cc1ccc(O)c(O)c1 ZINC001203882181 1122966256 /nfs/dbraw/zinc/96/62/56/1122966256.db2.gz FZWNAVVYTIEROO-UHFFFAOYSA-N 1 0 251.370 3.500 20 10 CHCDRO Cc1ccc(CC[NH2+]Cc2c(C)c3ccccc3n2C)o1 ZINC001199257823 1123025127 /nfs/dbraw/zinc/02/51/27/1123025127.db2.gz IIZGFLQPJOXVBN-UHFFFAOYSA-N 1 0 282.387 3.720 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)C/C=C/c2ccccc2)cc1 ZINC001203937862 1123033675 /nfs/dbraw/zinc/03/36/75/1123033675.db2.gz WBMPQNBGYZYRMV-JXMROGBWSA-N 1 0 280.415 3.898 20 10 CHCDRO C[C@H]1CCC[C@@H](C[NH2+]Cc2cc(F)c(N(C)C)cc2F)C1 ZINC001199759393 1123039336 /nfs/dbraw/zinc/03/93/36/1123039336.db2.gz JIGQJWLDJPERJS-QWHCGFSZSA-N 1 0 296.405 3.947 20 10 CHCDRO CC(=O)c1cc(F)cc(C[NH2+]C(C(C)C)C(C)C)c1O ZINC000776027044 1123042874 /nfs/dbraw/zinc/04/28/74/1123042874.db2.gz XJSGJYAVNQEFCP-UHFFFAOYSA-N 1 0 281.371 3.504 20 10 CHCDRO C[C@H](Cc1ccccc1F)[NH2+]Cc1cccc(Cl)c1[O-] ZINC000776038597 1123050560 /nfs/dbraw/zinc/05/05/60/1123050560.db2.gz IPQFYMLBVDFHDZ-LLVKDONJSA-N 1 0 293.769 3.906 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]Cc1cc(F)ccc1F ZINC000105496126 1123054219 /nfs/dbraw/zinc/05/42/19/1123054219.db2.gz KTPRMJQVFHJZQY-UHFFFAOYSA-N 1 0 283.705 3.614 20 10 CHCDRO CCCC1(C[NH2+]Cc2ccc(OC)c(COCC)c2)CC1 ZINC001201381099 1123094318 /nfs/dbraw/zinc/09/43/18/1123094318.db2.gz ZNZRXTSTYWJLTA-UHFFFAOYSA-N 1 0 291.435 3.902 20 10 CHCDRO Cc1cccc(C[NH2+]Cc2coc3ccccc23)c1O ZINC000776174863 1123101516 /nfs/dbraw/zinc/10/15/16/1123101516.db2.gz ICQVAIZBTVGHDU-UHFFFAOYSA-N 1 0 267.328 3.737 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]CC1Cc2ccccc2C1 ZINC000776175054 1123102586 /nfs/dbraw/zinc/10/25/86/1123102586.db2.gz FYICMIVVEJPCFX-UHFFFAOYSA-N 1 0 287.790 3.550 20 10 CHCDRO CC[C@@H]1CCC[C@@H]1[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC001201449604 1123106396 /nfs/dbraw/zinc/10/63/96/1123106396.db2.gz IMOOAJWKJNVNMW-LLHDCHNASA-N 1 0 272.436 3.934 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]CC12CCC(CC1)C2 ZINC001201794809 1123150622 /nfs/dbraw/zinc/15/06/22/1123150622.db2.gz JGRFDLSIZIAOMI-UHFFFAOYSA-N 1 0 265.784 3.716 20 10 CHCDRO Cc1ccc(CC[C@@H](C)[NH2+]Cc2cccc(C)c2O)o1 ZINC000776218949 1123153278 /nfs/dbraw/zinc/15/32/78/1123153278.db2.gz DAQCCQIYKHTWGN-CYBMUJFWSA-N 1 0 273.376 3.713 20 10 CHCDRO Cc1cccc(C[NH2+][C@H](C)[C@@H]2Oc3ccccc3[C@H]2C)c1O ZINC000776230456 1123159606 /nfs/dbraw/zinc/15/96/06/1123159606.db2.gz ITQPILMLPXRSQT-PJIJBLCYSA-N 1 0 297.398 3.743 20 10 CHCDRO CCC(CC)[C@@H](CC[NH2+]Cc1cccc(C)c1O)OC ZINC000776253509 1123179836 /nfs/dbraw/zinc/17/98/36/1123179836.db2.gz RKGCZVDLALHWKV-MRXNPFEDSA-N 1 0 279.424 3.632 20 10 CHCDRO C[C@@H]1CC[C@@H](C[NH2+]C/C=C/c2ccc(N(C)C)cc2)C1 ZINC001202249937 1123190170 /nfs/dbraw/zinc/19/01/70/1123190170.db2.gz BWLKLEJOTYDSHP-GWOVIKRFSA-N 1 0 272.436 3.792 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](C)[C@H]2CCCOC2)cc1 ZINC000780747104 1123227116 /nfs/dbraw/zinc/22/71/16/1123227116.db2.gz WMUBQBRDJREOTA-ZOBUZTSGSA-N 1 0 290.451 3.608 20 10 CHCDRO Cc1ccc2cc(C[NH2+]Cc3ccc4c(c3)CCO4)[nH]c2c1 ZINC000850112170 1123243226 /nfs/dbraw/zinc/24/32/26/1123243226.db2.gz UOYSYDBTRJUBML-UHFFFAOYSA-N 1 0 292.382 3.701 20 10 CHCDRO COCc1csc(C[NH2+]Cc2ccc(OC)c(C)c2)c1 ZINC000850113717 1123243259 /nfs/dbraw/zinc/24/32/59/1123243259.db2.gz SKANDCPZCQRRMX-UHFFFAOYSA-N 1 0 291.416 3.501 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cnn(CC2CCC2)c1)c1ccccc1O ZINC000895132963 1123244477 /nfs/dbraw/zinc/24/44/77/1123244477.db2.gz DNNCIALSNLDAEZ-QGZVFWFLSA-N 1 0 299.418 3.630 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]Cc2cc(C)cc(C)c2)c1 ZINC000850367172 1123257308 /nfs/dbraw/zinc/25/73/08/1123257308.db2.gz UROUBFNJWAIFLJ-UHFFFAOYSA-N 1 0 285.387 3.698 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H](C)C2CCC(F)CC2)c1O ZINC000850395187 1123261878 /nfs/dbraw/zinc/26/18/78/1123261878.db2.gz DXTMVAVHINWDNN-OPFPJEHXSA-N 1 0 295.398 3.797 20 10 CHCDRO CCOCc1cc(C[NH2+][C@H](C(C)C)C2CC2)ccc1OC ZINC000850396802 1123262609 /nfs/dbraw/zinc/26/26/09/1123262609.db2.gz AVRUIRGUAJYUFS-GOSISDBHSA-N 1 0 291.435 3.756 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCCN2C)C(C)(C)C(F)F ZINC000850430683 1123266218 /nfs/dbraw/zinc/26/62/18/1123266218.db2.gz OFNFJOLXNUUPKX-LBPRGKRZSA-N 1 0 296.405 3.838 20 10 CHCDRO CC[C@@H]([NH2+]CCC1CC(OC)C1)c1ccc(C)cc1O ZINC000850481712 1123273724 /nfs/dbraw/zinc/27/37/24/1123273724.db2.gz JCRSVIXJCGAIRZ-ZBCRRDGASA-N 1 0 277.408 3.556 20 10 CHCDRO CC[C@H]([NH2+][C@H]1COC(C)(C)C1)c1cc(Cl)ccc1O ZINC000850483242 1123274488 /nfs/dbraw/zinc/27/44/88/1123274488.db2.gz VLCKEIUTWODJKD-YPMHNXCESA-N 1 0 283.799 3.654 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCN(C(C)(C)C)C1)c1cc(Cl)ccc1O ZINC000850494848 1123275051 /nfs/dbraw/zinc/27/50/51/1123275051.db2.gz SXTPXMFCOHXCHT-DGCLKSJQSA-N 1 0 296.842 3.569 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCc2cnccc2C)c(O)c1C ZINC000850507085 1123277352 /nfs/dbraw/zinc/27/73/52/1123277352.db2.gz MFWHARSWNVKAED-OAHLLOKOSA-N 1 0 284.403 3.606 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H]2Cc3ccccc3[C@@H]2C)c1O ZINC000850517906 1123278667 /nfs/dbraw/zinc/27/86/67/1123278667.db2.gz HKTSKHMGJJOGCC-GDZNZVCISA-N 1 0 297.398 3.780 20 10 CHCDRO CC[C@H]([NH2+][C@H]1COC2(CCC2)C1)c1cc(Cl)ccc1O ZINC000850523339 1123280242 /nfs/dbraw/zinc/28/02/42/1123280242.db2.gz GRWJSSJMLZZKPN-OCCSQVGLSA-N 1 0 295.810 3.798 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1COC2(CCC2)C1)c1ccc(N(C)C)cc1 ZINC000850524299 1123280927 /nfs/dbraw/zinc/28/09/27/1123280927.db2.gz GCKYPRPWEDKZEC-RDJZCZTQSA-N 1 0 288.435 3.505 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2C[C@@H](O)c3ccccc32)c1 ZINC000850526395 1123282091 /nfs/dbraw/zinc/28/20/91/1123282091.db2.gz BUVJEQKCWRXCJU-ULFGMLNVSA-N 1 0 283.371 3.530 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1cc(Cl)ccc1O)C1CC1 ZINC000850539150 1123287801 /nfs/dbraw/zinc/28/78/01/1123287801.db2.gz BEFXVKYZAOTNCQ-NOZJJQNGSA-N 1 0 253.773 3.885 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCC[C@@H](C)O1)c1ccc(Cl)cc1O ZINC000850534042 1123286005 /nfs/dbraw/zinc/28/60/05/1123286005.db2.gz FSZRHRKZCGTOOB-NQBHXWOUSA-N 1 0 283.799 3.654 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@]2(C)CC2(F)F)c(O)c1 ZINC000850536890 1123286955 /nfs/dbraw/zinc/28/69/55/1123286955.db2.gz OSJOEBGGUAYOEO-FZMZJTMJSA-N 1 0 269.335 3.705 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1cc(Cl)ccc1O)C1CC1 ZINC000850539152 1123287787 /nfs/dbraw/zinc/28/77/87/1123287787.db2.gz BEFXVKYZAOTNCQ-RNCFNFMXSA-N 1 0 253.773 3.885 20 10 CHCDRO C[C@H]([NH2+]C[C@H](CO)CC1CC1)c1ccc2ccccc2c1O ZINC000850544935 1123289148 /nfs/dbraw/zinc/28/91/48/1123289148.db2.gz KRSZEYYESRKFOK-DZGCQCFKSA-N 1 0 299.414 3.605 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCc2ccc(O)cc21)c1cc(F)ccc1O ZINC000850543409 1123289331 /nfs/dbraw/zinc/28/93/31/1123289331.db2.gz JDBCWIMBXZHERL-QFYYESIMSA-N 1 0 287.334 3.575 20 10 CHCDRO CC[C@H]([NH2+]CC1CCC(O)CC1)c1cc(Cl)ccc1O ZINC000850553700 1123290670 /nfs/dbraw/zinc/29/06/70/1123290670.db2.gz AVYGLUGQZMOACM-HGMXIMQMSA-N 1 0 297.826 3.637 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCc2cccc(O)c21)C1CCC(F)CC1 ZINC000850555986 1123290978 /nfs/dbraw/zinc/29/09/78/1123290978.db2.gz QDERRIUOCIIBSI-TYVCDUJCSA-N 1 0 277.383 3.886 20 10 CHCDRO CC(C)CC1([NH2+][C@H](C)c2cc(F)ccc2O)CC1 ZINC000850567177 1123293472 /nfs/dbraw/zinc/29/34/72/1123293472.db2.gz XZDXLRBHZLIEJF-LLVKDONJSA-N 1 0 251.345 3.761 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](O)[C@@H](C)c2ccccc2)c(O)c1 ZINC000850573461 1123294913 /nfs/dbraw/zinc/29/49/13/1123294913.db2.gz MIRKEEXRLBQZNW-YZVOILCLSA-N 1 0 299.414 3.516 20 10 CHCDRO COc1ccc(Cl)cc1C[N@H+](C)Cc1ccccc1O ZINC000109769176 1123326603 /nfs/dbraw/zinc/32/66/03/1123326603.db2.gz YCBBDYVNTFBWNC-UHFFFAOYSA-N 1 0 291.778 3.686 20 10 CHCDRO C[C@H](c1ccc(F)cc1F)[N@H+](C)Cc1ccccc1O ZINC000109773824 1123326765 /nfs/dbraw/zinc/32/67/65/1123326765.db2.gz DEQVJTDEPKFVFL-LLVKDONJSA-N 1 0 277.314 3.863 20 10 CHCDRO C[C@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1ccccc1O ZINC000797585734 1123396180 /nfs/dbraw/zinc/39/61/80/1123396180.db2.gz MOBJRLDBTICJIJ-QMMMGPOBSA-N 1 0 299.267 3.799 20 10 CHCDRO Cc1cc(C)c(O)c(C[NH+]2CCC(c3ccco3)CC2)c1 ZINC000853527491 1123442647 /nfs/dbraw/zinc/44/26/47/1123442647.db2.gz WEHUPIHGJDCUNT-UHFFFAOYSA-N 1 0 285.387 3.982 20 10 CHCDRO COc1cccc(C[NH2+][C@H]2CCC[C@@H]2c2ccccc2)c1O ZINC000111413011 1123444202 /nfs/dbraw/zinc/44/42/02/1123444202.db2.gz FBEXTOMGGBZFDI-SJORKVTESA-N 1 0 297.398 3.827 20 10 CHCDRO COc1cc(C)cc(C[NH2+][C@@H](C)C2CCC(F)CC2)c1O ZINC000895327361 1123456998 /nfs/dbraw/zinc/45/69/98/1123456998.db2.gz MRUTXASMRUEWPN-OPFPJEHXSA-N 1 0 295.398 3.716 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCc3cc(N)ccc32)c1 ZINC000854225721 1123478264 /nfs/dbraw/zinc/47/82/64/1123478264.db2.gz JTVKXMWAAJGYNC-SJCJKPOMSA-N 1 0 282.387 3.621 20 10 CHCDRO Cc1cccc(C[NH2+]CC[C@@H]2CCCC2(F)F)c1O ZINC000895545578 1123491220 /nfs/dbraw/zinc/49/12/20/1123491220.db2.gz SDNJCZQATAYICJ-ZDUSSCGKSA-N 1 0 269.335 3.616 20 10 CHCDRO Oc1c(C[NH2+]C2CCC3(COC3)CC2)ccc2ccccc21 ZINC000895695343 1123506623 /nfs/dbraw/zinc/50/66/23/1123506623.db2.gz VDBPPTLZPRSMQQ-UHFFFAOYSA-N 1 0 297.398 3.594 20 10 CHCDRO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)CC2 ZINC000113310462 1123518711 /nfs/dbraw/zinc/51/87/11/1123518711.db2.gz SMPKDWPCYIIGSK-IBGZPJMESA-N 1 0 280.415 3.838 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2cccc(OC(F)F)c2)c1 ZINC000113336959 1123521717 /nfs/dbraw/zinc/52/17/17/1123521717.db2.gz YTULHQUTBZYBBO-UHFFFAOYSA-N 1 0 293.313 3.592 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2c(C)cc(C)cc2C)c1 ZINC000113330721 1123522051 /nfs/dbraw/zinc/52/20/51/1123522051.db2.gz KZSSNKHNCBTBAM-UHFFFAOYSA-N 1 0 269.388 3.916 20 10 CHCDRO Oc1ccccc1C[N@H+](Cc1cscn1)C1CCCC1 ZINC000113506126 1123529796 /nfs/dbraw/zinc/52/97/96/1123529796.db2.gz IIQNYSWJFHLLLR-UHFFFAOYSA-N 1 0 288.416 3.794 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH+]1CC(Cc2ccsc2)C1 ZINC000857067688 1123584221 /nfs/dbraw/zinc/58/42/21/1123584221.db2.gz DTUCCLSOSAMCLX-UHFFFAOYSA-N 1 0 293.819 3.782 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CC[C@@H]2CC2(F)F)c(O)c1 ZINC000857081921 1123586148 /nfs/dbraw/zinc/58/61/48/1123586148.db2.gz RKWDCHRBOIBUKJ-NWDGAFQWSA-N 1 0 269.335 3.705 20 10 CHCDRO Cc1cc(F)ccc1[C@@H](C)[NH2+]Cc1cc(F)ccc1O ZINC000896801945 1123628591 /nfs/dbraw/zinc/62/85/91/1123628591.db2.gz UULPFMQEHIELFJ-LLVKDONJSA-N 1 0 277.314 3.830 20 10 CHCDRO Fc1cc(C[NH2+]Cc2ccc(N3CCCCC3)cc2)ccn1 ZINC000858115522 1123632819 /nfs/dbraw/zinc/63/28/19/1123632819.db2.gz IKLAZCITBYNAED-UHFFFAOYSA-N 1 0 299.393 3.501 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2ncc(C(C)(C)C)s2)c1 ZINC000858239999 1123639275 /nfs/dbraw/zinc/63/92/75/1123639275.db2.gz YOFUSACIDJSQDG-UHFFFAOYSA-N 1 0 290.432 3.744 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CC[C@H]2CC=CCC2)c1O ZINC000858515212 1123658963 /nfs/dbraw/zinc/65/89/63/1123658963.db2.gz FKJWJAATZPCPTA-KBPBESRZSA-N 1 0 275.392 3.798 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1ccns1)c1ccc(C)cc1O ZINC000858578291 1123664930 /nfs/dbraw/zinc/66/49/30/1123664930.db2.gz YEPHYHGAYADSFR-WCQYABFASA-N 1 0 276.405 3.959 20 10 CHCDRO Oc1cccc(Br)c1C[N@@H+]1CCC[C@H]1C1CC1 ZINC000862239194 1123794254 /nfs/dbraw/zinc/79/42/54/1123794254.db2.gz YRSKCCXCBCZWBM-ZDUSSCGKSA-N 1 0 296.208 3.529 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2C[C@@H](C)C(F)(F)[C@@H](C)C2)cc1C ZINC000862444485 1123810746 /nfs/dbraw/zinc/81/07/46/1123810746.db2.gz XGDYLZWKZDRFCD-BETUJISGSA-N 1 0 283.362 3.732 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CC[C@H](c3ccc(O)cc3)C2)cc1C ZINC000862540818 1123817819 /nfs/dbraw/zinc/81/78/19/1123817819.db2.gz KOJWCEPTDBEEHW-INIZCTEOSA-N 1 0 297.398 3.704 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+][C@@H]1CCc2ccc(Cl)cc21 ZINC000862539824 1123818342 /nfs/dbraw/zinc/81/83/42/1123818342.db2.gz WFONBXPPUOSRII-OAHLLOKOSA-N 1 0 291.753 3.962 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2c(F)cc(C)cc2F)c(O)c1 ZINC000897213035 1123846949 /nfs/dbraw/zinc/84/69/49/1123846949.db2.gz MYCJNIFSAGOHKR-UHFFFAOYSA-N 1 0 277.314 3.577 20 10 CHCDRO CCOc1cccc(C[N@H+](C)[C@@H](C)c2ccccc2)c1O ZINC000119376066 1123857315 /nfs/dbraw/zinc/85/73/15/1123857315.db2.gz GRXBMXHLNWVJHJ-AWEZNQCLSA-N 1 0 285.387 3.984 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CS[C@@H](C)C1)c1cccc(Cl)c1[O-] ZINC000840860981 1123862313 /nfs/dbraw/zinc/86/23/13/1123862313.db2.gz YKMOSTLBSYJRFO-KWBADKCTSA-N 1 0 285.840 3.980 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CC3(CCC3)C[C@@H]2C)c1O ZINC000763644827 1129150863 /nfs/dbraw/zinc/15/08/63/1129150863.db2.gz ADRZVTADAVHPDK-NSHDSACASA-N 1 0 295.810 3.819 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CC3(CCC3)C[C@@H]2C)c(O)c1 ZINC000763645536 1129153547 /nfs/dbraw/zinc/15/35/47/1129153547.db2.gz HQHWAQLPKPULPW-ZDUSSCGKSA-N 1 0 275.392 3.555 20 10 CHCDRO COc1cc(C)cc(C[N@H+](CC2CC2)CC2CCC2)c1O ZINC000794711437 1123941989 /nfs/dbraw/zinc/94/19/89/1123941989.db2.gz RWUUYYATFHMIPS-UHFFFAOYSA-N 1 0 289.419 3.721 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccc(OC)cc1)c1ccc(C)cc1O ZINC000794791573 1123948841 /nfs/dbraw/zinc/94/88/41/1123948841.db2.gz BAYRQDSUWJACMV-GOSISDBHSA-N 1 0 299.414 3.993 20 10 CHCDRO CC[C@H]([NH2+]CC(CC)(CC)CCO)c1ccc(C)cc1O ZINC000794801920 1123950276 /nfs/dbraw/zinc/95/02/76/1123950276.db2.gz LXUZCCZVKJWGBM-INIZCTEOSA-N 1 0 293.451 3.930 20 10 CHCDRO CC[C@H]([NH2+]CC(C)(C)SC)c1ccc(C)cc1O ZINC000794800343 1123950925 /nfs/dbraw/zinc/95/09/25/1123950925.db2.gz CTKLLRFXJKICTL-ZDUSSCGKSA-N 1 0 267.438 3.883 20 10 CHCDRO CC[C@H]([NH2+][C@H]1COc2ccccc2C1)c1ccc(C)cc1O ZINC000794802515 1123950936 /nfs/dbraw/zinc/95/09/36/1123950936.db2.gz FVTYRDCTIWFCSQ-WBVHZDCISA-N 1 0 297.398 3.745 20 10 CHCDRO CCc1nc(C[NH2+][C@H](CC)c2ccc(C)cc2O)cs1 ZINC000794803616 1123952878 /nfs/dbraw/zinc/95/28/78/1123952878.db2.gz BINFMFBRGRGMKS-CQSZACIVSA-N 1 0 290.432 3.960 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)CC(C)(C)OC)c1ccc(C)cc1O ZINC000794803724 1123953427 /nfs/dbraw/zinc/95/34/27/1123953427.db2.gz SMSKBBGIRINUEA-UKRRQHHQSA-N 1 0 279.424 3.945 20 10 CHCDRO CC[C@H]([NH2+]C[C@](C)(O)c1ccccc1)c1ccc(C)cc1O ZINC000794807840 1123956337 /nfs/dbraw/zinc/95/63/37/1123956337.db2.gz MBYBKNIVYVBEMV-HKUYNNGSSA-N 1 0 299.414 3.649 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)[C@@H]1CCCOC1)c1ccc(C)cc1O ZINC000794818127 1123960606 /nfs/dbraw/zinc/96/06/06/1123960606.db2.gz QIKPQIFIZLRKFO-FMKPAKJESA-N 1 0 277.408 3.556 20 10 CHCDRO C[C@H]([NH2+]CCC1(C)CC1)c1ccc(Br)cc1O ZINC000794829995 1123962679 /nfs/dbraw/zinc/96/26/79/1123962679.db2.gz XEYJUBQPKKBKLX-JTQLQIEISA-N 1 0 298.224 3.996 20 10 CHCDRO COC1(C[NH2+][C@@H](C)c2ccc(C)cc2O)CCC(C)CC1 ZINC000794834337 1123964947 /nfs/dbraw/zinc/96/49/47/1123964947.db2.gz MWWIAJBZMQMCAL-DBQDNQAGSA-N 1 0 291.435 3.947 20 10 CHCDRO CC[C@@H]([NH2+]C1CCC(COC)CC1)c1ccccc1O ZINC000840882494 1123971944 /nfs/dbraw/zinc/97/19/44/1123971944.db2.gz WATUTFCQDNAQMC-ZBCRRDGASA-N 1 0 277.408 3.638 20 10 CHCDRO CCOc1cc(F)cc(C[NH2+]Cc2cc(C)ccc2O)c1 ZINC000865640516 1124001608 /nfs/dbraw/zinc/00/16/08/1124001608.db2.gz KTTRUZPNWXNPGB-UHFFFAOYSA-N 1 0 289.350 3.528 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2C[C@H](C)[C@@H]3CCCC[C@H]32)c1 ZINC000783592787 1124001689 /nfs/dbraw/zinc/00/16/89/1124001689.db2.gz KLDRFSWRTMLTFV-RRQGHBQHSA-N 1 0 289.419 3.801 20 10 CHCDRO Cc1cc(O)c(C[NH2+]Cc2cccc(F)c2F)cc1C ZINC000865676847 1124003889 /nfs/dbraw/zinc/00/38/89/1124003889.db2.gz PFFJHWHOTSLFDP-UHFFFAOYSA-N 1 0 277.314 3.577 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C[C@@H]2CC=CC[C@H]2C(F)(F)F)c1 ZINC000865781604 1124014351 /nfs/dbraw/zinc/01/43/51/1124014351.db2.gz DJPZSQHPWANWMI-GXTWGEPZSA-N 1 0 299.336 3.935 20 10 CHCDRO Oc1ccccc1C[NH2+][C@@H](Cc1cccnc1)C1CCCC1 ZINC000865835154 1124019948 /nfs/dbraw/zinc/01/99/48/1124019948.db2.gz ZULJBXMVUUNWLB-SFHVURJKSA-N 1 0 296.414 3.678 20 10 CHCDRO CC(C)[N@H+](Cc1cc(Br)ccc1O)C1CC1 ZINC000121320292 1124024969 /nfs/dbraw/zinc/02/49/69/1124024969.db2.gz GMRWAHBRESXVKT-UHFFFAOYSA-N 1 0 284.197 3.528 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCCc2ncccc21 ZINC000866267742 1124044379 /nfs/dbraw/zinc/04/43/79/1124044379.db2.gz HMMGBOQIWFBSBP-IBGZPJMESA-N 1 0 295.430 3.623 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccnc(F)c1)c1ccc(N(C)C)cc1 ZINC000866472979 1124069121 /nfs/dbraw/zinc/06/91/21/1124069121.db2.gz IGKRWTJCXWUBAU-INIZCTEOSA-N 1 0 287.382 3.528 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)o1 ZINC000866478783 1124069647 /nfs/dbraw/zinc/06/96/47/1124069647.db2.gz MNNLMIOQFZRSIL-JTQLQIEISA-N 1 0 265.740 3.798 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@@H](C)CC2CCC2)c1O ZINC000866487166 1124071884 /nfs/dbraw/zinc/07/18/84/1124071884.db2.gz VJAWIXJCANBHAR-NWDGAFQWSA-N 1 0 263.381 3.630 20 10 CHCDRO C[C@H]([NH2+][C@@H](C1CCC1)[C@@H]1CCCO1)c1cc(F)ccc1O ZINC000866491472 1124072697 /nfs/dbraw/zinc/07/26/97/1124072697.db2.gz RWQGTOCNMZXTJZ-GOPGUHFVSA-N 1 0 293.382 3.530 20 10 CHCDRO C[C@H]1C[C@@H]([NH2+][C@@H]2C[C@H]2C(F)(F)F)c2c1c(F)ccc2O ZINC000866499022 1124073123 /nfs/dbraw/zinc/07/31/23/1124073123.db2.gz CWQBXKAJGJTLPP-MVHNUAHISA-N 1 0 289.272 3.620 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cccc(OC)c1)c1ccccc1O ZINC000037680203 1129165380 /nfs/dbraw/zinc/16/53/80/1129165380.db2.gz ZYWJHJNPNYKDPV-MRXNPFEDSA-N 1 0 271.360 3.642 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C2([C@H]3CCCCO3)CCC2)c(O)c1 ZINC000866622963 1124091228 /nfs/dbraw/zinc/09/12/28/1124091228.db2.gz KTNYAKULLASEAQ-WMLDXEAASA-N 1 0 289.419 3.843 20 10 CHCDRO COC[C@@H]([NH2+][C@H](C)c1ccc2ccccc2c1O)C(C)C ZINC000086683222 1129166308 /nfs/dbraw/zinc/16/63/08/1129166308.db2.gz AUHJOALZCLSJEZ-CXAGYDPISA-N 1 0 287.403 3.867 20 10 CHCDRO C[C@@H]1[C@H](c2ccccc2)CC[N@@H+]1Cc1ccc(N)cc1 ZINC001120370825 1131274597 /nfs/dbraw/zinc/27/45/97/1131274597.db2.gz GOGFBAGOKGDEHO-RDTXWAMCSA-N 1 0 266.388 3.647 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC2(OC(C)C)CCC2)c(O)c1 ZINC000872116625 1124687651 /nfs/dbraw/zinc/68/76/51/1124687651.db2.gz UBEALHDJPBKQDD-CQSZACIVSA-N 1 0 277.408 3.699 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2nccnc2C)c(O)c1C ZINC000872134331 1124692485 /nfs/dbraw/zinc/69/24/85/1124692485.db2.gz RKVKNYSNZZOGPI-JSGCOSHPSA-N 1 0 285.391 3.519 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1ccc(C)cc1O)[C@H](O)c1ccccc1 ZINC000872133303 1124692890 /nfs/dbraw/zinc/69/28/90/1124692890.db2.gz PGJZOZJANRPQFF-DKSSEZFCSA-N 1 0 299.414 3.863 20 10 CHCDRO Cc1ccc(C[N@@H+]2CCC[C@H](OC3CCC3)CC2)c(O)c1 ZINC000872259658 1124699248 /nfs/dbraw/zinc/69/92/48/1124699248.db2.gz FPMGZLWAQDJYPL-KRWDZBQOSA-N 1 0 289.419 3.624 20 10 CHCDRO CCCOc1ccc(C[NH2+]Cc2ccc(C)nc2)cc1C ZINC000873013721 1124733872 /nfs/dbraw/zinc/73/38/72/1124733872.db2.gz GLXIKAICAXRWBJ-UHFFFAOYSA-N 1 0 284.403 3.777 20 10 CHCDRO CCCOc1ccc(C[NH2+][C@@H](C)c2ccc[nH]2)cc1C ZINC000873096930 1124737962 /nfs/dbraw/zinc/73/79/62/1124737962.db2.gz AXQKZVLSEQOVCX-AWEZNQCLSA-N 1 0 272.392 3.963 20 10 CHCDRO CCCOc1ccc(C[NH2+]Cc2cncc(C)c2)cc1C ZINC000873096952 1124738483 /nfs/dbraw/zinc/73/84/83/1124738483.db2.gz BSQPUPPLUOBEHO-UHFFFAOYSA-N 1 0 284.403 3.777 20 10 CHCDRO CCc1ccc(C[NH2+]Cc2ccc(N(C)C)cc2)cc1 ZINC000020146004 1124808139 /nfs/dbraw/zinc/80/81/39/1124808139.db2.gz CUHKHRMVZDZZOQ-UHFFFAOYSA-N 1 0 268.404 3.605 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)CCC(C)C)c1 ZINC000020560535 1124852261 /nfs/dbraw/zinc/85/22/61/1124852261.db2.gz UYWBCQBAQFRXEK-QWHCGFSZSA-N 1 0 265.397 3.876 20 10 CHCDRO CC[C@H]([NH2+]CCCN(C)c1ccccc1)c1ccccc1O ZINC000020826822 1124878138 /nfs/dbraw/zinc/87/81/38/1124878138.db2.gz XFDUZFXGUNGOMD-SFHVURJKSA-N 1 0 298.430 3.959 20 10 CHCDRO CCOc1cccc(C[N@H+](Cc2ccccc2)C2CC2)c1O ZINC000125425008 1124891101 /nfs/dbraw/zinc/89/11/01/1124891101.db2.gz HNBBXEGFZUOIBY-UHFFFAOYSA-N 1 0 297.398 3.956 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1ccsc1 ZINC000310771717 1124891550 /nfs/dbraw/zinc/89/15/50/1124891550.db2.gz CVJHYRVYXMIEMG-ZWNOBZJWSA-N 1 0 259.374 3.792 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccc(N(C)C)cc1 ZINC000126056637 1124964695 /nfs/dbraw/zinc/96/46/95/1124964695.db2.gz GVCHSTWKQJWYAW-ZDUSSCGKSA-N 1 0 299.374 3.512 20 10 CHCDRO Cc1cccc(O)c1C[NH+]1CCC(OCCC(C)C)CC1 ZINC000876621137 1124965694 /nfs/dbraw/zinc/96/56/94/1124965694.db2.gz WDZMGYJPHLWQHQ-UHFFFAOYSA-N 1 0 291.435 3.728 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](c2ccccc2)C2CC2)c(O)c1 ZINC000876906845 1124990118 /nfs/dbraw/zinc/99/01/18/1124990118.db2.gz JEPNFWSQCNAEAH-GOSISDBHSA-N 1 0 267.372 3.942 20 10 CHCDRO CC[C@@](C)([NH2+]Cc1ccc(C)cc1O)c1nc(C)cs1 ZINC000877045487 1125002382 /nfs/dbraw/zinc/00/23/82/1125002382.db2.gz XBHLWAHENHFZGB-MRXNPFEDSA-N 1 0 290.432 3.881 20 10 CHCDRO Cc1ccc(C[NH2+]C2(c3ccccc3F)CC2)c(O)c1 ZINC000877049081 1125004415 /nfs/dbraw/zinc/00/44/15/1125004415.db2.gz ARPJOKOKFSGWRR-UHFFFAOYSA-N 1 0 271.335 3.619 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2c(C)cccc2C)c(O)c1 ZINC000877112440 1125010926 /nfs/dbraw/zinc/01/09/26/1125010926.db2.gz UMPKQGJSHKFYOJ-UHFFFAOYSA-N 1 0 255.361 3.607 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)c2cccc(F)c2F)c(O)c1 ZINC000877117445 1125011381 /nfs/dbraw/zinc/01/13/81/1125011381.db2.gz AFERABIPHGEIMZ-NSHDSACASA-N 1 0 277.314 3.830 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(C)cc1O)c1c(C)noc1C ZINC000877120139 1125011781 /nfs/dbraw/zinc/01/17/81/1125011781.db2.gz OISWVOYETYWOCP-AWEZNQCLSA-N 1 0 274.364 3.546 20 10 CHCDRO COc1cccc(Cl)c1C[NH2+]Cc1c(C)cccc1O ZINC000877472286 1125030436 /nfs/dbraw/zinc/03/04/36/1125030436.db2.gz OQVVSNHGBIOOBB-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+][C@@H]1CCc2cc(Cl)ccc21 ZINC000529666235 1125038821 /nfs/dbraw/zinc/03/88/21/1125038821.db2.gz SHKHBMNZKFXURG-OAHLLOKOSA-N 1 0 291.753 3.962 20 10 CHCDRO Cc1ccc(C[N@@H+]2CC(C)(C)[C@H]2c2ccncc2)c(O)c1 ZINC000877548699 1125043579 /nfs/dbraw/zinc/04/35/79/1125043579.db2.gz RRAOFKJHKCJCTB-QGZVFWFLSA-N 1 0 282.387 3.679 20 10 CHCDRO CC(C)Cc1ncc(C[NH2+][C@H](C)c2ccccc2O)s1 ZINC000877756443 1125073184 /nfs/dbraw/zinc/07/31/84/1125073184.db2.gz IRGGGSPERWAHFO-GFCCVEGCSA-N 1 0 290.432 3.898 20 10 CHCDRO Cc1cc(F)ccc1C[NH2+][C@H](C)c1ccccc1O ZINC000877756496 1125073478 /nfs/dbraw/zinc/07/34/78/1125073478.db2.gz MVMRNVQAWAWCIT-GFCCVEGCSA-N 1 0 259.324 3.691 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](CF)c2ccc(F)cc2)c(O)c1 ZINC000877758526 1125073740 /nfs/dbraw/zinc/07/37/40/1125073740.db2.gz HFCOJXHNFWQPPU-OAHLLOKOSA-N 1 0 277.314 3.640 20 10 CHCDRO CCOc1ccc(C[NH2+][C@@H](C)c2ccccc2O)c(C)c1 ZINC000877758350 1125075093 /nfs/dbraw/zinc/07/50/93/1125075093.db2.gz UZNROBYAGBDRSP-AWEZNQCLSA-N 1 0 285.387 3.950 20 10 CHCDRO CCO[P@](C)(=O)CC[C@H](C)[NH2+][C@@H](C)c1ccccc1O ZINC000877758323 1125075356 /nfs/dbraw/zinc/07/53/56/1125075356.db2.gz SVSVRXSGVQCLMY-QAJFTPDKSA-N 1 0 299.351 3.766 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H]2CC=CC[C@H]2C(F)(F)F)c(O)c1 ZINC000877760875 1125076569 /nfs/dbraw/zinc/07/65/69/1125076569.db2.gz MVMBCOSBAPCXAM-CHWSQXEVSA-N 1 0 285.309 3.687 20 10 CHCDRO CC(C)(O)[C@H]1CCC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC000877795429 1125079516 /nfs/dbraw/zinc/07/95/16/1125079516.db2.gz KPERXHWFRBECDX-INIZCTEOSA-N 1 0 299.414 3.528 20 10 CHCDRO C[C@H]([NH2+]CCCF)c1ccc(N2CCCCC2)c(F)c1 ZINC000126951802 1125127204 /nfs/dbraw/zinc/12/72/04/1125127204.db2.gz ROMNRMPMRBARSB-ZDUSSCGKSA-N 1 0 282.378 3.826 20 10 CHCDRO C[C@H]([NH2+]CCCCOC(C)(C)C)c1ccccc1O ZINC000879650884 1125224275 /nfs/dbraw/zinc/22/42/75/1125224275.db2.gz VMIXUFRXGGXACN-ZDUSSCGKSA-N 1 0 265.397 3.638 20 10 CHCDRO C[C@H]([NH2+]Cc1ccccc1OC1CC1)c1ccccc1O ZINC000879650503 1125224114 /nfs/dbraw/zinc/22/41/14/1125224114.db2.gz FDZZRRFTQJOJQF-ZDUSSCGKSA-N 1 0 283.371 3.784 20 10 CHCDRO COc1cccc(C[NH2+][C@H](C)c2ccccc2O)c1Cl ZINC000879650351 1125224294 /nfs/dbraw/zinc/22/42/94/1125224294.db2.gz WCLXJMUIIBSIIZ-LLVKDONJSA-N 1 0 291.778 3.905 20 10 CHCDRO CCCCOCCC[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000128020656 1125235930 /nfs/dbraw/zinc/23/59/30/1125235930.db2.gz VQAGFLCTJMKGOU-HNNXBMFYSA-N 1 0 278.440 3.610 20 10 CHCDRO CC[C@H](C)C[C@H](C)[NH2+]Cc1cc(Cl)cc(OC)c1O ZINC000228675640 1125251297 /nfs/dbraw/zinc/25/12/97/1125251297.db2.gz NWHNUNQXKPACRS-QWRGUYRKSA-N 1 0 285.815 3.969 20 10 CHCDRO Cc1cc(C[NH2+][C@H]2CCCOCC2)c(C)n1-c1ccccc1 ZINC000321034377 1125264925 /nfs/dbraw/zinc/26/49/25/1125264925.db2.gz VLPPGMOXRNINEA-SFHVURJKSA-N 1 0 298.430 3.753 20 10 CHCDRO CC(C)OC1CCC([NH2+]Cc2ccc(N(C)C)cc2)CC1 ZINC000130343355 1125359664 /nfs/dbraw/zinc/35/96/64/1125359664.db2.gz JLKMOPLLEJEXRU-UHFFFAOYSA-N 1 0 290.451 3.578 20 10 CHCDRO C[N@H+](Cc1cc(Cl)nc(Cl)c1)Cc1ccccc1O ZINC000109772051 1125362133 /nfs/dbraw/zinc/36/21/33/1125362133.db2.gz PIQMPSQSUVXEDU-UHFFFAOYSA-N 1 0 297.185 3.726 20 10 CHCDRO COc1cccc(C[N@H+](C)[C@@H](C)c2ccc(C)cc2)c1O ZINC000130808666 1125368879 /nfs/dbraw/zinc/36/88/79/1125368879.db2.gz JJSIZSUGHFRTIP-AWEZNQCLSA-N 1 0 285.387 3.902 20 10 CHCDRO CN(C)c1ccc(C[NH2+]CC(C)(C)CC(F)F)cc1 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JZCXVPQEEZEZFO-BDAKNGLRSA-N 1 0 290.176 3.553 20 10 CHCDRO Cc1ncc([C@H](C)[NH2+]CCCSc2nccs2)s1 ZINC000090417497 1129289727 /nfs/dbraw/zinc/28/97/27/1129289727.db2.gz INVRPGJISVJDQM-VIFPVBQESA-N 1 0 299.490 3.741 20 10 CHCDRO CCc1ccc(C[NH2+]Cc2ccc(N(C)C)cc2C)s1 ZINC000734508736 1129310274 /nfs/dbraw/zinc/31/02/74/1129310274.db2.gz DBPNXFXSIFLEDX-UHFFFAOYSA-N 1 0 288.460 3.975 20 10 CHCDRO CC(C)([NH2+]Cc1ccc2c(c1)CCO2)c1cccs1 ZINC000735085681 1129331220 /nfs/dbraw/zinc/33/12/20/1129331220.db2.gz HFMOYWIIPRAMPY-UHFFFAOYSA-N 1 0 273.401 3.708 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2ncc(Cl)s2)c1 ZINC000719392875 1129331671 /nfs/dbraw/zinc/33/16/71/1129331671.db2.gz DBXVYIVPPFBXOC-VIFPVBQESA-N 1 0 282.796 3.661 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@H]2CCCS2)cc1 ZINC000246975967 1129347584 /nfs/dbraw/zinc/34/75/84/1129347584.db2.gz IRFMGMFNYWWBBU-CZUORRHYSA-N 1 0 278.465 3.689 20 10 CHCDRO C[C@@H]1C[C@@H]1c1ccc(C[N@H+](C)Cc2ccccc2O)o1 ZINC000091974431 1129376119 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Cn1ccc(C[N@H+](Cc2ccccc2O)C2CCCC2)c1 ZINC000093319262 1129421499 /nfs/dbraw/zinc/42/14/99/1129421499.db2.gz AXROBKQDGOGCMM-UHFFFAOYSA-N 1 0 284.403 3.676 20 10 CHCDRO Cc1cc(C)cc(CC[NH2+]Cc2ccc(N(C)C)cc2)c1 ZINC000740900203 1129424048 /nfs/dbraw/zinc/42/40/48/1129424048.db2.gz MKFGRRKNLJMDAP-UHFFFAOYSA-N 1 0 282.431 3.702 20 10 CHCDRO CC[N@@H+](Cc1cc(C)ccc1O)C[C@@H](O)c1ccc(C)cc1 ZINC000093641123 1129426921 /nfs/dbraw/zinc/42/69/21/1129426921.db2.gz FUCNNJFOEYBJNQ-LJQANCHMSA-N 1 0 299.414 3.565 20 10 CHCDRO C[C@@H]([NH2+]CCC1CCCC1)c1cc(F)ccc1O ZINC000094617632 1129448435 /nfs/dbraw/zinc/44/84/35/1129448435.db2.gz AMCYMJOSEKFIDM-LLVKDONJSA-N 1 0 251.345 3.762 20 10 CHCDRO C[C@H]([NH2+]CCc1cc(F)cc(F)c1)c1cc(F)ccc1O ZINC000094618101 1129448579 /nfs/dbraw/zinc/44/85/79/1129448579.db2.gz JVCXYIWRSZFQGA-JTQLQIEISA-N 1 0 295.304 3.703 20 10 CHCDRO C[N@H+](CCCCF)Cc1ccc(N2CCCCC2)cc1 ZINC000795851744 1129452691 /nfs/dbraw/zinc/45/26/91/1129452691.db2.gz HFKZUAMVTPYOQR-UHFFFAOYSA-N 1 0 278.415 3.858 20 10 CHCDRO C[N@H+](CCCCOc1ccccc1)Cc1ccccc1O ZINC000741786066 1129452935 /nfs/dbraw/zinc/45/29/35/1129452935.db2.gz VBPUZTSKHCHRBH-UHFFFAOYSA-N 1 0 285.387 3.683 20 10 CHCDRO Oc1ccccc1C[N@H+](CCCCF)Cc1ccco1 ZINC000795954116 1129460917 /nfs/dbraw/zinc/46/09/17/1129460917.db2.gz YRLREYLGWOHTPQ-UHFFFAOYSA-N 1 0 277.339 3.737 20 10 CHCDRO COc1ccc(C[NH2+]C[C@H](C)Oc2cccc(C)c2)cc1C ZINC000742378064 1129476109 /nfs/dbraw/zinc/47/61/09/1129476109.db2.gz AVTCXSGSXALMHH-INIZCTEOSA-N 1 0 299.414 3.869 20 10 CHCDRO CCOc1ccc(C[NH2+][C@@H]2CC[C@@H]3CCC[C@H]3C2)c(O)c1 ZINC000742378731 1129476207 /nfs/dbraw/zinc/47/62/07/1129476207.db2.gz LIXKBBCSGYQMNB-OFQRWUPVSA-N 1 0 289.419 3.849 20 10 CHCDRO c1ccc(CN2CCc3cc(C[NH2+]C4CC4)ccc32)cc1 ZINC000796254640 1129501042 /nfs/dbraw/zinc/50/10/42/1129501042.db2.gz AWFSOUHKCNIWEE-UHFFFAOYSA-N 1 0 278.399 3.501 20 10 CHCDRO CCC[N@H+](CCOc1ccccc1)Cc1ccccc1O ZINC000303145865 1129529986 /nfs/dbraw/zinc/52/99/86/1129529986.db2.gz RVJREPQXJBAXKQ-UHFFFAOYSA-N 1 0 285.387 3.683 20 10 CHCDRO CCC[N@H+](Cc1ccccc1O)Cc1ccccc1N(C)C ZINC000743869802 1129542307 /nfs/dbraw/zinc/54/23/07/1129542307.db2.gz ANAZWVIEXJVFRI-UHFFFAOYSA-N 1 0 298.430 3.870 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H]2C[C@H](C)C[C@H](C)C2)c1 ZINC000251776033 1129542405 /nfs/dbraw/zinc/54/24/05/1129542405.db2.gz FHQXVHWXLGQFDE-RQJABVFESA-N 1 0 277.408 3.876 20 10 CHCDRO CN1CCC(C)(C)c2cc(C3=CCC[N@H+](C)C3)ccc21 ZINC001241571993 1129584738 /nfs/dbraw/zinc/58/47/38/1129584738.db2.gz MSSVLKNOYHPZMW-UHFFFAOYSA-N 1 0 270.420 3.523 20 10 CHCDRO CC[C@H](C[C@@H](C)CO)[NH2+][C@@H](CC)c1ccc(N(C)C)cc1 ZINC000766360151 1129658922 /nfs/dbraw/zinc/65/89/22/1129658922.db2.gz JARQZCPJJWGHTJ-KYJSFNMBSA-N 1 0 292.467 3.590 20 10 CHCDRO CO[C@@H](C[N@H+](Cc1ccccc1O)C1CCCC1)C1CC1 ZINC000822622182 1131389734 /nfs/dbraw/zinc/38/97/34/1131389734.db2.gz UNLXDIFHIVVDEX-SFHVURJKSA-N 1 0 289.419 3.562 20 10 CHCDRO Cc1ccc([C@@H](O)[C@H](C)[NH2+]Cc2cc(C)c(C)cc2O)cc1 ZINC000796484439 1129748818 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CCOc1ccc(O)c(C[N@H+](C)CCCc2ccccc2)c1 ZINC000768337782 1129852529 /nfs/dbraw/zinc/85/25/29/1129852529.db2.gz VOSJHWUMVRBQSZ-UHFFFAOYSA-N 1 0 299.414 3.856 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC[C@H]2c2ccccn2)cc1F ZINC000768354956 1129853054 /nfs/dbraw/zinc/85/30/54/1129853054.db2.gz LCPDNNNVFYKJCJ-SFHVURJKSA-N 1 0 299.393 3.624 20 10 CHCDRO CC(C)[N@H+](Cc1ccoc1)Cc1ccc(N(C)C)cc1 ZINC000768353454 1129853398 /nfs/dbraw/zinc/85/33/98/1129853398.db2.gz UXVLYXKXDPGLIO-UHFFFAOYSA-N 1 0 272.392 3.756 20 10 CHCDRO Oc1ccccc1C[NH2+][C@@H]1CCC[C@@H](c2cccnc2)C1 ZINC000800231359 1129856778 /nfs/dbraw/zinc/85/67/78/1129856778.db2.gz DFXPCRHYBXITCK-RHSMWYFYSA-N 1 0 282.387 3.603 20 10 CHCDRO Oc1cc2c(cc1C[N@@H+]1CCC[C@@H]1C1CC1)CCCC2 ZINC000768452049 1129857911 /nfs/dbraw/zinc/85/79/11/1129857911.db2.gz NQKLCDMWALPOJR-QGZVFWFLSA-N 1 0 271.404 3.645 20 10 CHCDRO CSC[C@@H]1CCC[N@@H+]1Cc1cc2c(cc1O)CCCC2 ZINC000768462452 1129858852 /nfs/dbraw/zinc/85/88/52/1129858852.db2.gz LNVPXHYLWFCWNE-INIZCTEOSA-N 1 0 291.460 3.598 20 10 CHCDRO CC[C@H]1Cc2ccccc2C[N@@H+]1Cc1cc(OC)ccc1O ZINC000768530291 1129859750 /nfs/dbraw/zinc/85/97/50/1129859750.db2.gz HICGNAOXLJHBGA-KRWDZBQOSA-N 1 0 297.398 3.738 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]CCC1=CCCCCC1 ZINC000768536592 1129861324 /nfs/dbraw/zinc/86/13/24/1129861324.db2.gz SMHATUJRMIQOCU-UHFFFAOYSA-N 1 0 263.356 3.902 20 10 CHCDRO Oc1ccccc1C[NH2+]CCCc1c[nH]c2ccc(F)cc12 ZINC000800300915 1129864663 /nfs/dbraw/zinc/86/46/63/1129864663.db2.gz RSDBWAIQPIVESS-UHFFFAOYSA-N 1 0 298.361 3.735 20 10 CHCDRO COCC[N@H+](Cc1cc(C)ccc1O)[C@@H](C)c1ccccc1 ZINC000768598277 1129864913 /nfs/dbraw/zinc/86/49/13/1129864913.db2.gz XCPRULGZXFQCOE-INIZCTEOSA-N 1 0 299.414 3.910 20 10 CHCDRO CC[N@H+](CCc1cccs1)Cc1cc(C)ccc1O ZINC000768761531 1129870178 /nfs/dbraw/zinc/87/01/78/1129870178.db2.gz XGDRCPZTZHNSRY-UHFFFAOYSA-N 1 0 275.417 3.827 20 10 CHCDRO Cc1ccc(O)c(C[N@H+](C)CCCOc2ccccc2)c1 ZINC000768825207 1129876358 /nfs/dbraw/zinc/87/63/58/1129876358.db2.gz JFJHESRABBQMFZ-UHFFFAOYSA-N 1 0 285.387 3.602 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCC[C@H]2C[C@]21C ZINC000800478208 1129876812 /nfs/dbraw/zinc/87/68/12/1129876812.db2.gz ADPNITVUIPIHFO-CGTJXYLNSA-N 1 0 272.436 3.729 20 10 CHCDRO C[N@H+](Cc1ccccc1O)Cc1nccc2ccccc21 ZINC000768872926 1129878266 /nfs/dbraw/zinc/87/82/66/1129878266.db2.gz LTJHSSZMIDECRK-UHFFFAOYSA-N 1 0 278.355 3.572 20 10 CHCDRO CCSCCC[NH2+][C@H](CC)c1ccc(N(C)C)cc1 ZINC000800492579 1129880253 /nfs/dbraw/zinc/88/02/53/1129880253.db2.gz MHYLMVXIEWYOCN-MRXNPFEDSA-N 1 0 280.481 3.937 20 10 CHCDRO C[C@H]([NH2+]CCc1cccc2[nH]ccc21)c1cc(F)ccc1O ZINC000800500621 1129880949 /nfs/dbraw/zinc/88/09/49/1129880949.db2.gz FXTCPFPRKCIAIM-LBPRGKRZSA-N 1 0 298.361 3.906 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)Cc2ccoc2)cc1F ZINC000769005285 1129888605 /nfs/dbraw/zinc/88/86/05/1129888605.db2.gz QJGYNKPGZWTCKI-UHFFFAOYSA-N 1 0 290.382 3.897 20 10 CHCDRO CCC[N@@H+](Cc1ccccc1O)C[C@H]1CC=CCC1 ZINC000769201087 1129896575 /nfs/dbraw/zinc/89/65/75/1129896575.db2.gz QQTIZYHKEXXJLJ-HNNXBMFYSA-N 1 0 259.393 3.961 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[NH2+][C@H]1CC[C@H]1C1CCC1 ZINC000800967807 1129900559 /nfs/dbraw/zinc/90/05/59/1129900559.db2.gz RZEFBHMRMYWPGD-OALUTQOASA-N 1 0 284.447 3.955 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CCc2ccccc2OC1)c1ccccc1O ZINC000800987124 1129902715 /nfs/dbraw/zinc/90/27/15/1129902715.db2.gz QBNLTTZVCNTCEL-NVXWUHKLSA-N 1 0 297.398 3.827 20 10 CHCDRO CC[C@@H]([NH2+]CCCOC(F)F)c1cc(Cl)ccc1O ZINC000800989730 1129902937 /nfs/dbraw/zinc/90/29/37/1129902937.db2.gz ITZSNFUXBAHZLM-LLVKDONJSA-N 1 0 293.741 3.716 20 10 CHCDRO COc1cccc(O)c1C[N@@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000769426056 1129907296 /nfs/dbraw/zinc/90/72/96/1129907296.db2.gz BHISOHMDBCKZMX-SFHVURJKSA-N 1 0 287.403 3.723 20 10 CHCDRO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)C[C@H]1C[C@H]1C ZINC000769487676 1129909496 /nfs/dbraw/zinc/90/94/96/1129909496.db2.gz KVBPPNUHAISCFE-GDBMZVCRSA-N 1 0 260.425 3.619 20 10 CHCDRO CC[C@H](Cc1ccccc1)[N@H+](C)Cc1c(O)cccc1OC ZINC000769488610 1129909702 /nfs/dbraw/zinc/90/97/02/1129909702.db2.gz GKAOMZDUAPQNFK-MRXNPFEDSA-N 1 0 299.414 3.854 20 10 CHCDRO COc1cccc(O)c1C[N@@H+]1CC[C@H](c2ccccc2)[C@H]1C ZINC000769498654 1129914134 /nfs/dbraw/zinc/91/41/34/1129914134.db2.gz NTUSHKQWBQQRHK-ZBFHGGJFSA-N 1 0 297.398 3.779 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)Cc2ccc[nH]2)cc1F ZINC000769542324 1129914592 /nfs/dbraw/zinc/91/45/92/1129914592.db2.gz GBSCDGHQWFJWNW-UHFFFAOYSA-N 1 0 289.398 3.632 20 10 CHCDRO c1cc(N2CCCCC2)ccc1C[N@@H+]1CC[C@@H](C2CC2)C1 ZINC000769516313 1129914848 /nfs/dbraw/zinc/91/48/48/1129914848.db2.gz SBVXAUHEQSBAHA-GOSISDBHSA-N 1 0 284.447 3.909 20 10 CHCDRO CCC[C@H](C)[C@@H]1CCC[N@@H+]1Cc1c(O)cccc1OC ZINC000769536649 1129916215 /nfs/dbraw/zinc/91/62/15/1129916215.db2.gz CEAKINSKSOFHON-ZFWWWQNUSA-N 1 0 277.408 3.801 20 10 CHCDRO CCS[C@H]1CC[C@H]([N@H+](C)Cc2c(O)cccc2OC)C1 ZINC000769549028 1129916839 /nfs/dbraw/zinc/91/68/39/1129916839.db2.gz JUWGXIWUTIPHAI-STQMWFEESA-N 1 0 295.448 3.507 20 10 CHCDRO CCCC[N@H+](CCC(F)(F)F)Cc1ccccc1O ZINC000801595530 1129930926 /nfs/dbraw/zinc/93/09/26/1129930926.db2.gz MWSUMWZHZTZBHX-UHFFFAOYSA-N 1 0 275.314 3.947 20 10 CHCDRO COc1ccc(C[NH2+]CCC2C[C@@H](C)O[C@H](C)C2)cc1C ZINC000801732777 1129941358 /nfs/dbraw/zinc/94/13/58/1129941358.db2.gz WTYDMCQMAMUNGR-HUUCEWRRSA-N 1 0 291.435 3.687 20 10 CHCDRO COc1ccc(C[NH2+]CC[C@@H]2C[C@@H](C)O[C@@H](C)C2)cc1C ZINC000801732778 1129941427 /nfs/dbraw/zinc/94/14/27/1129941427.db2.gz WTYDMCQMAMUNGR-MUJYYYPQSA-N 1 0 291.435 3.687 20 10 CHCDRO CCCCC[C@H]1CCC[N@@H+]1Cc1cccc(OC)c1O ZINC000770353285 1129945912 /nfs/dbraw/zinc/94/59/12/1129945912.db2.gz ZFIDMXFZTVZCMY-HNNXBMFYSA-N 1 0 277.408 3.946 20 10 CHCDRO Cc1ccc(C[C@H]2CCC[N@@H+]2Cc2ccccc2O)cc1 ZINC000770509478 1129948989 /nfs/dbraw/zinc/94/89/89/1129948989.db2.gz AESDQDZTFVJWJS-GOSISDBHSA-N 1 0 281.399 3.908 20 10 CHCDRO Cc1ccncc1[C@H](C)[NH2+]Cc1cc(C)c(C)cc1O ZINC000770751413 1129958423 /nfs/dbraw/zinc/95/84/23/1129958423.db2.gz VRRAQEMHYWTGSW-AWEZNQCLSA-N 1 0 270.376 3.563 20 10 CHCDRO CCc1cccc(C[NH2+]Cc2ccccc2C)c1O ZINC000691502485 1129981770 /nfs/dbraw/zinc/98/17/70/1129981770.db2.gz DGANPYUOVKHPSU-UHFFFAOYSA-N 1 0 255.361 3.553 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)[C@@H]1C[C@H]1c1ccccc1 ZINC000802300885 1129990159 /nfs/dbraw/zinc/99/01/59/1129990159.db2.gz CZNFQNWPYAAFQM-JVPBZIDWSA-N 1 0 293.410 3.903 20 10 CHCDRO C[N@H+](Cc1ccoc1)Cc1ccc(N2CCCCC2)cc1 ZINC000771935399 1129996283 /nfs/dbraw/zinc/99/62/83/1129996283.db2.gz RDGVURLHIQXLMQ-UHFFFAOYSA-N 1 0 284.403 3.902 20 10 CHCDRO CCOc1ccc(C[NH2+][C@H]2CCCC(C)(C)C2)c(O)c1 ZINC000785548089 1130039153 /nfs/dbraw/zinc/03/91/53/1130039153.db2.gz JLYQSEAKMDBTAX-AWEZNQCLSA-N 1 0 277.408 3.849 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCC2(CCCCC2)O1)c1ccccc1O ZINC000786431596 1130093884 /nfs/dbraw/zinc/09/38/84/1130093884.db2.gz ROZQWNAZRIALGN-GJZGRUSLSA-N 1 0 289.419 3.925 20 10 CHCDRO CO[C@@H](c1ccccc1)[C@@H](C)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000786782060 1130117248 /nfs/dbraw/zinc/11/72/48/1130117248.db2.gz FBWPMTZUZFWHLN-DNVCBOLYSA-N 1 0 298.430 3.618 20 10 CHCDRO Cc1c([C@@H](C)[NH2+]Cc2ccc3c(c2)CCO3)cnn1C(C)C ZINC000786903337 1130120161 /nfs/dbraw/zinc/12/01/61/1130120161.db2.gz KOGQCHSLXOBNIY-CYBMUJFWSA-N 1 0 299.418 3.558 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]C[C@]23C[C@H]2CCCC3)c1O ZINC000903161023 1130121546 /nfs/dbraw/zinc/12/15/46/1130121546.db2.gz CYLNQYMWTJLQCH-AHIWAGSCSA-N 1 0 275.392 3.632 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCSC(C)(C)C1)c1ccccc1O ZINC000903285405 1130146951 /nfs/dbraw/zinc/14/69/51/1130146951.db2.gz ZILPDGBUEHMVCV-VXGBXAGGSA-N 1 0 265.422 3.717 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)c1ccc(Cl)cc1O)c1cncs1 ZINC000903312138 1130151486 /nfs/dbraw/zinc/15/14/86/1130151486.db2.gz SORDFAGHZXGCKT-RKDXNWHRSA-N 1 0 282.796 3.914 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](c2ccccn2)C2CC2)c1 ZINC000903334766 1130160354 /nfs/dbraw/zinc/16/03/54/1130160354.db2.gz FZZYHFHVSCBEIK-SCLBCKFNSA-N 1 0 282.387 3.898 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCOC12CCCC2)c1cc(Cl)ccc1O ZINC000903382836 1130169007 /nfs/dbraw/zinc/16/90/07/1130169007.db2.gz JNOJYQNMXKXHNQ-XHDPSFHLSA-N 1 0 295.810 3.798 20 10 CHCDRO C[C@H]1C[C@@H]1C[N@H+](Cc1ccco1)Cc1ccccc1O ZINC000788444032 1130186880 /nfs/dbraw/zinc/18/68/80/1130186880.db2.gz WOYVJIFKGLJCDY-DZGCQCFKSA-N 1 0 271.360 3.643 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1cc2ccccc2[nH]1 ZINC000788514945 1130193024 /nfs/dbraw/zinc/19/30/24/1130193024.db2.gz DMZSAEZXDZQLAZ-UHFFFAOYSA-N 1 0 293.414 3.832 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H](C)[C@@]2(C)CCCO2)cc1 ZINC000788546762 1130193618 /nfs/dbraw/zinc/19/36/18/1130193618.db2.gz LQDSHCFMPYKZPF-CRAIPNDOSA-N 1 0 290.451 3.580 20 10 CHCDRO CSC1(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)CC1 ZINC000788605162 1130197371 /nfs/dbraw/zinc/19/73/71/1130197371.db2.gz GUPJLLXXBOIDBH-KOLCDFICSA-N 1 0 281.396 3.565 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCC[C@H](OC)C2)cc1 ZINC000746753338 1130199343 /nfs/dbraw/zinc/19/93/43/1130199343.db2.gz FEZNESDQJWDKFJ-WMZOPIPTSA-N 1 0 290.451 3.580 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C2C[C@H](C)O[C@@H](C)C2)c(O)c1 ZINC000788684192 1130199794 /nfs/dbraw/zinc/19/97/94/1130199794.db2.gz BMVNWZKJLFSSCH-IHRRRGAJSA-N 1 0 277.408 3.616 20 10 CHCDRO CCC(CC)[C@H](CC[NH2+]Cc1cc(C)ccc1O)OC ZINC000746760170 1130205255 /nfs/dbraw/zinc/20/52/55/1130205255.db2.gz GHQGYPGKVQVJDD-KRWDZBQOSA-N 1 0 279.424 3.632 20 10 CHCDRO CSC1(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)CCC1 ZINC000788796657 1130208877 /nfs/dbraw/zinc/20/88/77/1130208877.db2.gz SLGHOEULPMPQCT-CYBMUJFWSA-N 1 0 279.449 3.945 20 10 CHCDRO C[N@@H+](Cc1c(O)cccc1Cl)C[C@H]1CC=CCC1 ZINC000753575584 1130218354 /nfs/dbraw/zinc/21/83/54/1130218354.db2.gz HWHJMVDFCVMSOX-LBPRGKRZSA-N 1 0 265.784 3.834 20 10 CHCDRO CCOC[C@@H]([NH2+][C@@H](C)c1ccc(N(C)CC)cc1)C(C)C ZINC000788985201 1130222395 /nfs/dbraw/zinc/22/23/95/1130222395.db2.gz OPTPGDXTKHAKFW-MAUKXSAKSA-N 1 0 292.467 3.854 20 10 CHCDRO CC[N@H+](CCC(F)(F)F)Cc1cc(C)c(C)cc1O ZINC000748295386 1130228264 /nfs/dbraw/zinc/22/82/64/1130228264.db2.gz GVWQPGIVLNJURM-UHFFFAOYSA-N 1 0 275.314 3.783 20 10 CHCDRO CCc1cccc(C[NH2+]CCC2(CSC)CC2)c1O ZINC000826938110 1130316397 /nfs/dbraw/zinc/31/63/97/1130316397.db2.gz ZNSQSCYDPJNYQV-UHFFFAOYSA-N 1 0 279.449 3.578 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](C(C)C)C(C)(C)O)cc1 ZINC000790700772 1130326862 /nfs/dbraw/zinc/32/68/62/1130326862.db2.gz FNXBMLVPZRLCJV-PBHICJAKSA-N 1 0 292.467 3.589 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2CCO[C@H](C(C)(C)C)C2)c1O ZINC000790930498 1130339210 /nfs/dbraw/zinc/33/92/10/1130339210.db2.gz DCBOVXJSHIUCPO-AWEZNQCLSA-N 1 0 297.826 3.601 20 10 CHCDRO CC[C@@]1([NH2+]Cc2cc(-c3ccccc3)ccc2O)CCOC1 ZINC000791002405 1130342647 /nfs/dbraw/zinc/34/26/47/1130342647.db2.gz HNUXUOBGAHEKEC-LJQANCHMSA-N 1 0 297.398 3.718 20 10 CHCDRO CS[C@@H]1CC[C@H]([NH2+]Cc2c([O-])ccc(Cl)c2F)C1 ZINC000790974223 1130343666 /nfs/dbraw/zinc/34/36/66/1130343666.db2.gz QHRCXLFTWJUUEE-DTWKUNHWSA-N 1 0 289.803 3.558 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H]2Cc3ccccc3[C@@H]2C)c1O ZINC000827031555 1130348401 /nfs/dbraw/zinc/34/84/01/1130348401.db2.gz YKBQDBICBZKLHT-SUMWQHHRSA-N 1 0 267.372 3.519 20 10 CHCDRO Cc1cccc(C[NH2+]CCc2cn(C)c3ccccc23)c1O ZINC000827251654 1130530013 /nfs/dbraw/zinc/53/00/13/1130530013.db2.gz JZHVRMYSCHSXNK-UHFFFAOYSA-N 1 0 294.398 3.525 20 10 CHCDRO C[C@@H]1CCC[C@H](C[NH2+]Cc2ccc3ccccc3c2O)O1 ZINC000827251703 1130530180 /nfs/dbraw/zinc/53/01/80/1130530180.db2.gz LGFNZJHJDUMGJS-CZUORRHYSA-N 1 0 285.387 3.593 20 10 CHCDRO Cc1ccc([C@@H]2CC[N@H+](Cc3ccccc3O)C2)c(C)c1 ZINC000793232089 1130533151 /nfs/dbraw/zinc/53/31/51/1130533151.db2.gz IMHCFRGJINGAGF-MRXNPFEDSA-N 1 0 281.399 3.999 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2CC[C@@H](C(F)(F)F)[C@H]2C)cc1C ZINC000793231271 1130533181 /nfs/dbraw/zinc/53/31/81/1130533181.db2.gz LXVWIFMHYQCPIC-DGCLKSJQSA-N 1 0 287.325 3.782 20 10 CHCDRO CC(C)(C)c1ccc(C[N@@H+]2CCc3cccc(O)c3C2)[nH]1 ZINC001137379596 1130543623 /nfs/dbraw/zinc/54/36/23/1130543623.db2.gz 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Cc1cc(Cl)cc(C[N@H+]2CCC[C@H](C)[C@@H]2C)c1O ZINC001237687802 1131128592 /nfs/dbraw/zinc/12/85/92/1131128592.db2.gz VHTMLUWJEUIEBP-JQWIXIFHSA-N 1 0 267.800 3.974 20 10 CHCDRO CC1(C)CCC[N@@H+]1Cc1cc(F)cc(Cl)c1[O-] ZINC001237807857 1131143422 /nfs/dbraw/zinc/14/34/22/1131143422.db2.gz NIAVZIYROLCYJQ-UHFFFAOYSA-N 1 0 257.736 3.559 20 10 CHCDRO C[C@@H]1C[N@@H+](Cc2ccc(N3CCCC3)cc2)C[C@H](C)S1 ZINC001116442438 1131146356 /nfs/dbraw/zinc/14/63/56/1131146356.db2.gz WUQJZCVIAQSIAQ-GASCZTMLSA-N 1 0 290.476 3.613 20 10 CHCDRO CC(C)CC[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001116443881 1131146499 /nfs/dbraw/zinc/14/64/99/1131146499.db2.gz HBVZVANRNZIIPD-UHFFFAOYSA-N 1 0 260.425 3.765 20 10 CHCDRO Cc1cc(F)cc(C[N@H+](C)Cc2cccs2)c1O ZINC001238061925 1131166058 /nfs/dbraw/zinc/16/60/58/1131166058.db2.gz LQSSHSWGALINHJ-UHFFFAOYSA-N 1 0 265.353 3.533 20 10 CHCDRO Cc1cc(F)cc(C[N@@H+]2CCC[C@@H]2c2ccccn2)c1O ZINC001238063422 1131167062 /nfs/dbraw/zinc/16/70/62/1131167062.db2.gz WDPMIRKUTBRFGG-MRXNPFEDSA-N 1 0 286.350 3.572 20 10 CHCDRO C[C@@H]([NH2+]CCCC1(O)CCC1)c1ccc2ccccc2c1O ZINC000817585269 1131173252 /nfs/dbraw/zinc/17/32/52/1131173252.db2.gz DWNHKLUKERTABC-CQSZACIVSA-N 1 0 299.414 3.891 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]C[C@H]1CC13CCSCC3)CC2 ZINC000817590625 1131174872 /nfs/dbraw/zinc/17/48/72/1131174872.db2.gz ZFXYGZBXRQYBNP-KGLIPLIRSA-N 1 0 289.444 3.502 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CC23CCSCC3)c1 ZINC000817590636 1131175387 /nfs/dbraw/zinc/17/53/87/1131175387.db2.gz ZHRRIORFUBPKSE-ZIAGYGMSSA-N 1 0 291.460 3.885 20 10 CHCDRO Cc1cc(C[NH2+][C@H](C)c2cc(Cl)ccc2O)cc(C)n1 ZINC000817590448 1131175500 /nfs/dbraw/zinc/17/55/00/1131175500.db2.gz XJHMSULSJDYYJF-GFCCVEGCSA-N 1 0 290.794 3.908 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCc2ccc(N)cc2)cc1 ZINC000817955785 1131190087 /nfs/dbraw/zinc/19/00/87/1131190087.db2.gz HRYPYECXTMMZBX-OAHLLOKOSA-N 1 0 297.446 3.618 20 10 CHCDRO CC(C)c1ccc([C@H](N)C[NH2+][C@@H](C)c2ccccc2O)cc1 ZINC000817953402 1131190625 /nfs/dbraw/zinc/19/06/25/1131190625.db2.gz MXSDVMPWIABDOC-KBXCAEBGSA-N 1 0 298.430 3.866 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCc2ccc(N)cc2)s1 ZINC000817955645 1131190682 /nfs/dbraw/zinc/19/06/82/1131190682.db2.gz DPNGCDCIFVWRKF-GFCCVEGCSA-N 1 0 260.406 3.532 20 10 CHCDRO CC(C)c1nc([C@@H](C)[NH2+]CCc2ccc(N)cc2)cs1 ZINC000817958245 1131191235 /nfs/dbraw/zinc/19/12/35/1131191235.db2.gz UVMZMIDOBBQCTN-GFCCVEGCSA-N 1 0 289.448 3.742 20 10 CHCDRO Cc1ccccc1C[C@@H]([NH2+]CCc1ccc(N)cc1)C1CC1 ZINC000817956721 1131191483 /nfs/dbraw/zinc/19/14/83/1131191483.db2.gz BEFYWXALZVYHNP-HXUWFJFHSA-N 1 0 294.442 3.731 20 10 CHCDRO Nc1ccc(CC[NH2+][C@H](c2ccc(F)cc2)C2CC2)cc1 ZINC000817956162 1131191558 /nfs/dbraw/zinc/19/15/58/1131191558.db2.gz SHEIQPAUUKZTGT-SFHVURJKSA-N 1 0 284.378 3.691 20 10 CHCDRO CC(C)c1nc([C@H](C)[NH2+]CCc2ccc(N)cc2)cs1 ZINC000817958246 1131191601 /nfs/dbraw/zinc/19/16/01/1131191601.db2.gz UVMZMIDOBBQCTN-LBPRGKRZSA-N 1 0 289.448 3.742 20 10 CHCDRO COc1ccc([C@H](C)[C@H](C)[NH2+]CCc2ccc(N)cc2)cc1 ZINC000817956147 1131191649 /nfs/dbraw/zinc/19/16/49/1131191649.db2.gz RUZPQMHIJNZGMU-CABCVRRESA-N 1 0 298.430 3.602 20 10 CHCDRO Cc1cc([C@H](C)[NH2+]CCc2ccc(N)cc2)cs1 ZINC000817958758 1131191667 /nfs/dbraw/zinc/19/16/67/1131191667.db2.gz XUSVOGLHJJLRFD-LBPRGKRZSA-N 1 0 260.406 3.532 20 10 CHCDRO C[C@H]([NH2+]Cc1cccc2c1CCCN2)c1ccccc1O ZINC000817975930 1131193737 /nfs/dbraw/zinc/19/37/37/1131193737.db2.gz QWIUFNXQOOEQHC-ZDUSSCGKSA-N 1 0 282.387 3.601 20 10 CHCDRO Nc1ccc2c(c1)CCC[C@@H]2[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000817967375 1131194254 /nfs/dbraw/zinc/19/42/54/1131194254.db2.gz GVHNMQCJERUMPH-DLBZAZTESA-N 1 0 294.398 3.629 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc(C)cc(N)c1)c1ccc(C)cc1O ZINC000817980415 1131194775 /nfs/dbraw/zinc/19/47/75/1131194775.db2.gz LCULTPXNFQJJCM-QGZVFWFLSA-N 1 0 284.403 3.832 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(C)cc(N)c1)c1ccccc1O ZINC000817979763 1131195208 /nfs/dbraw/zinc/19/52/08/1131195208.db2.gz FACKFJHPSBQEGS-INIZCTEOSA-N 1 0 270.376 3.524 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2)c1ccccc1O ZINC000817977385 1131195429 /nfs/dbraw/zinc/19/54/29/1131195429.db2.gz JDONZAFMZMEZPZ-CYBMUJFWSA-N 1 0 282.387 3.601 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(C)cc(N)c1)c1ccc(N(C)C)cc1 ZINC000817982067 1131195643 /nfs/dbraw/zinc/19/56/43/1131195643.db2.gz XBCWZKPSIQIJQZ-IBGZPJMESA-N 1 0 297.446 3.884 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1C[C@H]1C1CCC1)c1cc(F)ccc1O ZINC000818344858 1131209761 /nfs/dbraw/zinc/20/97/61/1131209761.db2.gz HKCFGINRKPLGAW-WBIUFABUSA-N 1 0 263.356 3.618 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1C[C@H]2C[C@H]2C1)c1cc2c(cc1O)CCCC2 ZINC000818361107 1131211374 /nfs/dbraw/zinc/21/13/74/1131211374.db2.gz ULXKKERULBWWNI-BQDHKBFISA-N 1 0 271.404 3.720 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CC12CC2)c1cc(Cl)ccc1O ZINC000818356924 1131211907 /nfs/dbraw/zinc/21/19/07/1131211907.db2.gz SPXYNVMWOQKRDY-DGCLKSJQSA-N 1 0 251.757 3.639 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CC[C@H](c3cccnc3)C2)cc1 ZINC000829522485 1131423106 /nfs/dbraw/zinc/42/31/06/1131423106.db2.gz JOSBONHCGNKALK-SFHVURJKSA-N 1 0 295.430 3.527 20 10 CHCDRO COC[C@@H]1CC[N@H+](Cc2cc(C)n(-c3ccccc3)c2C)C1 ZINC001137854420 1131424018 /nfs/dbraw/zinc/42/40/18/1131424018.db2.gz VNOKKPSVIVPMQO-QGZVFWFLSA-N 1 0 298.430 3.562 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)Cc2cc3cccnc3o2)cc1 ZINC000823372098 1131424211 /nfs/dbraw/zinc/42/42/11/1131424211.db2.gz UTOWGLALTFKQFC-UHFFFAOYSA-N 1 0 295.386 3.526 20 10 CHCDRO C[C@@H]([NH2+]Cc1cc2cccnc2o1)c1ccc(N(C)C)cc1 ZINC000824196014 1131457788 /nfs/dbraw/zinc/45/77/88/1131457788.db2.gz MYMOEXAJBQIOFM-CYBMUJFWSA-N 1 0 295.386 3.745 20 10 CHCDRO Cc1ccc(F)c(CN(C)Cc2ccccc2O)c1F ZINC001138120064 1131468903 /nfs/dbraw/zinc/46/89/03/1131468903.db2.gz ZOYZZYYFKPOMGF-UHFFFAOYSA-N 1 0 277.314 3.611 20 10 CHCDRO C[C@]1(F)CCC[N@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000824472578 1131470510 /nfs/dbraw/zinc/47/05/10/1131470510.db2.gz VLPIONJSEGHCPV-KRWDZBQOSA-N 1 0 273.351 3.869 20 10 CHCDRO Cc1cc([C@@H](C)[NH2+]Cc2cc(F)ccc2O)ccc1F ZINC000824549143 1131473197 /nfs/dbraw/zinc/47/31/97/1131473197.db2.gz ZFZNCUGGLFHLPF-LLVKDONJSA-N 1 0 277.314 3.830 20 10 CHCDRO CC[C@H](C)[C@@H](C[NH2+]Cc1ccc2ccccc2c1O)OC ZINC000824597668 1131475993 /nfs/dbraw/zinc/47/59/93/1131475993.db2.gz WEWVXVCKGXWSAG-SUMWQHHRSA-N 1 0 287.403 3.696 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]C2(CC)CCCC2)c1 ZINC000824648974 1131477314 /nfs/dbraw/zinc/47/73/14/1131477314.db2.gz AEAGVJNXILUMFL-UHFFFAOYSA-N 1 0 263.381 3.603 20 10 CHCDRO c1cc(N2CCCCC2)ccc1C[N@@H+]1CCCC12CC2 ZINC001138213879 1131477814 /nfs/dbraw/zinc/47/78/14/1131477814.db2.gz DNHXRWWYFKEFDY-UHFFFAOYSA-N 1 0 270.420 3.805 20 10 CHCDRO C[C@@H]1C[C@@H](F)C[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC001138215733 1131478126 /nfs/dbraw/zinc/47/81/26/1131478126.db2.gz RRPHEELARQYUCR-GDBMZVCRSA-N 1 0 276.399 3.609 20 10 CHCDRO CCC[C@@H]([NH2+]Cc1cc(OC)c(OC)cc1O)C(C)(C)C ZINC000824722521 1131480627 /nfs/dbraw/zinc/48/06/27/1131480627.db2.gz VAFLGMZFPQFACS-MRXNPFEDSA-N 1 0 295.423 3.714 20 10 CHCDRO Cc1c(C[NH+]2CC3(C2)CCCC3)c2ccccc2n1C ZINC001138254177 1131482928 /nfs/dbraw/zinc/48/29/28/1131482928.db2.gz SBBQIUNODYTFRO-UHFFFAOYSA-N 1 0 268.404 3.863 20 10 CHCDRO CC(C)[C@H]1C[C@@H](C[NH2+]Cc2cc(Cl)ccc2O)CCO1 ZINC000824798545 1131485250 /nfs/dbraw/zinc/48/52/50/1131485250.db2.gz DRWMZJHQDZJLMG-BLLLJJGKSA-N 1 0 297.826 3.586 20 10 CHCDRO CCC(CC)[N@H+](C)Cc1ccc2c(c1)CCCN2C ZINC001138356330 1131493640 /nfs/dbraw/zinc/49/36/40/1131493640.db2.gz LCJIMLBHGWSAQG-UHFFFAOYSA-N 1 0 260.425 3.689 20 10 CHCDRO CN1CCCc2cc(C[N@H+](C)CC(C)(C)C)ccc21 ZINC001138357516 1131493735 /nfs/dbraw/zinc/49/37/35/1131493735.db2.gz HUJHIJMMJWUGPJ-UHFFFAOYSA-N 1 0 260.425 3.547 20 10 CHCDRO COc1cccc(C[N@@H+]2CC3(CCC3)[C@@H]2c2ccco2)c1O ZINC000825103432 1131496273 /nfs/dbraw/zinc/49/62/73/1131496273.db2.gz FGEBBNMPTWMNBS-KRWDZBQOSA-N 1 0 299.370 3.721 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)CCC2CC2)c(OC)c1 ZINC001138388893 1131497190 /nfs/dbraw/zinc/49/71/90/1131497190.db2.gz AELPEGOXVAXROM-UHFFFAOYSA-N 1 0 290.451 3.773 20 10 CHCDRO Oc1cccc2c1C[N@H+](Cc1c[nH]c3cccc(F)c13)CC2 ZINC001136986963 1131498958 /nfs/dbraw/zinc/49/89/58/1131498958.db2.gz CMUXOHXCWJNNEQ-UHFFFAOYSA-N 1 0 296.345 3.571 20 10 CHCDRO Oc1cccc(Cl)c1CNc1ccc2c([nH+]1)CCC2 ZINC000825124696 1131500238 /nfs/dbraw/zinc/50/02/38/1131500238.db2.gz WNJPHWVKZOTPDW-UHFFFAOYSA-N 1 0 274.751 3.541 20 10 CHCDRO Cc1ccc2[nH]c(C[N@@H+](C)Cc3ccccc3O)cc2c1 ZINC001138418018 1131501926 /nfs/dbraw/zinc/50/19/26/1131501926.db2.gz OANWCQVZFSJERF-UHFFFAOYSA-N 1 0 280.371 3.814 20 10 CHCDRO CCC(CC)(CCO)C[NH2+]Cc1cc(Cl)c(C)cc1O ZINC000825321149 1131506393 /nfs/dbraw/zinc/50/63/93/1131506393.db2.gz SZCIOAZLNOUMTR-UHFFFAOYSA-N 1 0 299.842 3.632 20 10 CHCDRO COCCC(C)(C)C[NH2+]Cc1cc(Cl)c(C)cc1O ZINC000825514934 1131514293 /nfs/dbraw/zinc/51/42/93/1131514293.db2.gz UKCYOSRQWYJBEX-UHFFFAOYSA-N 1 0 285.815 3.506 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc2c(c1)CCCO2)[C@H]1CC1(C)C ZINC001202870775 1131555853 /nfs/dbraw/zinc/55/58/53/1131555853.db2.gz WYUVZEHNYMEWAL-CVEARBPZSA-N 1 0 273.420 3.926 20 10 CHCDRO Cn1ccc2c1cccc2C[N@H+](C)Cc1ccccc1O ZINC001139162602 1131588690 /nfs/dbraw/zinc/58/86/90/1131588690.db2.gz WTVPMHZVBJOKOB-UHFFFAOYSA-N 1 0 280.371 3.516 20 10 CHCDRO Cc1cccc(C[NH2+]CC[C@H]2CCc3ccccc3N2)c1O ZINC000844912764 1131609132 /nfs/dbraw/zinc/60/91/32/1131609132.db2.gz XBOGVUPJEUOKIB-QGZVFWFLSA-N 1 0 296.414 3.607 20 10 CHCDRO COCC(C)(C)CCC[NH2+]Cc1ccc(OC)c(C)c1 ZINC000808428891 1131624478 /nfs/dbraw/zinc/62/44/78/1131624478.db2.gz UKUIVLRRKKXILX-UHFFFAOYSA-N 1 0 279.424 3.546 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCc2cc(Cl)ccc2C1 ZINC000792179606 1131624491 /nfs/dbraw/zinc/62/44/91/1131624491.db2.gz IDIVUIMVGOPQRJ-UHFFFAOYSA-N 1 0 273.763 3.604 20 10 CHCDRO Cc1cc(C[NH+]2[C@@H](C)CCC[C@@H]2C)ccc1N(C)C ZINC001139669993 1131626912 /nfs/dbraw/zinc/62/69/12/1131626912.db2.gz UAGXLURETLVNSF-GJZGRUSLSA-N 1 0 260.425 3.824 20 10 CHCDRO Cc1cc(C[N@@H+]2CC[C@H]3CCC[C@H]3C2)ccc1N(C)C ZINC001139671511 1131627179 /nfs/dbraw/zinc/62/71/79/1131627179.db2.gz XDKOWSAJNPVEBH-SJORKVTESA-N 1 0 272.436 3.683 20 10 CHCDRO Cc1cc(C[N@@H+]2CCC[C@H](C(F)F)C2)ccc1N(C)C ZINC001139672807 1131627594 /nfs/dbraw/zinc/62/75/94/1131627594.db2.gz GOMQVGZXWQQPEI-AWEZNQCLSA-N 1 0 282.378 3.538 20 10 CHCDRO Cc1cc(C[N@H+]2CC[C@@H](C)C[C@H]2C)ccc1N(C)C ZINC001139672726 1131627699 /nfs/dbraw/zinc/62/76/99/1131627699.db2.gz CZMASXAHFVQDOW-UKRRQHHQSA-N 1 0 260.425 3.681 20 10 CHCDRO Cc1cc(C[NH+]2CC(c3ccccc3)C2)ccc1N(C)C ZINC001139673000 1131628246 /nfs/dbraw/zinc/62/82/46/1131628246.db2.gz NBKDSFOMNGRYDQ-UHFFFAOYSA-N 1 0 280.415 3.660 20 10 CHCDRO CC[N@H+](Cc1ccc(COC)s1)Cc1ccccc1O ZINC001139831658 1131640250 /nfs/dbraw/zinc/64/02/50/1131640250.db2.gz YDSWWPWWKOQTEX-UHFFFAOYSA-N 1 0 291.416 3.622 20 10 CHCDRO C[N@H+](CCc1cccc(Cl)c1)Cc1cc(F)ccc1O ZINC001140055200 1131659863 /nfs/dbraw/zinc/65/98/63/1131659863.db2.gz NNHGSUIMVDWDJP-UHFFFAOYSA-N 1 0 293.769 3.859 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2ccc3c(c2)CCO3)c(Cl)c1 ZINC000845928144 1131671094 /nfs/dbraw/zinc/67/10/94/1131671094.db2.gz ADZFSNYJSDVTOZ-UHFFFAOYSA-N 1 0 287.790 3.873 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2c(C)ccc(C)c2O)cc1 ZINC001140178924 1131672900 /nfs/dbraw/zinc/67/29/00/1131672900.db2.gz CVZXZRBNGCNVOT-UHFFFAOYSA-N 1 0 269.388 3.949 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCc3ccccc3C2)c1O ZINC001140180976 1131672938 /nfs/dbraw/zinc/67/29/38/1131672938.db2.gz RRTFIINBTGRIPO-UHFFFAOYSA-N 1 0 267.372 3.567 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCO[C@@H](c3ccccc3)C2)c1O ZINC001140181649 1131673504 /nfs/dbraw/zinc/67/35/04/1131673504.db2.gz DVILAVAMDADMRB-GOSISDBHSA-N 1 0 297.398 3.583 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)C2CCSCC2)c1 ZINC000845972763 1131673815 /nfs/dbraw/zinc/67/38/15/1131673815.db2.gz UCXDCZULFYURFC-RYUDHWBXSA-N 1 0 295.448 3.583 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCCC23CCC3)c1 ZINC000845970674 1131673867 /nfs/dbraw/zinc/67/38/67/1131673867.db2.gz BMIKBCHLVOOPMD-BLLLJJGKSA-N 1 0 275.392 3.774 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cccc(C)c2F)c1 ZINC000845972548 1131673956 /nfs/dbraw/zinc/67/39/56/1131673956.db2.gz RQISXSSMDXNSCC-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc(OC)ccc1F)c1ccccc1O ZINC000845991241 1131675326 /nfs/dbraw/zinc/67/53/26/1131675326.db2.gz AICFWIOALZQCLD-MRXNPFEDSA-N 1 0 289.350 3.781 20 10 CHCDRO CC[N@H+](Cc1cc(C)c(O)cc1C)Cc1ccccc1O ZINC001140201822 1131676109 /nfs/dbraw/zinc/67/61/09/1131676109.db2.gz BUZUTTAKYCPNCZ-UHFFFAOYSA-N 1 0 285.387 3.737 20 10 CHCDRO CCOc1ccc(C[NH2+][C@@H]2CCCC[C@H]2SC)c(O)c1 ZINC000846009666 1131677863 /nfs/dbraw/zinc/67/78/63/1131677863.db2.gz AJTXNKJVGLGOMQ-GDBMZVCRSA-N 1 0 295.448 3.555 20 10 CHCDRO CN(C)c1ccc(C[NH2+]CC[C@@]2(C)C[C@]2(F)Cl)cc1 ZINC000846036461 1131681926 /nfs/dbraw/zinc/68/19/26/1131681926.db2.gz LNWZMZFNQXYYCQ-LSDHHAIUSA-N 1 0 284.806 3.547 20 10 CHCDRO C[C@@H](Cc1ccccc1F)[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000834526333 1131682053 /nfs/dbraw/zinc/68/20/53/1131682053.db2.gz GYKOGXZEJWQVAM-BLLLJJGKSA-N 1 0 285.362 3.739 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C1CC1)C1CCOCC1)c1ccccc1O ZINC000846042821 1131683693 /nfs/dbraw/zinc/68/36/93/1131683693.db2.gz QHAVSDLFWPIOIY-AEFFLSMTSA-N 1 0 289.419 3.638 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]Cc1scnc1C1CC1 ZINC000846055096 1131685519 /nfs/dbraw/zinc/68/55/19/1131685519.db2.gz IQGYUNLEMJUVSH-UHFFFAOYSA-N 1 0 294.807 3.669 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCc2cccc(O)c21 ZINC000834590830 1131685792 /nfs/dbraw/zinc/68/57/92/1131685792.db2.gz ZIBHQDCQVZNPQD-KRWDZBQOSA-N 1 0 296.414 3.544 20 10 CHCDRO Cc1cccc(F)c1C[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000834602238 1131687844 /nfs/dbraw/zinc/68/78/44/1131687844.db2.gz MJVQZIDVUBYLTG-OAHLLOKOSA-N 1 0 271.335 3.617 20 10 CHCDRO COc1cccc2c1CC[C@H]2[NH2+][C@H]1CCc2cccc(O)c21 ZINC000834625153 1131688454 /nfs/dbraw/zinc/68/84/54/1131688454.db2.gz UUPOPYUCSXIRLM-CVEARBPZSA-N 1 0 295.382 3.665 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@@H]1CCc3ccc(F)cc31)CC2 ZINC000834640884 1131690228 /nfs/dbraw/zinc/69/02/28/1131690228.db2.gz SAQPWIFGYPBFLC-HZPDHXFCSA-N 1 0 283.346 3.796 20 10 CHCDRO CCO[C@@H](CC[NH2+][C@@H](C)c1cccc(OC)c1O)C(C)C ZINC000846149192 1131691475 /nfs/dbraw/zinc/69/14/75/1131691475.db2.gz WXDQKIDUPITUKX-ZFWWWQNUSA-N 1 0 295.423 3.503 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]Cc2c(C)cccc2C)c1O ZINC000846155876 1131691968 /nfs/dbraw/zinc/69/19/68/1131691968.db2.gz YYKFHYCXUMLDOU-AWEZNQCLSA-N 1 0 285.387 3.868 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]Cc2ccccc2Cl)c1O ZINC000846136706 1131693576 /nfs/dbraw/zinc/69/35/76/1131693576.db2.gz JOYAILSYOZLGPL-NSHDSACASA-N 1 0 291.778 3.905 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]Cc2cc(C)cs2)c1O ZINC000846170358 1131693637 /nfs/dbraw/zinc/69/36/37/1131693637.db2.gz XOUXPEJBPAMNFF-LLVKDONJSA-N 1 0 277.389 3.622 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H]2CCc3ccccc3C2)c1O ZINC000846135368 1131693690 /nfs/dbraw/zinc/69/36/90/1131693690.db2.gz CUCDQLPDSOVNNM-BBRMVZONSA-N 1 0 297.398 3.609 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H](C2CC2)C2CCC2)c1O ZINC000846168183 1131694030 /nfs/dbraw/zinc/69/40/30/1131694030.db2.gz HWWCIJKQVUIRII-MEDUHNTESA-N 1 0 275.392 3.630 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]Cc2c(C)cccc2F)c1O ZINC000846144209 1131694833 /nfs/dbraw/zinc/69/48/33/1131694833.db2.gz GKHDWUJZSOTOHR-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H](C)Cc2ccsc2)c1O ZINC000846143132 1131695180 /nfs/dbraw/zinc/69/51/80/1131695180.db2.gz HWQQTFXHSFEITH-RYUDHWBXSA-N 1 0 291.416 3.744 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H](C)COCC2CC2)c1O ZINC000846205828 1131695761 /nfs/dbraw/zinc/69/57/61/1131695761.db2.gz UHRDEJMCPIAMKY-VXGBXAGGSA-N 1 0 297.826 3.820 20 10 CHCDRO C[C@@H]([NH2+]CCC1(CO)CCC1)c1ccc2ccccc2c1O ZINC000846209131 1131695772 /nfs/dbraw/zinc/69/57/72/1131695772.db2.gz AFCFLMIENHMPCB-CQSZACIVSA-N 1 0 299.414 3.749 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]CCC2(CO)CCC2)c1O ZINC000846211091 1131695817 /nfs/dbraw/zinc/69/58/17/1131695817.db2.gz SDVNJBSMTQWRDA-GFCCVEGCSA-N 1 0 297.826 3.557 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)COCC1CC1)c1cc(Cl)ccc1O ZINC000846205527 1131696080 /nfs/dbraw/zinc/69/60/80/1131696080.db2.gz QFGJIBWYSSIKHO-ABAIWWIYSA-N 1 0 297.826 3.901 20 10 CHCDRO COc1ccc(C2([NH2+][C@@H]3CCc4cccc(O)c43)CC2)cc1 ZINC000834718420 1131696782 /nfs/dbraw/zinc/69/67/82/1131696782.db2.gz VBNTWOXUALELCP-MRXNPFEDSA-N 1 0 295.382 3.667 20 10 CHCDRO CC1(C)C[N@H+](Cc2c(O)cccc2Cl)CCC1(F)F ZINC001140338116 1131702691 /nfs/dbraw/zinc/70/26/91/1131702691.db2.gz VSHJFYZUDSVVPH-UHFFFAOYSA-N 1 0 289.753 3.913 20 10 CHCDRO CC(C)[C@H](CC(F)(F)F)[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000834779695 1131704493 /nfs/dbraw/zinc/70/44/93/1131704493.db2.gz RFUVOAOLYRZCBS-NEPJUHHUSA-N 1 0 287.325 3.946 20 10 CHCDRO CC(C)[C@@H](CC(F)(F)F)[NH2+][C@H]1CCc2cccc(O)c21 ZINC000834779696 1131704666 /nfs/dbraw/zinc/70/46/66/1131704666.db2.gz RFUVOAOLYRZCBS-NWDGAFQWSA-N 1 0 287.325 3.946 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CCCC2(CCC2)C1 ZINC001140342807 1131704752 /nfs/dbraw/zinc/70/47/52/1131704752.db2.gz ZAMIRNBQGHBGMG-UHFFFAOYSA-N 1 0 265.784 3.812 20 10 CHCDRO COC1(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)CCCC1 ZINC000834814520 1131707205 /nfs/dbraw/zinc/70/72/05/1131707205.db2.gz LIJDXVRGCWGNBQ-YPMHNXCESA-N 1 0 293.382 3.628 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CSc2ccccc21)c1ccccc1O ZINC000834817873 1131707654 /nfs/dbraw/zinc/70/76/54/1131707654.db2.gz DTAHJKBGBIAZFN-CHWSQXEVSA-N 1 0 285.412 3.932 20 10 CHCDRO CCC[C@H](C[NH2+][C@H](CC)c1ccc(C)cc1O)OC ZINC000834841499 1131711129 /nfs/dbraw/zinc/71/11/29/1131711129.db2.gz VAJDUNGWAGYZDM-UKRRQHHQSA-N 1 0 265.397 3.556 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccnc(C)c1)c1ccc(N(C)C)cc1 ZINC000834859932 1131713349 /nfs/dbraw/zinc/71/33/49/1131713349.db2.gz MCIFVFZZKVSHTO-GOSISDBHSA-N 1 0 283.419 3.697 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)CC(C)(C)O)c1cc(Cl)ccc1O ZINC000834876783 1131715826 /nfs/dbraw/zinc/71/58/26/1131715826.db2.gz OTPWQXBOEGBKEL-GXFFZTMASA-N 1 0 285.815 3.636 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCOC3(CCC3)C2)c(O)c1 ZINC000834882428 1131717135 /nfs/dbraw/zinc/71/71/35/1131717135.db2.gz JVXMDQORWLRIAK-HUUCEWRRSA-N 1 0 289.419 3.701 20 10 CHCDRO CC(C)[C@@H]1C[C@@H](C[NH2+][C@@H](C)c2cc(F)ccc2O)CCO1 ZINC000834884620 1131717459 /nfs/dbraw/zinc/71/74/59/1131717459.db2.gz AAUOMQPHOTWHSC-DCGLDWPTSA-N 1 0 295.398 3.633 20 10 CHCDRO C[C@@H]([NH2+]C[C@@]1(C)CC1(Cl)Cl)c1cc(F)ccc1O ZINC000834884572 1131717969 /nfs/dbraw/zinc/71/79/69/1131717969.db2.gz NQLDLTILOOTYFF-PRHODGIISA-N 1 0 292.181 3.766 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@]2(C)CC2(Cl)Cl)c1 ZINC000834885239 1131718325 /nfs/dbraw/zinc/71/83/25/1131718325.db2.gz UKTSEJKHUJSMQQ-GWCFXTLKSA-N 1 0 288.218 3.935 20 10 CHCDRO CO[C@@](C)(C[NH2+][C@H](C)c1ccccc1O)c1ccccc1 ZINC000834885073 1131718616 /nfs/dbraw/zinc/71/86/16/1131718616.db2.gz SVWLEXSMWYOCGY-KDOFPFPSSA-N 1 0 285.387 3.605 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@]2(C)CC2(Cl)Cl)c(O)c1 ZINC000834885901 1131718807 /nfs/dbraw/zinc/71/88/07/1131718807.db2.gz YVAFSMJPRGAAEB-GWCFXTLKSA-N 1 0 288.218 3.935 20 10 CHCDRO CC[N@H+](Cc1ccccc1)Cc1c(O)ccc2ccncc21 ZINC000834885116 1131718862 /nfs/dbraw/zinc/71/88/62/1131718862.db2.gz SZLGMIIZZFEAEF-UHFFFAOYSA-N 1 0 292.382 3.963 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2cnc(C)cc2C)c(O)c1 ZINC000834903989 1131728355 /nfs/dbraw/zinc/72/83/55/1131728355.db2.gz UPXXEZCAJKRDMN-OAHLLOKOSA-N 1 0 284.403 3.872 20 10 CHCDRO C[C@@H]([NH2+]CCC[C@H]1CCOC1)c1cc(Cl)ccc1O ZINC000834906459 1131728453 /nfs/dbraw/zinc/72/84/53/1131728453.db2.gz WVTHKGQTZYJSEH-NEPJUHHUSA-N 1 0 283.799 3.513 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCOC(C)(C)C1)c1ccccc1O ZINC000834911519 1131732191 /nfs/dbraw/zinc/73/21/91/1131732191.db2.gz TZZJOKHSOYTWCN-HIFRSBDPSA-N 1 0 277.408 3.638 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCOC(C)(C)C1)c1ccccc1O ZINC000834911522 1131732278 /nfs/dbraw/zinc/73/22/78/1131732278.db2.gz TZZJOKHSOYTWCN-ZFWWWQNUSA-N 1 0 277.408 3.638 20 10 CHCDRO C[N@H+](Cc1ccc(F)cc1)Cc1ccc(Cl)cc1O ZINC001140461029 1131747986 /nfs/dbraw/zinc/74/79/86/1131747986.db2.gz BURVVIVASIGAKI-UHFFFAOYSA-N 1 0 279.742 3.817 20 10 CHCDRO CC[C@@H]([NH2+]CCc1noc2ccccc12)c1ccccc1O ZINC000846844815 1131750353 /nfs/dbraw/zinc/75/03/53/1131750353.db2.gz PWBVIMIMUGLICL-OAHLLOKOSA-N 1 0 296.370 3.817 20 10 CHCDRO Oc1cc(Cl)ccc1C[N@@H+]1CCC[C@@H]2CCC[C@H]21 ZINC001140465430 1131750299 /nfs/dbraw/zinc/75/02/99/1131750299.db2.gz NAGBPWHMYKRBBB-SMDDNHRTSA-N 1 0 265.784 3.810 20 10 CHCDRO Cc1ccccc1C[N@@H+](C)Cc1ccc(Cl)cc1O ZINC001140465927 1131750672 /nfs/dbraw/zinc/75/06/72/1131750672.db2.gz WHHDMLZIUVBBJQ-UHFFFAOYSA-N 1 0 275.779 3.986 20 10 CHCDRO C[C@@H](c1ccncc1)[N@H+](C)C/C=C/c1ccc(N(C)C)cc1 ZINC000835046969 1131763374 /nfs/dbraw/zinc/76/33/74/1131763374.db2.gz AZQDGUXOEXAWBV-JFDDCEBESA-N 1 0 295.430 3.854 20 10 CHCDRO COc1ccc2c(c1)C[N@@H+](Cc1cc(C)ccc1O)CCC2 ZINC001140624494 1131832762 /nfs/dbraw/zinc/83/27/62/1131832762.db2.gz YINLVHNRPJXYAT-UHFFFAOYSA-N 1 0 297.398 3.658 20 10 CHCDRO C[N@H+](Cc1ccccc1O)Cc1cccc2ccncc21 ZINC001140644238 1131844059 /nfs/dbraw/zinc/84/40/59/1131844059.db2.gz FOWFCTASVQWKTO-UHFFFAOYSA-N 1 0 278.355 3.572 20 10 CHCDRO C[C@@H]1CCC[C@@H]1C[NH2+]Cc1cc(Cl)cc(F)c1[O-] ZINC000798963053 1131845634 /nfs/dbraw/zinc/84/56/34/1131845634.db2.gz WENOGKQGQREXPZ-NXEZZACHSA-N 1 0 271.763 3.711 20 10 CHCDRO Cc1c(O)ccc(C[N@@H+](Cc2ccccc2)C(C)C)c1O ZINC001140742731 1131905759 /nfs/dbraw/zinc/90/57/59/1131905759.db2.gz XBDJCLPWONJWPK-UHFFFAOYSA-N 1 0 285.387 3.817 20 10 CHCDRO Cc1c(O)ccc(C[NH+]2CCC3(CC[C@H](F)C3)CC2)c1O ZINC001140749403 1131906466 /nfs/dbraw/zinc/90/64/66/1131906466.db2.gz YHDYEQUDXUXWQG-AWEZNQCLSA-N 1 0 293.382 3.510 20 10 CHCDRO CCCC[N@H+](CC)Cc1ccc(N(CC)CC)cc1O ZINC001140852054 1131947571 /nfs/dbraw/zinc/94/75/71/1131947571.db2.gz ZXNHTIKIRQXXNA-UHFFFAOYSA-N 1 0 278.440 3.860 20 10 CHCDRO Oc1ccccc1C[NH2+]C[C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000712975637 1131960433 /nfs/dbraw/zinc/96/04/33/1131960433.db2.gz WIUOUKNTUFDRDB-AAEUAGOBSA-N 1 0 287.325 3.851 20 10 CHCDRO CN(C)c1ccc(CN2CCC[C@@](C)(F)C2)c(Cl)c1 ZINC001140922256 1131963783 /nfs/dbraw/zinc/96/37/83/1131963783.db2.gz LWPQBZGCZCNSSH-OAHLLOKOSA-N 1 0 284.806 3.730 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2ccccc2Cl)c(O)c1 ZINC001140949716 1131968776 /nfs/dbraw/zinc/96/87/76/1131968776.db2.gz JHKVMJOSSUKKRT-UHFFFAOYSA-N 1 0 275.779 3.986 20 10 CHCDRO Cc1ccc(C[N@@H+]2Cc3ccccc3[C@@H](C)C2)c(O)c1 ZINC001140948173 1131968984 /nfs/dbraw/zinc/96/89/84/1131968984.db2.gz WOKYUZPDNXAFNG-AWEZNQCLSA-N 1 0 267.372 3.820 20 10 CHCDRO Cc1ccc(C[N@@H+]2CCc3ccccc3[C@H]2C)c(O)c1 ZINC001140948057 1131969857 /nfs/dbraw/zinc/96/98/57/1131969857.db2.gz RBIUYRBEBWMLBV-CQSZACIVSA-N 1 0 267.372 3.820 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H]2CCc3c(F)cccc3C2)cc1 ZINC001171410747 1131979027 /nfs/dbraw/zinc/97/90/27/1131979027.db2.gz XSAMFFJTFMQOAD-INIZCTEOSA-N 1 0 298.405 3.539 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CC12CC2)c1ccc2ccccc2c1O ZINC000715220331 1131980630 /nfs/dbraw/zinc/98/06/30/1131980630.db2.gz AKTUDJAGSGGHIL-IAQYHMDHSA-N 1 0 253.345 3.749 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CC12CC2)c1ccc2ccccc2c1O ZINC000715220330 1131981660 /nfs/dbraw/zinc/98/16/60/1131981660.db2.gz AKTUDJAGSGGHIL-ABAIWWIYSA-N 1 0 253.345 3.749 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H]2CCCC[C@@H]2CC)c1O ZINC000037032043 1131989739 /nfs/dbraw/zinc/98/97/39/1131989739.db2.gz MPAKLSVJWKMMHE-DZGCQCFKSA-N 1 0 277.408 3.849 20 10 CHCDRO Cc1ccncc1C[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001141035157 1131990856 /nfs/dbraw/zinc/99/08/56/1131990856.db2.gz JQPYHBAATGJJGK-UHFFFAOYSA-N 1 0 295.430 3.622 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2ccns2)c1 ZINC000715964033 1132000724 /nfs/dbraw/zinc/00/07/24/1132000724.db2.gz CLEYIIDOCHDEFG-WDEREUQCSA-N 1 0 262.378 3.569 20 10 CHCDRO CC[C@H]1CCC[N@@H+]1Cc1cc2c3c(c1)CCCN3CCC2 ZINC001141076467 1132006317 /nfs/dbraw/zinc/00/63/17/1132006317.db2.gz SLSVPWFKPZCTHN-SFHVURJKSA-N 1 0 284.447 3.760 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)cc1 ZINC000037214537 1132021701 /nfs/dbraw/zinc/02/17/01/1132021701.db2.gz RRGCZYDKDRYUCS-HNNXBMFYSA-N 1 0 268.404 3.912 20 10 CHCDRO Clc1ccc(C[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC000037362955 1132030588 /nfs/dbraw/zinc/03/05/88/1132030588.db2.gz PBGWUCLWNCQVED-UHFFFAOYSA-N 1 0 273.763 3.565 20 10 CHCDRO c1ccc2c(c1)CCC[C@@H]2[NH2+]Cc1ccc2c(c1)CCO2 ZINC000037362817 1132030920 /nfs/dbraw/zinc/03/09/20/1132030920.db2.gz WMRRZGUCVSBQSG-SFHVURJKSA-N 1 0 279.383 3.789 20 10 CHCDRO CC[C@H](c1ccccc1)[N@H+](C)Cc1cc(O)ccc1O ZINC001141160949 1132031840 /nfs/dbraw/zinc/03/18/40/1132031840.db2.gz KORAIBGPSOPRRY-MRXNPFEDSA-N 1 0 271.360 3.681 20 10 CHCDRO CC[N@H+](Cc1cccc(Cl)c1)Cc1cc(O)ccc1O ZINC001141162312 1132031965 /nfs/dbraw/zinc/03/19/65/1132031965.db2.gz OXLKJGYFMBYYNH-UHFFFAOYSA-N 1 0 291.778 3.773 20 10 CHCDRO CC[C@@H]1C[N@H+](Cc2ccc(N(C)CC)cc2)[C@@H](CC)CO1 ZINC001171778859 1132098758 /nfs/dbraw/zinc/09/87/58/1132098758.db2.gz QULLHEQMNXDWPE-FUHWJXTLSA-N 1 0 290.451 3.532 20 10 CHCDRO Cc1cc(C[N@@H+](C)Cc2ccc(N(C)C)cc2)cs1 ZINC001248804188 1132118951 /nfs/dbraw/zinc/11/89/51/1132118951.db2.gz QSKUTARHSUKJJR-UHFFFAOYSA-N 1 0 274.433 3.755 20 10 CHCDRO CC[C@@H](C)OCC[C@H](C)[N@H+](CC)Cc1ccccc1O ZINC001172356437 1132185951 /nfs/dbraw/zinc/18/59/51/1132185951.db2.gz YKXOLRLMJKCTNS-LSDHHAIUSA-N 1 0 279.424 3.808 20 10 CHCDRO Cc1cccc(C[NH2+]C2CCC(C(F)F)CC2)c1O ZINC000839179669 1132188385 /nfs/dbraw/zinc/18/83/85/1132188385.db2.gz MYSKAHISTMQDTL-UHFFFAOYSA-N 1 0 269.335 3.614 20 10 CHCDRO Cc1ccc(O)c(CNc2ccc(C[NH+](C)C)c(C)c2)c1 ZINC000839188382 1132189495 /nfs/dbraw/zinc/18/94/95/1132189495.db2.gz GLXCCJPQTZMFFH-UHFFFAOYSA-N 1 0 284.403 3.683 20 10 CHCDRO CC[C@@H](CC(C)C)[N@@H+]1CCCc2cc(O)c(O)cc2C1 ZINC001172404221 1132197606 /nfs/dbraw/zinc/19/76/06/1132197606.db2.gz SXSAUUDQNGMFMC-HNNXBMFYSA-N 1 0 277.408 3.671 20 10 CHCDRO C[C@@H]1CC(C)(C)C[N@@H+]1Cc1c(O)ccc2ccncc21 ZINC000840182634 1132248764 /nfs/dbraw/zinc/24/87/64/1132248764.db2.gz HVMNPYBEFWJPGV-GFCCVEGCSA-N 1 0 270.376 3.561 20 10 CHCDRO COc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2)c(C)c1 ZINC000840709580 1132272833 /nfs/dbraw/zinc/27/28/33/1132272833.db2.gz KHHQDUYFPJVPLI-HNNXBMFYSA-N 1 0 298.430 3.920 20 10 CHCDRO CC[C@H]([NH2+][C@H]1C[C@@H](OC(C)C)C1)c1ccc(C)cc1O ZINC000840764620 1132284022 /nfs/dbraw/zinc/28/40/22/1132284022.db2.gz QRJSUUIVZPPWNL-LZWOXQAQSA-N 1 0 277.408 3.697 20 10 CHCDRO CCO[C@H]1C[C@@H]([NH2+][C@H](CC)c2cc(Cl)ccc2O)C1 ZINC000840764694 1132284454 /nfs/dbraw/zinc/28/44/54/1132284454.db2.gz YBLKXNMEQURLDY-MBNYWOFBSA-N 1 0 283.799 3.654 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@H]2C[C@@H](OC(C)C)C2)c(O)c1 ZINC000840765127 1132284999 /nfs/dbraw/zinc/28/49/99/1132284999.db2.gz VJPPNASAZPPEEE-SOUVJXGZSA-N 1 0 277.408 3.616 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccc(C)c(C)n2)c(O)c1 ZINC000840783385 1132286250 /nfs/dbraw/zinc/28/62/50/1132286250.db2.gz JGQVMXNBSWJNEA-OAHLLOKOSA-N 1 0 284.403 3.872 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2ccc(C)c(C)n2)c(O)c1 ZINC000840783384 1132286875 /nfs/dbraw/zinc/28/68/75/1132286875.db2.gz JGQVMXNBSWJNEA-HNNXBMFYSA-N 1 0 284.403 3.872 20 10 CHCDRO COC1CCC([NH2+][C@H](C)c2cc(Cl)ccc2O)CC1 ZINC000840791673 1132287696 /nfs/dbraw/zinc/28/76/96/1132287696.db2.gz BPIWHNLQPCGTMD-QFWMXSHPSA-N 1 0 283.799 3.654 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]C2CCC(OC)CC2)cc1 ZINC000840791488 1132287959 /nfs/dbraw/zinc/28/79/59/1132287959.db2.gz GHXDZRRNDPWSGF-MXWWQKGMSA-N 1 0 290.451 3.751 20 10 CHCDRO CCn1ccc(C[NH2+][C@@H](C)c2ccc3ccccc3c2O)n1 ZINC000840841531 1132292260 /nfs/dbraw/zinc/29/22/60/1132292260.db2.gz VMMSMVXASXUPCJ-ZDUSSCGKSA-N 1 0 295.386 3.613 20 10 CHCDRO CC[C@H]([NH2+]CC(C)(C)OCC1CC1)c1ccccc1O ZINC000840876422 1132299683 /nfs/dbraw/zinc/29/96/83/1132299683.db2.gz MOPNNQVXRRCIBE-HNNXBMFYSA-N 1 0 277.408 3.638 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2CCC[C@H](CO)C2)c1O ZINC000840893376 1132305830 /nfs/dbraw/zinc/30/58/30/1132305830.db2.gz GNAIOVYMHIKOEV-OBJOEFQTSA-N 1 0 297.826 3.556 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H](C)c1cccnc1 ZINC000840893529 1132306196 /nfs/dbraw/zinc/30/61/96/1132306196.db2.gz KNMJDJODZZJUAY-HOTGVXAUSA-N 1 0 297.446 3.738 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@@H]1c1ccccn1 ZINC000840911223 1132306961 /nfs/dbraw/zinc/30/69/61/1132306961.db2.gz XYFTTXVZCREGHH-LJQANCHMSA-N 1 0 295.430 3.793 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CCNc2ccccc2)c(Cl)c1 ZINC000840906370 1132308069 /nfs/dbraw/zinc/30/80/69/1132308069.db2.gz XPRGYGALFFCZBT-UHFFFAOYSA-N 1 0 290.794 3.556 20 10 CHCDRO CC[C@@H](CC(F)(F)F)[NH2+]Cc1ccc(N(C)C)cc1C ZINC000840940279 1132309613 /nfs/dbraw/zinc/30/96/13/1132309613.db2.gz YHBFBIDWVCSELF-ZDUSSCGKSA-N 1 0 288.357 3.882 20 10 CHCDRO Cc1csc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)n1 ZINC000840931542 1132309816 /nfs/dbraw/zinc/30/98/16/1132309816.db2.gz HPOZEVMWRXMPOC-CYBMUJFWSA-N 1 0 289.448 3.677 20 10 CHCDRO Oc1c(C[N@@H+]2CCO[C@H](C3CCC3)C2)ccc2ccccc21 ZINC000840954158 1132313401 /nfs/dbraw/zinc/31/34/01/1132313401.db2.gz HTRKNQITUKOBMV-SFHVURJKSA-N 1 0 297.398 3.546 20 10 CHCDRO COCC[C@H](C)C[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000840955864 1132313856 /nfs/dbraw/zinc/31/38/56/1132313856.db2.gz YVWLWEHGRMXDIQ-HNNXBMFYSA-N 1 0 299.414 3.821 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCSC3(CCC3)CC2)c1O ZINC000840955431 1132314227 /nfs/dbraw/zinc/31/42/27/1132314227.db2.gz WCKXYDIEZNXJTG-UHFFFAOYSA-N 1 0 277.433 3.562 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+]C1CC(C(F)F)C1 ZINC000840976705 1132316882 /nfs/dbraw/zinc/31/68/82/1132316882.db2.gz QDNVMPQWHMKKMY-LRVUVFPRSA-N 1 0 296.405 3.625 20 10 CHCDRO C[C@@]1(F)CC[N@H+](Cc2c(O)ccc3ccccc32)C[C@@H]1F ZINC001231587623 1132317104 /nfs/dbraw/zinc/31/71/04/1132317104.db2.gz WSISTPCOUCEPBE-DLBZAZTESA-N 1 0 291.341 3.817 20 10 CHCDRO COCC[C@@H]1CCCC[N@@H+]1Cc1c(O)ccc2ccccc21 ZINC001231588118 1132318089 /nfs/dbraw/zinc/31/80/89/1132318089.db2.gz IQJCLAKTGSTGEW-INIZCTEOSA-N 1 0 299.414 3.936 20 10 CHCDRO CCCC[C@@H]1CCC[C@@H]1[NH2+]CCc1ccc(N)cc1 ZINC000841035855 1132321412 /nfs/dbraw/zinc/32/14/12/1132321412.db2.gz PLLVPLNBNDLLSF-WBVHZDCISA-N 1 0 260.425 3.760 20 10 CHCDRO CCCCOc1ccccc1C[NH2+]CCc1ccc(N)cc1 ZINC000841035959 1132321451 /nfs/dbraw/zinc/32/14/51/1132321451.db2.gz RAFPBKBLCVHPAT-UHFFFAOYSA-N 1 0 298.430 3.780 20 10 CHCDRO CC(C)c1ccc(CC[NH2+]CCc2ccc(N)cc2)cc1 ZINC000841036879 1132321701 /nfs/dbraw/zinc/32/17/01/1132321701.db2.gz WWKJSFHJVFLEKK-UHFFFAOYSA-N 1 0 282.431 3.767 20 10 CHCDRO Cc1ccc(CC[C@H](C)[NH2+]CCc2ccc(N)cc2)cc1 ZINC000841036496 1132321781 /nfs/dbraw/zinc/32/17/81/1132321781.db2.gz TVHOUXFEFKYUKF-INIZCTEOSA-N 1 0 282.431 3.731 20 10 CHCDRO CCC[C@H](Cc1ccccc1)[NH2+]CCc1ccc(N)cc1 ZINC000841035329 1132321832 /nfs/dbraw/zinc/32/18/32/1132321832.db2.gz MSJVTRKKFUWONJ-LJQANCHMSA-N 1 0 282.431 3.812 20 10 CHCDRO Cc1cc(C)c(C[NH2+]CCc2ccc(N)cc2)c(C)c1 ZINC000841037740 1132322875 /nfs/dbraw/zinc/32/28/75/1132322875.db2.gz WDSJXIWMEKMUEJ-UHFFFAOYSA-N 1 0 268.404 3.526 20 10 CHCDRO Nc1ccc(CC[NH2+][C@H]2CCC[C@H](C(F)(F)F)C2)cc1 ZINC000841038034 1132323017 /nfs/dbraw/zinc/32/30/17/1132323017.db2.gz GANKSUVCWDPLMZ-JSGCOSHPSA-N 1 0 286.341 3.522 20 10 CHCDRO COc1ccc(C[NH2+]Cc2ccc3c(c2)CCCN3)cc1C ZINC000841070536 1132324418 /nfs/dbraw/zinc/32/44/18/1132324418.db2.gz QDRAWDXVQUPDAI-UHFFFAOYSA-N 1 0 296.414 3.652 20 10 CHCDRO CCN(CC)c1ccc(CNc2ccc(C[NH2+]C)cc2)cc1 ZINC000841071278 1132326878 /nfs/dbraw/zinc/32/68/78/1132326878.db2.gz LZSBGGQTGBEGJC-UHFFFAOYSA-N 1 0 297.446 3.864 20 10 CHCDRO C[C@@H](Cc1c(F)cccc1Cl)[NH2+]Cc1ccccc1O ZINC001172838580 1132331811 /nfs/dbraw/zinc/33/18/11/1132331811.db2.gz XLUYUKRGDVCYQV-NSHDSACASA-N 1 0 293.769 3.906 20 10 CHCDRO Cc1cc(C)c(C[N@H+](C)Cc2cnc(Cl)s2)c(O)c1 ZINC001231842988 1132375649 /nfs/dbraw/zinc/37/56/49/1132375649.db2.gz RFUMFISOTUNFEV-UHFFFAOYSA-N 1 0 296.823 3.751 20 10 CHCDRO Cc1cc(C)c(C[N@H+]2CCC[C@@H](C)[C@@H](C)C2)c(O)c1 ZINC001231842455 1132376147 /nfs/dbraw/zinc/37/61/47/1132376147.db2.gz MKDSJJPWFXFLNU-HIFRSBDPSA-N 1 0 261.409 3.877 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCC23CCCCC3)c(O)c1 ZINC001231842464 1132377442 /nfs/dbraw/zinc/37/74/42/1132377442.db2.gz MWIGUNBKGHVYRX-UHFFFAOYSA-N 1 0 259.393 3.918 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCC[C@@H]2c2nccs2)c(O)c1 ZINC001231846872 1132377756 /nfs/dbraw/zinc/37/77/56/1132377756.db2.gz RQRWRTCVZPQDHJ-CQSZACIVSA-N 1 0 288.416 3.803 20 10 CHCDRO Cc1cc(C)c(C[N@H+](C)CCc2ccc(F)cc2)c(O)c1 ZINC001231847005 1132377782 /nfs/dbraw/zinc/37/77/82/1132377782.db2.gz UJRURLQKTQLXTE-UHFFFAOYSA-N 1 0 287.378 3.823 20 10 CHCDRO CCC[N@H+](Cc1ccc(N(C)C)cc1OC)[C@H](C)CC ZINC001231849774 1132378197 /nfs/dbraw/zinc/37/81/97/1132378197.db2.gz ZAOPAWLFGYUHIC-CQSZACIVSA-N 1 0 278.440 3.772 20 10 CHCDRO Cc1cc(C)c(C[NH+]2CCC(C(C)C)CC2)c(O)c1 ZINC001231849921 1132379553 /nfs/dbraw/zinc/37/95/53/1132379553.db2.gz WEHBEPDWQFEUSK-UHFFFAOYSA-N 1 0 261.409 3.877 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CC[C@@H]3CCC[C@@H]3C2)c(O)c1 ZINC001231844630 1132379638 /nfs/dbraw/zinc/37/96/38/1132379638.db2.gz OKYLYKCFJVBIDA-LSDHHAIUSA-N 1 0 259.393 3.631 20 10 CHCDRO CCC[N@H+](Cc1cc(Cl)c(C)cc1O)C1CCOCC1 ZINC001231870268 1132382845 /nfs/dbraw/zinc/38/28/45/1132382845.db2.gz QUUIAHHZTFQNSI-UHFFFAOYSA-N 1 0 297.826 3.745 20 10 CHCDRO Cc1cc(O)c(C[NH+]2C[C@H]3CCCC[C@@H]3C2)cc1Cl ZINC001231867990 1132385356 /nfs/dbraw/zinc/38/53/56/1132385356.db2.gz OZVPETLKYDXMCH-CHWSQXEVSA-N 1 0 279.811 3.976 20 10 CHCDRO COc1cccc(C[NH2+][C@H](C)c2ccc(Cl)cc2O)c1 ZINC000841743034 1132388024 /nfs/dbraw/zinc/38/80/24/1132388024.db2.gz BOQYKROFVCNABJ-LLVKDONJSA-N 1 0 291.778 3.905 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)c1ccccn1 ZINC000841743134 1132388636 /nfs/dbraw/zinc/38/86/36/1132388636.db2.gz CTYYDKACWIMJOF-QWRGUYRKSA-N 1 0 276.767 3.852 20 10 CHCDRO Oc1c(C[NH+]2CC3(CCC3)C2)ccc2ccccc21 ZINC001231879590 1132388911 /nfs/dbraw/zinc/38/89/11/1132388911.db2.gz JKIYASIJUKHMEV-UHFFFAOYSA-N 1 0 253.345 3.531 20 10 CHCDRO CCC[N@H+](Cc1ccc2ccccc2c1O)C1CCOCC1 ZINC001231883333 1132389099 /nfs/dbraw/zinc/38/90/99/1132389099.db2.gz OQPRRMZDJNHZHF-UHFFFAOYSA-N 1 0 299.414 3.936 20 10 CHCDRO CCCO[C@@H]1CC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC001231882151 1132390672 /nfs/dbraw/zinc/39/06/72/1132390672.db2.gz LVSYKISBGCNGCG-MRXNPFEDSA-N 1 0 285.387 3.546 20 10 CHCDRO CCc1cnc(C[NH2+][C@H](C)c2ccc(Cl)cc2O)s1 ZINC000841755675 1132391884 /nfs/dbraw/zinc/39/18/84/1132391884.db2.gz QSFDKHQWOXXWPB-SECBINFHSA-N 1 0 296.823 3.915 20 10 CHCDRO CO[C@H](C[NH2+][C@H](C)c1ccc(Cl)cc1O)C(C)(C)C ZINC000841756179 1132392719 /nfs/dbraw/zinc/39/27/19/1132392719.db2.gz USXCGUDSGUMFEM-QMTHXVAHSA-N 1 0 285.815 3.757 20 10 CHCDRO CO[C@@H]([C@H](C)[NH2+][C@@H](C)c1ccc(Cl)cc1O)C1CC1 ZINC000841758876 1132394333 /nfs/dbraw/zinc/39/43/33/1132394333.db2.gz VRKUSLJRNXEDKY-YHAQOWFVSA-N 1 0 283.799 3.510 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1COCc2ccccc21)c1ccccc1O ZINC000841758365 1132394848 /nfs/dbraw/zinc/39/48/48/1132394848.db2.gz AOTZWCWURABLGJ-IAGOWNOFSA-N 1 0 283.371 3.704 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H](CO)CC2CCCCC2)c(O)c1 ZINC000841760984 1132396115 /nfs/dbraw/zinc/39/61/15/1132396115.db2.gz HLJFXZKJRWYVIW-ZBFHGGJFSA-N 1 0 291.435 3.683 20 10 CHCDRO CCCC[C@H](CC(C)C)[NH2+]Cc1ccc(O)cc1O ZINC001173252498 1132422325 /nfs/dbraw/zinc/42/23/25/1132422325.db2.gz IZAUDXGXDVVXRK-CQSZACIVSA-N 1 0 265.397 3.792 20 10 CHCDRO Oc1cc(O)c(C[NH+]2CCC3(CCCC3)CC2)cc1Cl ZINC001232258113 1132444062 /nfs/dbraw/zinc/44/40/62/1132444062.db2.gz QICPMVOSTWJMOJ-UHFFFAOYSA-N 1 0 295.810 3.907 20 10 CHCDRO Cc1cccc(C[N@@H+](C)Cc2cc(Cl)c(O)cc2O)c1 ZINC001232261247 1132445085 /nfs/dbraw/zinc/44/50/85/1132445085.db2.gz XTEYNDZKDUBQTI-UHFFFAOYSA-N 1 0 291.778 3.692 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2cc(Cl)c(O)cc2O)cc1 ZINC001232261407 1132445399 /nfs/dbraw/zinc/44/53/99/1132445399.db2.gz HDYVVFACRLVYKS-UHFFFAOYSA-N 1 0 291.778 3.692 20 10 CHCDRO COc1cc(O)c(C[NH+]2C[C@H](C)C[C@@H](C)C2)cc1Cl ZINC001232269485 1132447534 /nfs/dbraw/zinc/44/75/34/1132447534.db2.gz BXPNENKLGCLAPQ-GHMZBOCLSA-N 1 0 283.799 3.532 20 10 CHCDRO COc1cccc(C[NH2+]C2(c3cccc(C)c3)CCC2)c1O ZINC000842744785 1132457076 /nfs/dbraw/zinc/45/70/76/1132457076.db2.gz AUYLPDDUDBWZDU-UHFFFAOYSA-N 1 0 297.398 3.878 20 10 CHCDRO CCOCc1cc(C[NH2+][C@@H]2CC[C@H]3C[C@H]3C2)ccc1OC ZINC000842775441 1132461264 /nfs/dbraw/zinc/46/12/64/1132461264.db2.gz CLKHPGORIDNSLE-YQQAZPJKSA-N 1 0 289.419 3.510 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](C)CC(F)F)c(O)c1C ZINC000842890876 1132474975 /nfs/dbraw/zinc/47/49/75/1132474975.db2.gz VDDCBNNPLSMLIO-JOYOIKCWSA-N 1 0 271.351 3.951 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCS[C@H]1C)c1ccc(N(C)C)cc1 ZINC000842927358 1132476279 /nfs/dbraw/zinc/47/62/79/1132476279.db2.gz CNDVQMSDWTWLTN-RCBQFDQVSA-N 1 0 278.465 3.687 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CO[C@H](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000842928973 1132477870 /nfs/dbraw/zinc/47/78/70/1132477870.db2.gz LGEAHASKXHXWNM-BFYDXBDKSA-N 1 0 288.435 3.505 20 10 CHCDRO C[C@@H]([NH2+]CC1CCC(F)CC1)c1cc(F)ccc1O ZINC000842929298 1132478158 /nfs/dbraw/zinc/47/81/58/1132478158.db2.gz OQWZAOFVWGZLGN-VOMCLLRMSA-N 1 0 269.335 3.710 20 10 CHCDRO CC(C)(C)c1cccc(C[N@@H+]2CC[C@](C)(F)[C@H](F)C2)c1O ZINC001143104535 1132502157 /nfs/dbraw/zinc/50/21/57/1132502157.db2.gz UXSAGVYWKWBGDZ-PBHICJAKSA-N 1 0 297.389 3.962 20 10 CHCDRO CCOC1CC[NH+](Cc2cccc(C(C)(C)C)c2O)CC1 ZINC001143111228 1132504691 /nfs/dbraw/zinc/50/46/91/1132504691.db2.gz ZPUZHDCQNIFDOR-UHFFFAOYSA-N 1 0 291.435 3.691 20 10 CHCDRO CCC[N@H+](Cc1ccccc1)Cc1ccc(N(C)C)cc1O ZINC001232838324 1132528101 /nfs/dbraw/zinc/52/81/01/1132528101.db2.gz DZZRFINEFJTVTI-UHFFFAOYSA-N 1 0 298.430 3.870 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)[C@@H]2CCc3ccccc32)c(O)c1 ZINC001232841734 1132528997 /nfs/dbraw/zinc/52/89/97/1132528997.db2.gz APNUQTYVDBNJSW-GOSISDBHSA-N 1 0 296.414 3.578 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH+]1CC(C)(CC(F)F)C1 ZINC000843424800 1132533105 /nfs/dbraw/zinc/53/31/05/1132533105.db2.gz KEYYRVYIMNRGOF-UHFFFAOYSA-N 1 0 282.378 3.538 20 10 CHCDRO CC[C@H]1CCC[N@H+](Cc2c(O)cccc2Cl)C1 ZINC000132250800 1132579198 /nfs/dbraw/zinc/57/91/98/1132579198.db2.gz SLMCNTJLSSYFKB-NSHDSACASA-N 1 0 253.773 3.668 20 10 CHCDRO CC1CC[NH+](Cc2cc(C(C)(C)C)ccc2O)CC1 ZINC001233283749 1132594585 /nfs/dbraw/zinc/59/45/85/1132594585.db2.gz UCAXJZGSLNSJCR-UHFFFAOYSA-N 1 0 261.409 3.922 20 10 CHCDRO CC(C)(C)c1ccc(O)c(C[NH+]2CC(c3cccnc3)C2)c1 ZINC001233286648 1132594746 /nfs/dbraw/zinc/59/47/46/1132594746.db2.gz CXCBVMCTDARXIJ-UHFFFAOYSA-N 1 0 296.414 3.684 20 10 CHCDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CCC[C@H](CF)C2)c1 ZINC001233286339 1132594949 /nfs/dbraw/zinc/59/49/49/1132594949.db2.gz PJIMALZNUMJWSE-CYBMUJFWSA-N 1 0 279.399 3.871 20 10 CHCDRO CO[C@@H]1CC[N@H+](Cc2cc(C(C)(C)C)ccc2O)[C@@H](C)C1 ZINC001233287429 1132596224 /nfs/dbraw/zinc/59/62/24/1132596224.db2.gz PELSODCVZDZLGW-XJKSGUPXSA-N 1 0 291.435 3.689 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CCC[C@H](C)[C@@H](C)C2)c1O ZINC001233287887 1132597106 /nfs/dbraw/zinc/59/71/06/1132597106.db2.gz LJLQVHFZKLLPGD-RYUDHWBXSA-N 1 0 297.826 3.922 20 10 CHCDRO C[N@@H+](Cc1ccc(C(F)(F)F)cc1O)C[C@@H]1CC1(C)C ZINC001233454664 1132626485 /nfs/dbraw/zinc/62/64/85/1132626485.db2.gz DXPSZEPDRWTHRZ-LBPRGKRZSA-N 1 0 287.325 3.889 20 10 CHCDRO CC[NH+](CC)Cc1ccccc1Nc1ccc(N)cc1 ZINC001159486212 1132854015 /nfs/dbraw/zinc/85/40/15/1132854015.db2.gz ZNJBIRBOSCDAHF-UHFFFAOYSA-N 1 0 269.392 3.854 20 10 CHCDRO Nc1ccc(CCc2ccc(NC3=C[NH2+]CCC3)cc2)cc1 ZINC001159551513 1132862007 /nfs/dbraw/zinc/86/20/07/1132862007.db2.gz FNNYOBORKYILGO-UHFFFAOYSA-N 1 0 293.414 3.691 20 10 CHCDRO COc1ccc(N(c2ccc(N)cc2)C2=C[NH2+]CCC2)cc1 ZINC001159715457 1132898179 /nfs/dbraw/zinc/89/81/79/1132898179.db2.gz YLQLQNHSEDABAM-UHFFFAOYSA-N 1 0 295.386 3.640 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]CCC[C@H]1C=CCC1 ZINC001203554137 1133338559 /nfs/dbraw/zinc/33/85/59/1133338559.db2.gz WUGADQOOTRDOCT-LBPRGKRZSA-N 1 0 265.784 3.882 20 10 CHCDRO C[C@H]([NH2+]Cc1cnc(-c2ccccc2)[nH]1)c1ccccc1O ZINC001203542310 1133339496 /nfs/dbraw/zinc/33/94/96/1133339496.db2.gz XDFAXSURKVJTPN-ZDUSSCGKSA-N 1 0 293.370 3.633 20 10 CHCDRO COc1ccc(C[N@@H+]2Cc3ccccc3C(C)(C)C2)c(O)c1 ZINC001203629190 1133347119 /nfs/dbraw/zinc/34/71/19/1133347119.db2.gz SLJIRFWHBCLGAL-UHFFFAOYSA-N 1 0 297.398 3.694 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH+]1CCC2(CC(F)C2)CC1 ZINC001203651465 1133347715 /nfs/dbraw/zinc/34/77/15/1133347715.db2.gz PRCNKKSPVLVSMT-UHFFFAOYSA-N 1 0 283.774 3.760 20 10 CHCDRO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc(O)c(O)c2)cc1 ZINC001203878611 1133377839 /nfs/dbraw/zinc/37/78/39/1133377839.db2.gz IFQJEDJVERABLT-INIZCTEOSA-N 1 0 283.371 3.743 20 10 CHCDRO Oc1ccc(C[N@@H+]2CCCC[C@H]2c2ccccc2)cc1O ZINC001203875377 1133377959 /nfs/dbraw/zinc/37/79/59/1133377959.db2.gz MZTFVVTZOXDFTQ-INIZCTEOSA-N 1 0 283.371 3.825 20 10 CHCDRO C[N@H+](Cc1ccc(O)c(O)c1)Cc1ccc2ccccc2c1 ZINC001203881905 1133378934 /nfs/dbraw/zinc/37/89/34/1133378934.db2.gz XPVFWQNYOCNEBT-UHFFFAOYSA-N 1 0 293.366 3.883 20 10 CHCDRO C[C@H]1CC[C@H](C)[N@H+](Cc2ccc(Cl)cc2O)C1 ZINC001204164132 1133411989 /nfs/dbraw/zinc/41/19/89/1133411989.db2.gz YNCPEHMOBPNXPL-QWRGUYRKSA-N 1 0 253.773 3.666 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+]1C[C@H](C)CC[C@@H]1C ZINC001204163904 1133412368 /nfs/dbraw/zinc/41/23/68/1133412368.db2.gz VLSLZNYUBQQIGF-HIFRSBDPSA-N 1 0 260.425 3.681 20 10 CHCDRO FC(F)[C@H]1CCC[N@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001204323043 1133436350 /nfs/dbraw/zinc/43/63/50/1133436350.db2.gz ZPTYACMHSGTLRB-HNNXBMFYSA-N 1 0 294.389 3.764 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[N@@H+](CC1CC1)C1CC1 ZINC001204328857 1133438031 /nfs/dbraw/zinc/43/80/31/1133438031.db2.gz QIXYVYXMEUPODU-UHFFFAOYSA-N 1 0 270.420 3.661 20 10 CHCDRO CC1(C)CC[NH+](Cc2ccc(N3CCCC3)cc2)CC1 ZINC001204327454 1133438310 /nfs/dbraw/zinc/43/83/10/1133438310.db2.gz UXIZTUFMUACFPB-UHFFFAOYSA-N 1 0 272.436 3.909 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH+]2CCC(C)(C)CC2)cc1 ZINC001204533341 1133458927 /nfs/dbraw/zinc/45/89/27/1133458927.db2.gz FBNAGDYQHOSVCN-WAYWQWQTSA-N 1 0 272.436 3.888 20 10 CHCDRO CC[C@@H](C)[C@@H]1CCCC[N@@H+]1Cc1cc(OC)ccc1O ZINC001204690692 1133476366 /nfs/dbraw/zinc/47/63/66/1133476366.db2.gz XKLNVBRAKLMMFC-CJNGLKHVSA-N 1 0 277.408 3.801 20 10 CHCDRO CC[C@@H]1CC[N@H+](Cc2cc(F)c(N(C)C)cc2F)[C@@H]1C ZINC001205471623 1133580462 /nfs/dbraw/zinc/58/04/62/1133580462.db2.gz OTMBQXDEVIWDIE-VXGBXAGGSA-N 1 0 282.378 3.651 20 10 CHCDRO Cc1ccc(C[NH2+]C[C@H](c2ccccc2)C2CC2)c(O)c1 ZINC001205999080 1133639757 /nfs/dbraw/zinc/63/97/57/1133639757.db2.gz VBJFKIDSXPTWSB-GOSISDBHSA-N 1 0 281.399 3.984 20 10 CHCDRO CCc1cccc(C[NH2+]CC2(COC)CCCCC2)c1O ZINC001206108838 1133658213 /nfs/dbraw/zinc/65/82/13/1133658213.db2.gz KRMWPNBYGZNHFV-UHFFFAOYSA-N 1 0 291.435 3.641 20 10 CHCDRO COC[C@@H]1CCCC[N@@H+]1Cc1cc(C(C)C)ccc1O ZINC001206271511 1133680355 /nfs/dbraw/zinc/68/03/55/1133680355.db2.gz ZQHFKIROYAKYOV-INIZCTEOSA-N 1 0 277.408 3.517 20 10 CHCDRO Oc1cc(Cl)ccc1C[NH2+]C[C@@H]1CCC2(CCCC2)O1 ZINC001206490343 1133708746 /nfs/dbraw/zinc/70/87/46/1133708746.db2.gz MAJIVXBXKSRAAS-AWEZNQCLSA-N 1 0 295.810 3.627 20 10 CHCDRO CC(C)c1ccc(O)c(C[NH2+][C@@H]2C[C@H]2C(F)(F)F)c1 ZINC001207252415 1133782878 /nfs/dbraw/zinc/78/28/78/1133782878.db2.gz HQZNWTLSRAAURR-VXGBXAGGSA-N 1 0 273.298 3.556 20 10 CHCDRO Cc1ccc([C@@H](C)CC[N@@H+]2CCc3cccc(O)c3C2)o1 ZINC001208165851 1133893151 /nfs/dbraw/zinc/89/31/51/1133893151.db2.gz HFDHGCUQRCLRHV-ZDUSSCGKSA-N 1 0 285.387 3.846 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(C[N@@H+]2C[C@@H]3C[C@@H]3[C@H](F)C2)cc1 ZINC001209516204 1134032993 /nfs/dbraw/zinc/03/29/93/1134032993.db2.gz CPJUGMZBYUBPQS-YTQUADARSA-N 1 0 298.405 3.884 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(C[NH+]2CC(C(F)F)C2)cc1 ZINC001209519705 1134034060 /nfs/dbraw/zinc/03/40/60/1134034060.db2.gz GBFNKOLASSMWLD-UHFFFAOYSA-N 1 0 290.357 3.791 20 10 CHCDRO C[NH2+][C@H]1C[C@H](OC2=CC(=O)C=CC2=NNc2ccccc2)C1 ZINC001217954007 1135030313 /nfs/dbraw/zinc/03/03/13/1135030313.db2.gz MQGKLAIQZQHBBM-NZMCDHBQSA-N 1 0 297.358 3.937 20 10 CHCDRO Cc1ccccc1[C@H](C)Oc1ccc(N2CC[NH2+]CC2)cc1 ZINC001218295799 1135080886 /nfs/dbraw/zinc/08/08/86/1135080886.db2.gz OQXXINIUSIPLAF-INIZCTEOSA-N 1 0 296.414 3.545 20 10 CHCDRO C[C@@H]1[NH2+]C[C@H]1Oc1ccccc1NN=C1C=CC=CC1=O ZINC001218388355 1135097561 /nfs/dbraw/zinc/09/75/61/1135097561.db2.gz SDAIORATIJLINL-VTJSOYEQSA-N 1 0 283.331 3.547 20 10 CHCDRO C[C@H]([NH2+]CCc1cccc2cccnc21)c1ccccc1O ZINC000316948188 1135170668 /nfs/dbraw/zinc/17/06/68/1135170668.db2.gz BXOJCHBVBTXQGC-AWEZNQCLSA-N 1 0 292.382 3.834 20 10 CHCDRO C[C@@H]([NH2+]CC(C)(C)N(C)C)c1ccc2ccccc2c1O ZINC000020125767 171009064 /nfs/dbraw/zinc/00/90/64/171009064.db2.gz QVXLRLOZWGGLIP-CYBMUJFWSA-N 1 0 286.419 3.536 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2CCc3ccccc32)c1 ZINC000020129855 171018783 /nfs/dbraw/zinc/01/87/83/171018783.db2.gz MYPSNNIXSKSHCD-SJCJKPOMSA-N 1 0 283.371 3.739 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H](C)c2ccc(C)cc2O)c1 ZINC000020134479 171022675 /nfs/dbraw/zinc/02/26/75/171022675.db2.gz JHDGWGJQZPELAU-AWEZNQCLSA-N 1 0 255.361 3.860 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]C[C@H](C)c2ccccc2)c1 ZINC000020137303 171024359 /nfs/dbraw/zinc/02/43/59/171024359.db2.gz MEQXPZUOCXBGOY-KBPBESRZSA-N 1 0 285.387 3.855 20 10 CHCDRO C[C@@H]([NH2+]Cc1cccnc1)c1ccc2ccccc2c1O ZINC000020140784 171027586 /nfs/dbraw/zinc/02/75/86/171027586.db2.gz YJAVGXYYXPCKBV-CYBMUJFWSA-N 1 0 278.355 3.791 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2)s1 ZINC000020146119 171031632 /nfs/dbraw/zinc/03/16/32/171031632.db2.gz BGSQSTRLTWPAOM-ZDUSSCGKSA-N 1 0 274.433 3.973 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2)c(O)c1 ZINC000020146141 171031944 /nfs/dbraw/zinc/03/19/44/171031944.db2.gz ARAUMDVEEUJMAJ-AWEZNQCLSA-N 1 0 284.403 3.617 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cccc(F)c1 ZINC000020147750 171035198 /nfs/dbraw/zinc/03/51/98/171035198.db2.gz LYXSJJMRVPINHT-CYBMUJFWSA-N 1 0 272.367 3.743 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2cccc(F)c2)c1 ZINC000035628988 172308721 /nfs/dbraw/zinc/30/87/21/172308721.db2.gz NNPZKPAEJLTURX-LBPRGKRZSA-N 1 0 259.324 3.691 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2ccccc2Cl)c1 ZINC000071403866 176155196 /nfs/dbraw/zinc/15/51/96/176155196.db2.gz PMMVCURWGBBEJD-UHFFFAOYSA-N 1 0 261.752 3.644 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc(C)ccc1O)c1ccccc1 ZINC000071409103 176156648 /nfs/dbraw/zinc/15/66/48/176156648.db2.gz FMERCNGCENDTDP-MRXNPFEDSA-N 1 0 255.361 3.942 20 10 CHCDRO COc1cc[nH+]c(NCc2c(C)c3ccccc3n2C)c1 ZINC000352534797 227035374 /nfs/dbraw/zinc/03/53/74/227035374.db2.gz JGHQOJQOLRZBOI-UHFFFAOYSA-N 1 0 281.359 3.502 20 10 CHCDRO CCC[N@H+](Cc1cnc(C)s1)Cc1ccccc1O ZINC000075829103 260291933 /nfs/dbraw/zinc/29/19/33/260291933.db2.gz MFLRYBVPGHJFJL-UHFFFAOYSA-N 1 0 276.405 3.569 20 10 CHCDRO CC[C@@H]([NH2+][C@H](CC)c1ccccc1O)c1ccncc1 ZINC000156002644 261111280 /nfs/dbraw/zinc/11/12/80/261111280.db2.gz PPAGKJMBFCLIPT-HZPDHXFCSA-N 1 0 270.376 3.979 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(C)cc1OC)c1ccccc1O ZINC000156337161 261120515 /nfs/dbraw/zinc/12/05/15/261120515.db2.gz AEINYWRGINQKFB-INIZCTEOSA-N 1 0 285.387 3.950 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccc(Cl)nc1)c1ccccc1O ZINC000156356620 261120710 /nfs/dbraw/zinc/12/07/10/261120710.db2.gz YBPRIDHDCNXACH-CQSZACIVSA-N 1 0 290.794 3.724 20 10 CHCDRO COc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(N(C)C)cc1)CC2 ZINC000173228405 261158807 /nfs/dbraw/zinc/15/88/07/261158807.db2.gz IGZRXWSEIHUSNG-LJQANCHMSA-N 1 0 296.414 3.538 20 10 CHCDRO COc1cccc(C[N@@H+]2CCC[C@@H]2c2cccs2)c1O ZINC000162703326 261291507 /nfs/dbraw/zinc/29/15/07/261291507.db2.gz SNCCVICAGOQUOK-CYBMUJFWSA-N 1 0 289.400 3.799 20 10 CHCDRO CC[C@@H]([NH2+]CCCC(C)(C)CO)c1ccc(N(C)C)cc1 ZINC000163224506 261308804 /nfs/dbraw/zinc/30/88/04/261308804.db2.gz PUZDFYZYSZFLSM-QGZVFWFLSA-N 1 0 292.467 3.592 20 10 CHCDRO CCC[N@H+](Cc1c(C)onc1CC)Cc1ccccc1O ZINC000163378612 261314135 /nfs/dbraw/zinc/31/41/35/261314135.db2.gz ZSMNPZAIKILBDV-UHFFFAOYSA-N 1 0 288.391 3.663 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCC[C@H]2CCCCO2)c1 ZINC000183985283 262003934 /nfs/dbraw/zinc/00/39/34/262003934.db2.gz BHOFLUVAFSXAAA-LSDHHAIUSA-N 1 0 277.408 3.701 20 10 CHCDRO C[C@H]([NH2+]CCc1cccnc1)c1cc2c(cc1O)CCCC2 ZINC000184980499 262036093 /nfs/dbraw/zinc/03/60/93/262036093.db2.gz VSNJFBDTHULGPD-AWEZNQCLSA-N 1 0 296.414 3.559 20 10 CHCDRO CCc1nc([C@H](C)[NH2+][C@@H](C)c2cc(F)ccc2O)cs1 ZINC000185427159 262054225 /nfs/dbraw/zinc/05/42/25/262054225.db2.gz NRBKNZBDTTVXBA-UWVGGRQHSA-N 1 0 294.395 3.962 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)C1CCOCC1)c1cc(Cl)ccc1O ZINC000185782176 262070676 /nfs/dbraw/zinc/07/06/76/262070676.db2.gz QRNMFAKVDPLQTI-WDEREUQCSA-N 1 0 283.799 3.511 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)C1CCOCC1)c1cc(Cl)ccc1O ZINC000185782159 262070718 /nfs/dbraw/zinc/07/07/18/262070718.db2.gz QRNMFAKVDPLQTI-QWRGUYRKSA-N 1 0 283.799 3.511 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)[C@@H](c1ccccc1)N(C)C)c1ccccc1O ZINC000186319901 262089011 /nfs/dbraw/zinc/08/90/11/262089011.db2.gz AKYNZHLOOOEVAO-VCBZYWHSSA-N 1 0 298.430 3.734 20 10 CHCDRO C/C=C/C[C@H](CO)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000186519408 262096150 /nfs/dbraw/zinc/09/61/50/262096150.db2.gz QSZKQLBNYLOJNH-MXKYZYEVSA-N 1 0 285.387 3.523 20 10 CHCDRO Cc1ccc2c(c1C)OC[C@@H]2[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000297056646 263200314 /nfs/dbraw/zinc/20/03/14/263200314.db2.gz VTHZHXGSVLNAJL-CVEARBPZSA-N 1 0 295.382 3.720 20 10 CHCDRO Cc1cc([C@H]2CCC[N@@H+]2Cc2cc(C)c(C)cc2O)no1 ZINC000369991627 267281846 /nfs/dbraw/zinc/28/18/46/267281846.db2.gz TXPNRFLZIUSCMW-MRXNPFEDSA-N 1 0 286.375 3.643 20 10 CHCDRO C[C@@H]([NH2+]C[C@H](C)Oc1ccccc1F)c1ccccc1O ZINC000183534726 327820488 /nfs/dbraw/zinc/82/04/88/327820488.db2.gz XOEPOMDZRLNLRS-QWHCGFSZSA-N 1 0 289.350 3.649 20 10 CHCDRO C[C@H]([NH2+]CCC[C@H]1CCCCO1)c1ccc(N(C)C)cc1 ZINC000183992740 327823052 /nfs/dbraw/zinc/82/30/52/327823052.db2.gz LTCOOPPPHADYOX-MAUKXSAKSA-N 1 0 290.451 3.753 20 10 CHCDRO C[C@@H]([NH2+]CCC[C@@H]1CCCCO1)c1ccc(N(C)C)cc1 ZINC000183992724 327823201 /nfs/dbraw/zinc/82/32/01/327823201.db2.gz LTCOOPPPHADYOX-QAPCUYQASA-N 1 0 290.451 3.753 20 10 CHCDRO COc1ccc([C@H](C)[NH2+][C@@H](C)c2ccccc2O)cc1 ZINC000090339503 327094149 /nfs/dbraw/zinc/09/41/49/327094149.db2.gz MBTJCKHUELCVNA-STQMWFEESA-N 1 0 271.360 3.813 20 10 CHCDRO Oc1ccccc1C[NH2+]C1CC(c2cc(F)cc(F)c2)C1 ZINC000367318148 328890673 /nfs/dbraw/zinc/89/06/73/328890673.db2.gz PKAIWKQGBBSRMX-UHFFFAOYSA-N 1 0 289.325 3.706 20 10 CHCDRO C[C@H]1Oc2ccccc2[C@@H]1[NH2+]Cc1cc(Cl)ccc1O ZINC000377408004 329014318 /nfs/dbraw/zinc/01/43/18/329014318.db2.gz OHDFMOXIBNRVPJ-QLJPJBMISA-N 1 0 289.762 3.657 20 10 CHCDRO C[C@H]1C[C@H]([NH2+]CC2CC=CC2)c2c1c(F)ccc2O ZINC000527951658 330294405 /nfs/dbraw/zinc/29/44/05/330294405.db2.gz RJPQXFQEPAFKKM-GWCFXTLKSA-N 1 0 261.340 3.635 20 10 CHCDRO CC[C@H]([NH2+]CC[C@@H]1CCCOC1)c1cc(Cl)ccc1O ZINC000527923640 330296076 /nfs/dbraw/zinc/29/60/76/330296076.db2.gz DDBFKPMACOTNFV-WFASDCNBSA-N 1 0 297.826 3.903 20 10 CHCDRO COCCC1CC[NH+]([C@H](C)c2ccc(C)cc2O)CC1 ZINC000527935691 330297841 /nfs/dbraw/zinc/29/78/41/330297841.db2.gz OJWRNGFORXHKHZ-CQSZACIVSA-N 1 0 277.408 3.510 20 10 CHCDRO CC[C@H]([NH2+]CC[C@H]1CCCOC1)c1ccc(C)cc1O ZINC000527935767 330298035 /nfs/dbraw/zinc/29/80/35/330298035.db2.gz ZAMULROARGXSMU-ZBFHGGJFSA-N 1 0 277.408 3.558 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ncccc2F)c(O)c1C ZINC000528035046 330302431 /nfs/dbraw/zinc/30/24/31/330302431.db2.gz DJBXMIPAKOXOSH-OLZOCXBDSA-N 1 0 288.366 3.955 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1ncccc1F)c1ccccc1O ZINC000528036239 330302675 /nfs/dbraw/zinc/30/26/75/330302675.db2.gz QBQOZVYZEZLMGA-SMDDNHRTSA-N 1 0 274.339 3.728 20 10 CHCDRO CCC[C@@](C)(O)C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000230661812 333320161 /nfs/dbraw/zinc/32/01/61/333320161.db2.gz ZGBPQDYBECLOPU-SCLBCKFNSA-N 1 0 287.403 3.747 20 10 CHCDRO CC(F)(F)c1ccc(C[NH2+]Cc2ccccc2O)cc1 ZINC000292855557 520168660 /nfs/dbraw/zinc/16/86/60/520168660.db2.gz CDGGYRAYWJXKQB-UHFFFAOYSA-N 1 0 277.314 3.794 20 10 CHCDRO CCCOc1ccc(C[NH2+][C@H](C)c2ccc(C)o2)c(O)c1 ZINC000101589500 520375612 /nfs/dbraw/zinc/37/56/12/520375612.db2.gz BLPNXGWYDGHPDW-CYBMUJFWSA-N 1 0 289.375 3.933 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)cc1)[C@H]1CCOC(C)(C)C1 ZINC000289975680 521320377 /nfs/dbraw/zinc/32/03/77/521320377.db2.gz XHHXCZCJIWNQFV-KRWDZBQOSA-N 1 0 290.451 3.532 20 10 CHCDRO CCC[N@H+](Cc1nc(C)cs1)Cc1ccccc1O ZINC000088602563 521694055 /nfs/dbraw/zinc/69/40/55/521694055.db2.gz ASWCBBQSFHMKCK-UHFFFAOYSA-N 1 0 276.405 3.569 20 10 CHCDRO CN(C)c1ccc(C[NH2+]Cc2ccco2)c(C(F)(F)F)c1 ZINC000279907564 522208584 /nfs/dbraw/zinc/20/85/84/522208584.db2.gz LSOGJDQDZWPFPB-UHFFFAOYSA-N 1 0 298.308 3.654 20 10 CHCDRO CC[C@H]([NH2+]CCCCOC(C)C)c1ccccc1O ZINC000157957587 522579555 /nfs/dbraw/zinc/57/95/55/522579555.db2.gz DBKNCZAIXKNLFL-HNNXBMFYSA-N 1 0 265.397 3.638 20 10 CHCDRO CC[C@H]([NH2+]CCCc1nccs1)c1ccc(C)cc1O ZINC000280142183 522591460 /nfs/dbraw/zinc/59/14/60/522591460.db2.gz PRPYOVMPZOUGNV-AWEZNQCLSA-N 1 0 290.432 3.831 20 10 CHCDRO CC[C@H]([NH2+]CCc1csc(C)n1)c1ccc(C)cc1O ZINC000280156350 522603116 /nfs/dbraw/zinc/60/31/16/522603116.db2.gz QLICXBROCUJQNE-HNNXBMFYSA-N 1 0 290.432 3.749 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCO[C@@H](C)C1)c1ccc(C)cc1O ZINC000280299744 522617043 /nfs/dbraw/zinc/61/70/43/522617043.db2.gz ZUVUGYZEDHBEHZ-LZWOXQAQSA-N 1 0 277.408 3.556 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCO[C@H](C)C1)c1ccc(C)cc1O ZINC000280299740 522617701 /nfs/dbraw/zinc/61/77/01/522617701.db2.gz ZUVUGYZEDHBEHZ-FMKPAKJESA-N 1 0 277.408 3.556 20 10 CHCDRO CC[C@H]([NH2+]Cc1cccc2c1OCO2)c1ccc(C)cc1O ZINC000279945357 522655256 /nfs/dbraw/zinc/65/52/56/522655256.db2.gz BLNDAVHEXFSPCN-HNNXBMFYSA-N 1 0 299.370 3.670 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCC[C@@H]2OCC[C@H]21)c1ccc(C)cc1O ZINC000280036848 522712341 /nfs/dbraw/zinc/71/23/41/522712341.db2.gz IOLQICUMMHZGQI-CUSZFKRNSA-N 1 0 289.419 3.699 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCCC12CCOCC2)c1ccccc1O ZINC000282683797 522712790 /nfs/dbraw/zinc/71/27/90/522712790.db2.gz JVGGAMMVGBTEAE-DOTOQJQBSA-N 1 0 289.419 3.782 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)[C@H]1CCCCO1)c1ccc(C)cc1O ZINC000280276150 522736124 /nfs/dbraw/zinc/73/61/24/522736124.db2.gz YFHPSYOGWGQRQU-UKPHBRMFSA-N 1 0 277.408 3.699 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cn2ccc(C)cc2n1)c1ccccc1O ZINC000274912186 522889632 /nfs/dbraw/zinc/88/96/32/522889632.db2.gz NKXSPBJGQCMAAY-MRXNPFEDSA-N 1 0 295.386 3.589 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H]2CCCSC2)c(O)c1 ZINC000294008510 524333425 /nfs/dbraw/zinc/33/34/25/524333425.db2.gz DENOTHUTCZRINO-KBPBESRZSA-N 1 0 279.449 3.803 20 10 CHCDRO C[C@@H](CCO)CC[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000297411097 524503648 /nfs/dbraw/zinc/50/36/48/524503648.db2.gz UAZAZFQHMHOCTK-KGLIPLIRSA-N 1 0 287.403 3.605 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)s1 ZINC000050225294 524593170 /nfs/dbraw/zinc/59/31/70/524593170.db2.gz HZPYWKQLYMVLFJ-ZDUSSCGKSA-N 1 0 274.433 3.973 20 10 CHCDRO C[C@H](Cc1ccsc1)[NH2+][C@@H](C)c1ccccc1O ZINC000049154515 524764164 /nfs/dbraw/zinc/76/41/64/524764164.db2.gz BKRMWDVAUHISKD-NEPJUHHUSA-N 1 0 261.390 3.736 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(C)s2)c1 ZINC000050225148 524771402 /nfs/dbraw/zinc/77/14/02/524771402.db2.gz LCTIVRXSUJGLAL-NSHDSACASA-N 1 0 277.389 3.622 20 10 CHCDRO Cc1ccccc1C[NH2+][C@H](C)c1cc(F)ccc1O ZINC000094617624 525169112 /nfs/dbraw/zinc/16/91/12/525169112.db2.gz AILXRVSEAAQVPU-GFCCVEGCSA-N 1 0 259.324 3.691 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C2(c3ccccc3)CC2)cc1C ZINC000266187912 525318613 /nfs/dbraw/zinc/31/86/13/525318613.db2.gz HSLRTXDIKSBOAX-UHFFFAOYSA-N 1 0 267.372 3.788 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc3c(n2)CCCC3)c1 ZINC000278586904 525363345 /nfs/dbraw/zinc/36/33/45/525363345.db2.gz YPUFCZHRCMGIBC-CQSZACIVSA-N 1 0 296.414 3.825 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCCCO1)c1ccc2ccccc2c1O ZINC000042812030 525387854 /nfs/dbraw/zinc/38/78/54/525387854.db2.gz RRPOGFUDVOIKIR-ZFWWWQNUSA-N 1 0 285.387 3.765 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000122141299 525526487 /nfs/dbraw/zinc/52/64/87/525526487.db2.gz HQMARMHKMLTEDJ-CYBMUJFWSA-N 1 0 299.374 3.512 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccsc1 ZINC000061361746 525531450 /nfs/dbraw/zinc/53/14/50/525531450.db2.gz LQPYZRWTTYECPL-CYBMUJFWSA-N 1 0 286.444 3.981 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H](C)[C@@H](O)c2ccccc2)c(O)c1C ZINC000290176774 525940012 /nfs/dbraw/zinc/94/00/12/525940012.db2.gz FCTKBWJZTWBLCW-QMTMVMCOSA-N 1 0 299.414 3.782 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCCSC2)c(O)c1C ZINC000273552629 525946256 /nfs/dbraw/zinc/94/62/56/525946256.db2.gz GFDKZRBVQGVABX-STQMWFEESA-N 1 0 265.422 3.555 20 10 CHCDRO CC[C@H]([NH2+]CCCCSC)c1ccc(N(C)C)cc1 ZINC000133653160 1125482288 /nfs/dbraw/zinc/48/22/88/1125482288.db2.gz ZWLNVFZFQYIGAG-INIZCTEOSA-N 1 0 280.481 3.937 20 10 CHCDRO [O-]c1c(Br)cccc1C[N@@H+]1CCC2(CCC2)C1 ZINC000093455917 1120559152 /nfs/dbraw/zinc/55/91/52/1120559152.db2.gz RKEFZJCCUKBDMJ-UHFFFAOYSA-N 1 0 296.208 3.531 20 10 CHCDRO CC[C@@H]1CCC[N@@H+]1Cc1cc(Cl)cc(F)c1[O-] ZINC000775663644 1122874801 /nfs/dbraw/zinc/87/48/01/1122874801.db2.gz QEVWMWYYIBELTB-LLVKDONJSA-N 1 0 257.736 3.559 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2C[C@@H](C)S[C@@H](C)C2)c1O ZINC000775664276 1122877204 /nfs/dbraw/zinc/87/72/04/1122877204.db2.gz JWCWWVNNGDDERM-PHIMTYICSA-N 1 0 285.840 3.680 20 10 CHCDRO Oc1cc(Br)ccc1C[N@@H+]1CCCC2(CC2)C1 ZINC000825537279 1123219597 /nfs/dbraw/zinc/21/95/97/1123219597.db2.gz UGVFYAJFYLRJPQ-UHFFFAOYSA-N 1 0 296.208 3.531 20 10 CHCDRO Cc1ncc([C@@H](C)[NH2+][C@@H](C)c2ccccc2O)s1 ZINC000866455425 1124067734 /nfs/dbraw/zinc/06/77/34/1124067734.db2.gz LKTDKVKWHKGXKL-VHSXEESVSA-N 1 0 262.378 3.569 20 10 CHCDRO Oc1cc(Cl)ccc1C[N@@H+]1CC[C@@H]2CCC[C@@H]2C1 ZINC001140462206 1131748823 /nfs/dbraw/zinc/74/88/23/1131748823.db2.gz AKDOIHLNVAPKHL-NWDGAFQWSA-N 1 0 265.784 3.668 20 10 CHCDRO C[C@@H]1CCCC[N@@H+]1Cc1ccc(C(F)(F)F)cc1O ZINC001233451279 1132624693 /nfs/dbraw/zinc/62/46/93/1132624693.db2.gz DXUHNSWBYDVYPG-SNVBAGLBSA-N 1 0 273.298 3.785 20 10 CHCDRO CCC(C)(C)[N@H+](C)C/C=C\c1ccc(N(C)C)cc1 ZINC001205634761 1133597559 /nfs/dbraw/zinc/59/75/59/1133597559.db2.gz ZELJLZSVWUCFMZ-HJWRWDBZSA-N 1 0 260.425 3.886 20 10 CHCDRO CCOc1cccc(C[NH+]2CCC3(CCCC3)CC2)c1O ZINC000133995713 1125517144 /nfs/dbraw/zinc/51/71/44/1125517144.db2.gz LGWRWDIVDLGXAY-UHFFFAOYSA-N 1 0 289.419 3.947 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)c2ccc(Cl)cc2O)cn1 ZINC000841746306 1125570958 /nfs/dbraw/zinc/57/09/58/1125570958.db2.gz YFVCZMMXQOMQAQ-LLVKDONJSA-N 1 0 276.767 3.600 20 10 CHCDRO C[C@@H]1C[C@H](C)C[N@H+]1Cc1c(O)ccc2ccccc21 ZINC000134957864 1125571452 /nfs/dbraw/zinc/57/14/52/1125571452.db2.gz UZIDCXPKQQTGEZ-QWHCGFSZSA-N 1 0 255.361 3.776 20 10 CHCDRO CCC(C)(C)OCC[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841757643 1125596611 /nfs/dbraw/zinc/59/66/11/1125596611.db2.gz OEPOVWNBPJXOLK-LLVKDONJSA-N 1 0 285.815 3.901 20 10 CHCDRO CCC[N@H+](Cc1cccc(COC)c1)Cc1ccccc1O ZINC000179225186 1125699473 /nfs/dbraw/zinc/69/94/73/1125699473.db2.gz PIJRSIXJOMGTHO-UHFFFAOYSA-N 1 0 299.414 3.951 20 10 CHCDRO CCOCCC1(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)CC1 ZINC000090722851 1125745678 /nfs/dbraw/zinc/74/56/78/1125745678.db2.gz IEOJUDOJUCCYBD-OAHLLOKOSA-N 1 0 290.451 3.610 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCCSC1)c1ccccc1O ZINC000286963308 1125756096 /nfs/dbraw/zinc/75/60/96/1125756096.db2.gz IBPYJIUOBXAPQB-OCCSQVGLSA-N 1 0 265.422 3.576 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCCSC1)c1ccccc1O ZINC000286963305 1125756216 /nfs/dbraw/zinc/75/62/16/1125756216.db2.gz IBPYJIUOBXAPQB-JSGCOSHPSA-N 1 0 265.422 3.576 20 10 CHCDRO CCC[N@H+](Cc1cc2c(cc1O)CCCC2)C1CC1 ZINC000768451339 1129857691 /nfs/dbraw/zinc/85/76/91/1129857691.db2.gz MVONVTLDSLWNNG-UHFFFAOYSA-N 1 0 259.393 3.645 20 10 CHCDRO CCOc1ccc(C)c(C[N@@H+]2CCc3cccc(O)c3C2)c1 ZINC001238715269 1131236586 /nfs/dbraw/zinc/23/65/86/1131236586.db2.gz XJQOINWCIWYGKM-UHFFFAOYSA-N 1 0 297.398 3.658 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+][C@@H](C2CC2)C2CCC2)c1O ZINC000324994617 1129205950 /nfs/dbraw/zinc/20/59/50/1129205950.db2.gz XOSVKXXAEUJUBH-OAHLLOKOSA-N 1 0 295.810 3.723 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C(C)C)C(C)(C)O)c1cc(Cl)ccc1O ZINC000790702049 1130326796 /nfs/dbraw/zinc/32/67/96/1130326796.db2.gz PYTAELOBBIKBDS-HIFRSBDPSA-N 1 0 299.842 3.882 20 10 CHCDRO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1cccc(C)c1O ZINC000158107224 1126746750 /nfs/dbraw/zinc/74/67/50/1126746750.db2.gz ZZSSFHHEILGMMJ-LBPRGKRZSA-N 1 0 289.350 3.699 20 10 CHCDRO CC[C@@](C)([NH2+]Cc1cc(C)c(C)cc1O)c1nccs1 ZINC000174419931 1126770245 /nfs/dbraw/zinc/77/02/45/1126770245.db2.gz QBHWNTCFCCUPDH-MRXNPFEDSA-N 1 0 290.432 3.881 20 10 CHCDRO CC[C@](C)([NH2+]Cc1cc(C)ccc1O)c1nc(C)cs1 ZINC000174505897 1126770771 /nfs/dbraw/zinc/77/07/71/1126770771.db2.gz PDZUEPJJYIBXPC-INIZCTEOSA-N 1 0 290.432 3.881 20 10 CHCDRO COc1ccc(O)c(C[N@H+](C)[C@@H](C)c2ccccc2)c1 ZINC000179596741 1126830475 /nfs/dbraw/zinc/83/04/75/1126830475.db2.gz NDFPWGQXLARNOA-ZDUSSCGKSA-N 1 0 271.360 3.594 20 10 CHCDRO COc1ccc(O)c(C[N@H+]([C@H](C)c2ccco2)C2CC2)c1 ZINC000179850027 1126836178 /nfs/dbraw/zinc/83/61/78/1126836178.db2.gz UNKJANJHRRVGHY-GFCCVEGCSA-N 1 0 287.359 3.719 20 10 CHCDRO Cc1ncsc1C[N@@H+](C)Cc1cc(Cl)cc(C)c1O ZINC000180038907 1126838753 /nfs/dbraw/zinc/83/87/53/1126838753.db2.gz BLZFKDBMHJQWDI-UHFFFAOYSA-N 1 0 296.823 3.751 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(OC)c(F)c1)c1ccccc1O ZINC000183316624 1126884777 /nfs/dbraw/zinc/88/47/77/1126884777.db2.gz RIZXEYJCSLORBM-HNNXBMFYSA-N 1 0 289.350 3.781 20 10 CHCDRO C[C@H]([NH2+][C@@H](CCCO)c1ccccc1)c1ccccc1O ZINC000183527354 1126888826 /nfs/dbraw/zinc/88/88/26/1126888826.db2.gz IAMRWERTWKTRCU-YOEHRIQHSA-N 1 0 285.387 3.557 20 10 CHCDRO C[C@@H]([NH2+]CC1([C@@H](O)c2ccccc2)CC1)c1ccccc1O ZINC000183627089 1126889196 /nfs/dbraw/zinc/88/91/96/1126889196.db2.gz RAOMHBXYKJKIHI-KDOFPFPSSA-N 1 0 297.398 3.557 20 10 CHCDRO C[C@@H]([NH2+]C1(c2cccc(F)c2)CC1)c1ccccc1O ZINC000183660805 1126889921 /nfs/dbraw/zinc/88/99/21/1126889921.db2.gz MTCJETSIDVVACB-GFCCVEGCSA-N 1 0 271.335 3.871 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCCCF)cc1 ZINC000812737347 1130709989 /nfs/dbraw/zinc/70/99/89/1130709989.db2.gz URZXHSRUDFAWNV-CYBMUJFWSA-N 1 0 252.377 3.543 20 10 CHCDRO COc1ccc(F)cc1C[NH2+][C@H](C)c1cc(C)ccc1O ZINC000187591429 1126911904 /nfs/dbraw/zinc/91/19/04/1126911904.db2.gz SJAUBERXOOKOIP-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CCC[C@H]3CCC[C@H]32)c1 ZINC000245565701 1129211906 /nfs/dbraw/zinc/21/19/06/1129211906.db2.gz SAQDSZMRMKUTLL-CZUORRHYSA-N 1 0 275.392 3.555 20 10 CHCDRO CC(C)(C)c1ccc(C[N@@H+]2CCC[C@@H](F)C2)c(O)c1 ZINC001235681668 1130767004 /nfs/dbraw/zinc/76/70/04/1130767004.db2.gz BXYCAHBMEHRQFM-CQSZACIVSA-N 1 0 265.372 3.624 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H]2CCCc3c(O)cccc32)cc1 ZINC000191656042 1126953350 /nfs/dbraw/zinc/95/33/50/1126953350.db2.gz MMXDJFMMKXNMAB-SFHVURJKSA-N 1 0 296.414 3.625 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1cncs1 ZINC000268786728 1127023775 /nfs/dbraw/zinc/02/37/75/1127023775.db2.gz BOXHIUHPCKGFKO-ZDUSSCGKSA-N 1 0 287.432 3.594 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(Cl)o2)c(O)c1 ZINC000698074713 1127037675 /nfs/dbraw/zinc/03/76/75/1127037675.db2.gz MMMNAROIGKLFMW-JTQLQIEISA-N 1 0 265.740 3.798 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)cc1)[C@H](C)c1cccnc1 ZINC000269334555 1127037996 /nfs/dbraw/zinc/03/79/96/1127037996.db2.gz AZZMWZAJASPKRI-OAHLLOKOSA-N 1 0 283.419 3.731 20 10 CHCDRO Cc1ccncc1[C@H](C)[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000271332751 1127076080 /nfs/dbraw/zinc/07/60/80/1127076080.db2.gz BGUFICYXPMPRMB-HNNXBMFYSA-N 1 0 295.430 3.623 20 10 CHCDRO Cc1nc(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)cs1 ZINC000815561303 1130999826 /nfs/dbraw/zinc/99/98/26/1130999826.db2.gz DAZWVMFWTUDMAN-LLVKDONJSA-N 1 0 276.405 3.625 20 10 CHCDRO c1csc(S[C@@H]2CC[N@@H+](Cc3ccccc3)C2)n1 ZINC000283109454 1127122419 /nfs/dbraw/zinc/12/24/19/1127122419.db2.gz RTULAASIFJEUJK-CYBMUJFWSA-N 1 0 276.430 3.510 20 10 CHCDRO C[C@H]1CCC[N@H+](Cc2cc(C(F)(F)F)ccc2O)C1 ZINC001237137107 1131056757 /nfs/dbraw/zinc/05/67/57/1131056757.db2.gz MCCQFMHAFLDERK-JTQLQIEISA-N 1 0 273.298 3.643 20 10 CHCDRO C[N@H+](Cc1c(O)cccc1OC(F)(F)F)C1CCCC1 ZINC001237122720 1131056039 /nfs/dbraw/zinc/05/60/39/1131056039.db2.gz LDDMNTPSZYYEOR-UHFFFAOYSA-N 1 0 289.297 3.665 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@H+](C)Cc2ccc(Cl)nc2)c1 ZINC000163895730 1127147312 /nfs/dbraw/zinc/14/73/12/1127147312.db2.gz IHSBUXDQMXASOK-UHFFFAOYSA-N 1 0 290.794 3.689 20 10 CHCDRO CC[C@@H]([NH2+]CCSC(C)(C)C)c1ccccc1O ZINC000156474882 1127157884 /nfs/dbraw/zinc/15/78/84/1127157884.db2.gz WUOQTKMSXBUIJD-CYBMUJFWSA-N 1 0 267.438 3.965 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](C)Oc1ccccc1)c1ccccc1O ZINC000156588660 1127160171 /nfs/dbraw/zinc/16/01/71/1127160171.db2.gz RSSOXHWJIAWPHC-WMLDXEAASA-N 1 0 285.387 3.900 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@H+](C)CCc2cccs2)c1 ZINC000164421281 1127164144 /nfs/dbraw/zinc/16/41/44/1127164144.db2.gz SYHBSCJURAIDID-UHFFFAOYSA-N 1 0 275.417 3.745 20 10 CHCDRO CC1(C)C[N@H+](Cc2cc(Cl)c(F)cc2[O-])CCS1 ZINC000816513676 1131103763 /nfs/dbraw/zinc/10/37/63/1131103763.db2.gz YQERUJNHJNNDBV-UHFFFAOYSA-N 1 0 289.803 3.512 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccc([C@H](C)O)cc2)c(O)c1 ZINC000284295391 1127179936 /nfs/dbraw/zinc/17/99/36/1127179936.db2.gz YGQXBPGZRWNLOF-CABCVRRESA-N 1 0 299.414 3.913 20 10 CHCDRO C[C@H]1C[N@H+](Cc2ccc(N(C)C)cc2C(F)(F)F)[C@H]1C ZINC000816647952 1131120797 /nfs/dbraw/zinc/12/07/97/1131120797.db2.gz BEFTYIXJOBLPFP-QWRGUYRKSA-N 1 0 286.341 3.612 20 10 CHCDRO Cc1noc(C)c1C(C)(C)[NH2+]Cc1cc(C)c(C)cc1O ZINC000285398754 1127225815 /nfs/dbraw/zinc/22/58/15/1127225815.db2.gz DUJXLFZUMAXIHY-UHFFFAOYSA-N 1 0 288.391 3.639 20 10 CHCDRO CC[C@@H]1CC[C@H]1[NH2+]Cc1c(C)c2ccccc2n1C ZINC000572790623 1127226744 /nfs/dbraw/zinc/22/67/44/1127226744.db2.gz GSMAOXKOUAESRK-UKRRQHHQSA-N 1 0 256.393 3.765 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CC=CCC1)c1ccc(N(C)C)cc1 ZINC000045629133 1127260975 /nfs/dbraw/zinc/26/09/75/1127260975.db2.gz SUFXUJIXKODHGF-HUUCEWRRSA-N 1 0 258.409 3.760 20 10 CHCDRO CO[C@@H]1CCC[C@H]1[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000224422524 1127261818 /nfs/dbraw/zinc/26/18/18/1127261818.db2.gz UHDXPESHTYVRSP-JCURWCKSSA-N 1 0 285.387 3.764 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCOC[C@@H]1C)c1ccc2ccccc2c1O ZINC000287373487 1127302455 /nfs/dbraw/zinc/30/24/55/1127302455.db2.gz HYDATGNFFWOVES-DZKIICNBSA-N 1 0 299.414 3.869 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCOC[C@@H]1C)c1ccc2ccccc2c1O ZINC000287373499 1127302780 /nfs/dbraw/zinc/30/27/80/1127302780.db2.gz HYDATGNFFWOVES-OFQRWUPVSA-N 1 0 299.414 3.869 20 10 CHCDRO CC(C)CC[C@H]([NH2+]CCc1ccc(N)cc1)C1CC1 ZINC000817957191 1131190907 /nfs/dbraw/zinc/19/09/07/1131190907.db2.gz KCKGQZTYYPYWRQ-KRWDZBQOSA-N 1 0 260.425 3.616 20 10 CHCDRO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccccc1O)CCC2 ZINC000288381601 1127335471 /nfs/dbraw/zinc/33/54/71/1127335471.db2.gz GDMVMRPMTTXKHK-KRWDZBQOSA-N 1 0 267.372 3.868 20 10 CHCDRO Cc1ccccc1C[C@@H](C)[NH2+]Cc1cc(F)ccc1O ZINC000226585339 1127412321 /nfs/dbraw/zinc/41/23/21/1127412321.db2.gz ZDEOERZXCVYJRK-CYBMUJFWSA-N 1 0 273.351 3.561 20 10 CHCDRO Cc1ccc(C[C@@H](C)[NH2+]Cc2cc(F)ccc2O)s1 ZINC000226610760 1127412362 /nfs/dbraw/zinc/41/23/62/1127412362.db2.gz HFVODYCAPLRPRM-SNVBAGLBSA-N 1 0 279.380 3.622 20 10 CHCDRO C[C@@H]([NH2+]C[C@@]1(N(C)C)CCC[C@@H](C)C1)c1ccccc1O ZINC000226701109 1127417499 /nfs/dbraw/zinc/41/74/99/1127417499.db2.gz ZTCUJHPARCIRBN-IIDMSEBBSA-N 1 0 290.451 3.553 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCCCS1)c1ccc(N(C)C)cc1 ZINC000158084683 1127437015 /nfs/dbraw/zinc/43/70/15/1127437015.db2.gz OKERBGOTDFEXOR-CZUORRHYSA-N 1 0 278.465 3.689 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCCCC[NH+]2CCCC2)c(O)c1 ZINC000293649610 1127510510 /nfs/dbraw/zinc/51/05/10/1127510510.db2.gz HTLFUFSRWOWGNS-INIZCTEOSA-N 1 0 290.451 3.617 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCC[C@@H]3CCC[C@H]32)c1O ZINC000228173045 1127535938 /nfs/dbraw/zinc/53/59/38/1127535938.db2.gz HBAIIESLPVJOEN-DZGCQCFKSA-N 1 0 275.392 3.555 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2CC[C@@H](C)C[C@H]2C)cc1Cl ZINC001231870794 1127544515 /nfs/dbraw/zinc/54/45/15/1127544515.db2.gz UFQOUVPCTDFWLR-ZYHUDNBSSA-N 1 0 267.800 3.974 20 10 CHCDRO COc1cc(Cl)cc(C[N@H+](C)[C@@H](C)C(C)(C)C)c1O ZINC000228627015 1127576290 /nfs/dbraw/zinc/57/62/90/1127576290.db2.gz NTNZMYICGNEYAQ-JTQLQIEISA-N 1 0 285.815 3.921 20 10 CHCDRO CC(C)Oc1ccc(C[NH2+][C@@H]2CCc3cccc(O)c32)cc1 ZINC000296004056 1127660512 /nfs/dbraw/zinc/66/05/12/1127660512.db2.gz OLBCVSGYGDMGMF-QGZVFWFLSA-N 1 0 297.398 3.957 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CCc2cccc(O)c21)c1ccncc1 ZINC000296241925 1127666338 /nfs/dbraw/zinc/66/63/38/1127666338.db2.gz ATYCAGRNHNKLMQ-CABCVRRESA-N 1 0 268.360 3.515 20 10 CHCDRO Cc1ncsc1CC[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000296636746 1127679219 /nfs/dbraw/zinc/67/92/19/1127679219.db2.gz XUSVCAWQYIGGFC-ZDUSSCGKSA-N 1 0 290.432 3.667 20 10 CHCDRO Cc1ccc2c(c1)CC[C@@H]2[NH2+][C@H]1CCc2cccc(O)c21 ZINC000297606069 1127701633 /nfs/dbraw/zinc/70/16/33/1127701633.db2.gz IFVFAMAJBSURON-IRXDYDNUSA-N 1 0 279.383 3.965 20 10 CHCDRO Cc1ccc2c(c1)CC[C@H]2[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000297606064 1127701825 /nfs/dbraw/zinc/70/18/25/1127701825.db2.gz IFVFAMAJBSURON-IAGOWNOFSA-N 1 0 279.383 3.965 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@H]1CCCOc3ccccc31)CC2 ZINC000297728172 1127705762 /nfs/dbraw/zinc/70/57/62/1127705762.db2.gz NMWDDQPQDXLONA-JKSUJKDBSA-N 1 0 295.382 3.883 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCCc2cn[nH]c21)c1ccc(C)cc1O ZINC000373559707 1127848854 /nfs/dbraw/zinc/84/88/54/1127848854.db2.gz CPXRPEVAYCWMQT-LSDHHAIUSA-N 1 0 285.391 3.542 20 10 CHCDRO CC[C@H]([NH2+]CCC1CC1)c1cc(Br)ccc1O ZINC000088454372 1127937579 /nfs/dbraw/zinc/93/75/79/1127937579.db2.gz SUDGEWHFQXGHNY-ZDUSSCGKSA-N 1 0 298.224 3.996 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCSCC(F)(F)F)c(O)c1 ZINC000698951994 1128069081 /nfs/dbraw/zinc/06/90/81/1128069081.db2.gz FQFNPQGVFAGWHA-SNVBAGLBSA-N 1 0 293.354 3.647 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)C1CC1)c1cc(Br)ccc1O ZINC000134911236 1128115302 /nfs/dbraw/zinc/11/53/02/1128115302.db2.gz ODLPJSHVCBVSKT-IUCAKERBSA-N 1 0 284.197 3.604 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2ccccc2OCC2CC2)c1 ZINC000152751628 1128149963 /nfs/dbraw/zinc/14/99/63/1128149963.db2.gz HUPNDRJIDLRXAK-UHFFFAOYSA-N 1 0 297.398 3.779 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(CF)cc2)c1 ZINC000777721416 1128254618 /nfs/dbraw/zinc/25/46/18/1128254618.db2.gz MDQBOHCMBAOBRU-LBPRGKRZSA-N 1 0 289.350 3.721 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCS[C@H](C)C1)c1ccc(N(C)C)cc1 ZINC000927032452 1128209444 /nfs/dbraw/zinc/20/94/44/1128209444.db2.gz NLAZLYOFNDIQOI-VNHYZAJKSA-N 1 0 278.465 3.687 20 10 CHCDRO CC[C@H]([NH2+]Cc1cccc2c1OCC2)c1ccccc1O ZINC000927091463 1128216571 /nfs/dbraw/zinc/21/65/71/1128216571.db2.gz PKWITHSXBDTDAN-INIZCTEOSA-N 1 0 283.371 3.568 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CC[C@H]2CCC3(CCC3)O2)c1 ZINC000927127199 1128220605 /nfs/dbraw/zinc/22/06/05/1128220605.db2.gz GKIJNRFDEBXIGL-LSDHHAIUSA-N 1 0 289.419 3.843 20 10 CHCDRO CCc1onc(C)c1C[NH2+][C@H](CC)c1ccc(C)cc1O ZINC000927133156 1128220615 /nfs/dbraw/zinc/22/06/15/1128220615.db2.gz AGIXYSBVIQDHQV-OAHLLOKOSA-N 1 0 288.391 3.800 20 10 CHCDRO COc1cc(C)cc(C[N@@H+]2CCc3cccc(C)c3C2)c1O ZINC000762087446 1128268147 /nfs/dbraw/zinc/26/81/47/1128268147.db2.gz PGZQLWWTNPIJMD-UHFFFAOYSA-N 1 0 297.398 3.576 20 10 CHCDRO CC(C)[N@@H+](Cc1cc2c(cc1O)CCC2)CC1CC1 ZINC000915209462 1128292111 /nfs/dbraw/zinc/29/21/11/1128292111.db2.gz XDCMMMLQKFVLTC-UHFFFAOYSA-N 1 0 259.393 3.501 20 10 CHCDRO C[C@@H]([NH2+]C1Cc2ccccc2C1)c1cc(Cl)ccc1O ZINC000762784777 1128318257 /nfs/dbraw/zinc/31/82/57/1128318257.db2.gz ZEGWSGPJWNSRMZ-LLVKDONJSA-N 1 0 287.790 3.864 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCc2ccccc2)c1 ZINC000035628639 1128319840 /nfs/dbraw/zinc/31/98/40/1128319840.db2.gz JCGRAVMKQOIGAP-CQSZACIVSA-N 1 0 255.361 3.594 20 10 CHCDRO C[C@@H]([NH2+][C@H](C1CC1)C1CCC1)c1cc(F)ccc1O ZINC000324606570 1128390040 /nfs/dbraw/zinc/39/00/40/1128390040.db2.gz BJRZXUUFPGHJAE-HWPZZCPQSA-N 1 0 263.356 3.761 20 10 CHCDRO Cc1cc(C[NH2+]C2CCOCC2)c(C)n1-c1cccc(C)c1 ZINC000916838231 1128456957 /nfs/dbraw/zinc/45/69/57/1128456957.db2.gz DMUUIJIMOJOFMR-UHFFFAOYSA-N 1 0 298.430 3.671 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@@H+](C)Cc2ccc(N(C)C)cc2)c1 ZINC000918066639 1128533022 /nfs/dbraw/zinc/53/30/22/1128533022.db2.gz HKIOPNXQAYNLPK-UHFFFAOYSA-N 1 0 298.430 3.707 20 10 CHCDRO CCCC(O)(CCC)C[NH2+][C@@H](CC)c1ccccc1O ZINC000155923152 1128619019 /nfs/dbraw/zinc/61/90/19/1128619019.db2.gz FAQMOUOZAOWWAS-HNNXBMFYSA-N 1 0 279.424 3.764 20 10 CHCDRO C[C@H]1c2ccsc2CC[N@H+]1Cc1cc(F)ccc1O ZINC000778995534 1128674419 /nfs/dbraw/zinc/67/44/19/1128674419.db2.gz ZBNLVSWCSSGRQI-JTQLQIEISA-N 1 0 277.364 3.712 20 10 CHCDRO COCC[N@H+](Cc1ccc(C)cc1C)Cc1ccccc1O ZINC000778996560 1128675834 /nfs/dbraw/zinc/67/58/34/1128675834.db2.gz QHJDGKPJIFXLNT-UHFFFAOYSA-N 1 0 299.414 3.658 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CC[C@H](c2ccc(F)cc2)C1 ZINC000779014952 1128679510 /nfs/dbraw/zinc/67/95/10/1128679510.db2.gz MMJKWKSVMJBVHO-ZDUSSCGKSA-N 1 0 289.325 3.660 20 10 CHCDRO CCC1CCC([NH2+]Cc2ccc3c(c2)CCO3)CC1 ZINC000048400339 1128706796 /nfs/dbraw/zinc/70/67/96/1128706796.db2.gz AGZNXYFROKFNIX-UHFFFAOYSA-N 1 0 259.393 3.680 20 10 CHCDRO Cc1ccc2c(c1)[C@H]([NH2+]Cc1cc(F)ccc1O)CC2 ZINC000779075173 1128718593 /nfs/dbraw/zinc/71/85/93/1128718593.db2.gz XSAWJMNWKRYLDT-MRXNPFEDSA-N 1 0 271.335 3.617 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC(C)(C)O2)c(O)c1C ZINC000779079006 1128721485 /nfs/dbraw/zinc/72/14/85/1128721485.db2.gz JSINORCWXMYQMB-KGLIPLIRSA-N 1 0 277.408 3.617 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)n1 ZINC000185086048 1117761206 /nfs/dbraw/zinc/76/12/06/1117761206.db2.gz ZVSDLQAJQWSVQV-AWEZNQCLSA-N 1 0 296.414 3.825 20 10 CHCDRO COc1ccc(CCC[NH2+][C@@H](C)c2ccc(C)cc2O)cc1 ZINC000185095103 1117761289 /nfs/dbraw/zinc/76/12/89/1117761289.db2.gz IMFNRCKGZCEEPK-HNNXBMFYSA-N 1 0 299.414 3.993 20 10 CHCDRO Oc1ccccc1C[NH2+]C1(Cc2cccc(F)c2)CCC1 ZINC000185230846 1117793844 /nfs/dbraw/zinc/79/38/44/1117793844.db2.gz CDKVNMFPCZYUCA-UHFFFAOYSA-N 1 0 285.362 3.786 20 10 CHCDRO Cc1nc(C)c(CC[NH2+][C@@H](C)c2cc(C)ccc2O)s1 ZINC000185402640 1117820027 /nfs/dbraw/zinc/82/00/27/1117820027.db2.gz JJKUTIKFGACUQU-NSHDSACASA-N 1 0 290.432 3.667 20 10 CHCDRO CCCC[C@H](COC)[NH2+][C@H](C)c1ccc(C)cc1O ZINC000185494684 1117829769 /nfs/dbraw/zinc/82/97/69/1117829769.db2.gz ZYCGQRNFRUQWIF-ZIAGYGMSSA-N 1 0 265.397 3.556 20 10 CHCDRO CCCC(O)(CCC)C[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000185500975 1117830099 /nfs/dbraw/zinc/83/00/99/1117830099.db2.gz STTMIQMIOINKBN-LBPRGKRZSA-N 1 0 283.387 3.513 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@](C)(O)CCC(C)C)c(O)c1 ZINC000185528137 1117838029 /nfs/dbraw/zinc/83/80/29/1117838029.db2.gz JCAVJRGASMXXER-PBHICJAKSA-N 1 0 279.424 3.538 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCOCc2ccccc2)c1 ZINC000185633040 1117860826 /nfs/dbraw/zinc/86/08/26/1117860826.db2.gz GIHFGBWIKFVDGM-OAHLLOKOSA-N 1 0 285.387 3.568 20 10 CHCDRO Oc1ccc2ccncc2c1C[N@@H+]1CCC[C@@H]1C1CCC1 ZINC000728196649 1117868775 /nfs/dbraw/zinc/86/87/75/1117868775.db2.gz OIGBARGTYUSALY-QGZVFWFLSA-N 1 0 282.387 3.705 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](C)Oc2ccccc2)c(O)c1 ZINC000186041056 1117974703 /nfs/dbraw/zinc/97/47/03/1117974703.db2.gz JJJJHWJPLZTNNC-CABCVRRESA-N 1 0 285.387 3.819 20 10 CHCDRO C[C@@H]1c2ccccc2CC[N@H+]1Cc1ccccc1O ZINC000179581743 1128748959 /nfs/dbraw/zinc/74/89/59/1128748959.db2.gz JSVGXGLRVLKIJL-CYBMUJFWSA-N 1 0 253.345 3.512 20 10 CHCDRO Cc1cccc(C[N@H+]2CC=C(c3ccc(O)cc3)CC2)c1O ZINC000179631050 1128750328 /nfs/dbraw/zinc/75/03/28/1128750328.db2.gz JLISGCVEWROTOW-UHFFFAOYSA-N 1 0 295.382 3.696 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CCCOCC(C)C)cc1 ZINC000764686334 1118107369 /nfs/dbraw/zinc/10/73/69/1118107369.db2.gz GYNDXPFUJVCEGI-INIZCTEOSA-N 1 0 292.467 3.856 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]C(C2CC2)C2CC2)cc1 ZINC000765346620 1118145885 /nfs/dbraw/zinc/14/58/85/1118145885.db2.gz DASGYXWJRIGVEJ-CYBMUJFWSA-N 1 0 272.436 3.982 20 10 CHCDRO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)CC2 ZINC000765474849 1118154110 /nfs/dbraw/zinc/15/41/10/1118154110.db2.gz QHJTXAUSBLZLDH-SFHVURJKSA-N 1 0 298.405 3.977 20 10 CHCDRO Cc1ccc(C[N@@H+](Cc2ccc(N(C)C)cc2)C(C)C)cn1 ZINC000765575634 1118174527 /nfs/dbraw/zinc/17/45/27/1118174527.db2.gz CBVMBNLVOYQMMZ-UHFFFAOYSA-N 1 0 297.446 3.867 20 10 CHCDRO Clc1ccc2c(c1)C[C@H]([NH2+]Cc1ccc3c(c1)CCO3)C2 ZINC000765610457 1118182302 /nfs/dbraw/zinc/18/23/02/1118182302.db2.gz VDTKQNTVXSCIHY-QGZVFWFLSA-N 1 0 299.801 3.532 20 10 CHCDRO COc1cnccc1[C@H](C)[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000188784416 1128765416 /nfs/dbraw/zinc/76/54/16/1128765416.db2.gz FZOPBZKCVNAPFZ-KGLIPLIRSA-N 1 0 299.418 3.568 20 10 CHCDRO CCOC(C)(C)C[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000188687650 1128763912 /nfs/dbraw/zinc/76/39/12/1128763912.db2.gz RBAHVGJNDFHQMS-ZDUSSCGKSA-N 1 0 291.435 3.737 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2CSc3ccccc32)cc1 ZINC000083748775 1118359303 /nfs/dbraw/zinc/35/93/03/1118359303.db2.gz SKOBPGMNTAZTCC-MRXNPFEDSA-N 1 0 284.428 3.689 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2ccc(N3CCCCC3)cc2)o1 ZINC000049949235 1118385129 /nfs/dbraw/zinc/38/51/29/1118385129.db2.gz QNWMSRLIVUVDPJ-UHFFFAOYSA-N 1 0 284.403 3.868 20 10 CHCDRO CC1(C2([NH2+]Cc3ccc(N4CCCC4)cc3)CC2)CC1 ZINC000398248996 1118507872 /nfs/dbraw/zinc/50/78/72/1118507872.db2.gz KVZUXMZDVWRWPO-UHFFFAOYSA-N 1 0 270.420 3.709 20 10 CHCDRO CCc1ccc(C[NH2+][C@H]2CCc3cccc(O)c32)s1 ZINC000295826740 1118548807 /nfs/dbraw/zinc/54/88/07/1118548807.db2.gz DSSKZJSYICRQIX-AWEZNQCLSA-N 1 0 273.401 3.793 20 10 CHCDRO CCc1cccc(C[NH2+]C[C@H]2CCCC23CC3)c1O ZINC000706978895 1118588684 /nfs/dbraw/zinc/58/86/84/1118588684.db2.gz KVZBHSCSBZSJFH-OAHLLOKOSA-N 1 0 259.393 3.625 20 10 CHCDRO Cc1ccc(OC[C@@H](C)[NH2+][C@@H](C)c2ccccc2O)cc1 ZINC000040499380 1118613842 /nfs/dbraw/zinc/61/38/42/1118613842.db2.gz OLIAQGPRKMBCML-CABCVRRESA-N 1 0 285.387 3.819 20 10 CHCDRO Oc1cccc(Br)c1C[N@@H+]1CC2CCC1CC2 ZINC000707138741 1118642887 /nfs/dbraw/zinc/64/28/87/1118642887.db2.gz FXTOUIJXTHVADW-UHFFFAOYSA-N 1 0 296.208 3.529 20 10 CHCDRO Oc1cccc(Br)c1C[NH+]1CCCCCCC1 ZINC000707153050 1118650863 /nfs/dbraw/zinc/65/08/63/1118650863.db2.gz RZXTUTKSPXFOQZ-UHFFFAOYSA-N 1 0 298.224 3.921 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]CCCc1c[nH]c2ccccc12 ZINC000180650568 1128800494 /nfs/dbraw/zinc/80/04/94/1128800494.db2.gz VGCKSNPWPIGVDM-UHFFFAOYSA-N 1 0 298.361 3.735 20 10 CHCDRO Oc1ccccc1C[NH2+][C@H](c1ccco1)c1ccccc1 ZINC000041640172 1118949172 /nfs/dbraw/zinc/94/91/72/1118949172.db2.gz NEYHBCBFELWCRO-SFHVURJKSA-N 1 0 279.339 3.864 20 10 CHCDRO C[C@@H]([NH2+]Cc1nc(C2CC2)cs1)c1ccccc1O ZINC000183619256 1118988915 /nfs/dbraw/zinc/98/89/15/1118988915.db2.gz SGBRUKJODPWPOF-SNVBAGLBSA-N 1 0 274.389 3.577 20 10 CHCDRO Cc1cc(C[N@@H+]2CC[C@H]2Cc2ccccc2)ccc1N(C)C ZINC001167593935 1119141363 /nfs/dbraw/zinc/14/13/63/1119141363.db2.gz GDELTQGBQYGZOB-IBGZPJMESA-N 1 0 294.442 3.878 20 10 CHCDRO C[C@H]1CCC[C@H]([N@H+](C)Cc2cc(F)ccc2O)C1 ZINC000226562218 1119157458 /nfs/dbraw/zinc/15/74/58/1119157458.db2.gz AWELTMRVDQJAAH-FZMZJTMJSA-N 1 0 251.345 3.542 20 10 CHCDRO C[C@H]1CCC[C@@H]([NH2+]Cc2ccc3c(c2)CCCN3C)C1 ZINC000050286458 1119163147 /nfs/dbraw/zinc/16/31/47/1119163147.db2.gz VSUHCZQKMWKSTN-WMLDXEAASA-N 1 0 272.436 3.737 20 10 CHCDRO CCC[N@H+](Cc1ccccc1O)[C@@H](C)c1cccnc1 ZINC000076074095 1119182540 /nfs/dbraw/zinc/18/25/40/1119182540.db2.gz MNLFLESVBWUFOP-AWEZNQCLSA-N 1 0 270.376 3.760 20 10 CHCDRO CC(C)C[NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1 ZINC000119625889 1119219126 /nfs/dbraw/zinc/21/91/26/1119219126.db2.gz ALXMBUPSAOAFID-UHFFFAOYSA-N 1 0 298.377 3.502 20 10 CHCDRO CCC1(C[NH2+]Cc2cc(F)ccc2O)CCCC1 ZINC000226614893 1119227367 /nfs/dbraw/zinc/22/73/67/1119227367.db2.gz HQNXVNLRKHKVCS-UHFFFAOYSA-N 1 0 251.345 3.591 20 10 CHCDRO CC(C)CCn1cccc1C[NH2+]Cc1ccc(N(C)C)cc1 ZINC000161555624 1119302291 /nfs/dbraw/zinc/30/22/91/1119302291.db2.gz QRXIXAUGFGLTRS-UHFFFAOYSA-N 1 0 299.462 3.890 20 10 CHCDRO CC[C@@H](C)C[C@@H](C)[NH2+]Cc1cc(F)cc(F)c1[O-] ZINC000708445608 1119467114 /nfs/dbraw/zinc/46/71/14/1119467114.db2.gz VGKSUFSGOKCUEZ-NXEZZACHSA-N 1 0 257.324 3.585 20 10 CHCDRO C[C@H]1CC[C@H]([NH2+]Cc2ccc(N3CCCC3)cc2)CC1 ZINC000252959134 1119597210 /nfs/dbraw/zinc/59/72/10/1119597210.db2.gz LZSOKUZUYTXTBA-JCNLHEQBSA-N 1 0 272.436 3.955 20 10 CHCDRO COc1cccc(C[NH2+][C@@H]2CC[C@@H]3CCCC[C@@H]3C2)c1O ZINC000725843745 1119780667 /nfs/dbraw/zinc/78/06/67/1119780667.db2.gz CYTCHUZSPBAPGP-SQWLQELKSA-N 1 0 289.419 3.849 20 10 CHCDRO CC[C@@H]([NH2+]CCCOc1ccccc1)c1ccccc1O ZINC000052091976 1119781206 /nfs/dbraw/zinc/78/12/06/1119781206.db2.gz GVYUIXKFXVDJKI-QGZVFWFLSA-N 1 0 285.387 3.902 20 10 CHCDRO C[C@H]([NH2+]Cc1ccccc1O)C1CCC(F)(F)CC1 ZINC000690786845 1119819489 /nfs/dbraw/zinc/81/94/89/1119819489.db2.gz VOUVAHZGEWKYIW-NSHDSACASA-N 1 0 269.335 3.696 20 10 CHCDRO CCOc1cccc(C[NH2+][C@H]2CCCCC2(C)C)c1O ZINC000094323708 1120052276 /nfs/dbraw/zinc/05/22/76/1120052276.db2.gz UUMIPPRBEYCTCQ-HNNXBMFYSA-N 1 0 277.408 3.849 20 10 CHCDRO Cc1cc(C)cc([C@H](C)[NH2+]Cc2ccccc2O)c1 ZINC000107319891 1120059090 /nfs/dbraw/zinc/05/90/90/1120059090.db2.gz DZYGPZNCNDZWSQ-AWEZNQCLSA-N 1 0 255.361 3.860 20 10 CHCDRO CN(C)c1ccc(C[NH+]2C3CCCC2CCC3)cc1 ZINC000166489972 1120068630 /nfs/dbraw/zinc/06/86/30/1120068630.db2.gz CSGJRXYUGALKJF-UHFFFAOYSA-N 1 0 258.409 3.660 20 10 CHCDRO C[C@@H]([NH2+]CC(C)(C)C)c1ccc(Br)cc1O ZINC000309567316 1120127994 /nfs/dbraw/zinc/12/79/94/1120127994.db2.gz MNJYOSSKINSQGJ-SECBINFHSA-N 1 0 286.213 3.851 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCCC(F)(F)C1)c1ccc(N(C)C)cc1 ZINC000695064583 1120099226 /nfs/dbraw/zinc/09/92/26/1120099226.db2.gz GFBUNNTUYVMQFH-OCCSQVGLSA-N 1 0 282.378 3.981 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCCC(F)(F)C2)c1 ZINC000695081287 1120100867 /nfs/dbraw/zinc/10/08/67/1120100867.db2.gz FHLBXTJLZRRLDM-WDEREUQCSA-N 1 0 285.334 3.629 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[C@@H](C)[C@H](C)C2)c1 ZINC000251911112 1128891443 /nfs/dbraw/zinc/89/14/43/1128891443.db2.gz UALMBNTYYISJFD-YIYPIFLZSA-N 1 0 277.408 3.876 20 10 CHCDRO C[C@H]([NH2+][C@H]1CC[C@@H]1C)c1cc(Br)ccc1O ZINC000309587829 1120132135 /nfs/dbraw/zinc/13/21/35/1120132135.db2.gz SQJNWIPLYVMSRD-AUTRQRHGSA-N 1 0 284.197 3.604 20 10 CHCDRO CCC(CC)[C@H](O)C[NH2+][C@H](C)c1ccc(N(C)CC)cc1 ZINC000765921787 1120210130 /nfs/dbraw/zinc/21/01/30/1120210130.db2.gz LTMFHHFBPYMVLD-RDTXWAMCSA-N 1 0 292.467 3.590 20 10 CHCDRO CCC(CC)[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756339556 1120212003 /nfs/dbraw/zinc/21/20/03/1120212003.db2.gz BBDJYMXNCWSASQ-SKDRFNHKSA-N 1 0 251.345 3.858 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CC[C@@H]2CCCCO2)cc1 ZINC000180260749 1120269877 /nfs/dbraw/zinc/26/98/77/1120269877.db2.gz YLIAIHBCFGIBRZ-QAPCUYQASA-N 1 0 290.451 3.753 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H](C)N(C)c2ccccc2)c1 ZINC000756415083 1120329080 /nfs/dbraw/zinc/32/90/80/1120329080.db2.gz KFTPSUPOGFGRJZ-HZPDHXFCSA-N 1 0 298.430 3.876 20 10 CHCDRO C[C@H]([NH2+]CCN1CCCC[C@H]1C)c1cc(Cl)ccc1O ZINC000756421473 1120336431 /nfs/dbraw/zinc/33/64/31/1120336431.db2.gz ZVXNUSXGWWQSNX-OLZOCXBDSA-N 1 0 296.842 3.571 20 10 CHCDRO Cc1cccc(OC[C@H](C)[NH2+][C@@H](C)c2ccccc2O)c1 ZINC000183438551 1120341089 /nfs/dbraw/zinc/34/10/89/1120341089.db2.gz MODUMOCBDHBDEB-GJZGRUSLSA-N 1 0 285.387 3.819 20 10 CHCDRO COC[C@@H]1CCCC[N@@H+]1Cc1cccc(C(C)(C)C)c1O ZINC001143103381 1120346184 /nfs/dbraw/zinc/34/61/84/1120346184.db2.gz BJKREWIWTWYPDU-HNNXBMFYSA-N 1 0 291.435 3.691 20 10 CHCDRO Cc1cscc1C[NH2+]Cc1ccc2c(c1)CCCO2 ZINC000922069123 1120353352 /nfs/dbraw/zinc/35/33/52/1120353352.db2.gz RUPUERWONDLBOY-UHFFFAOYSA-N 1 0 273.401 3.671 20 10 CHCDRO COc1ccc(C[NH2+]Cc2ccc(C)c(F)c2)cc1C ZINC000078303002 1128912866 /nfs/dbraw/zinc/91/28/66/1128912866.db2.gz ODPQRRNZZJDAKC-UHFFFAOYSA-N 1 0 273.351 3.741 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C2CCC3(CC3)CC2)cc1 ZINC000695717801 1120405581 /nfs/dbraw/zinc/40/55/81/1120405581.db2.gz QPXBESCBPMIQCM-UHFFFAOYSA-N 1 0 258.409 3.565 20 10 CHCDRO CCc1ccc([C@H]2C[N@H+](Cc3ccccc3O)CCO2)cc1 ZINC000191665428 1120525989 /nfs/dbraw/zinc/52/59/89/1120525989.db2.gz YNYLWWBSHCNXRL-LJQANCHMSA-N 1 0 297.398 3.528 20 10 CHCDRO COc1ccccc1[C@@H](C)[NH2+][C@@H](C)c1ccccc1O ZINC000020096741 1120583859 /nfs/dbraw/zinc/58/38/59/1120583859.db2.gz BTASRJDHHMNLDA-QWHCGFSZSA-N 1 0 271.360 3.813 20 10 CHCDRO C[C@H]([NH2+]Cc1cc(F)ccc1O)C1CCC(F)(F)CC1 ZINC000690837750 1120588691 /nfs/dbraw/zinc/58/86/91/1120588691.db2.gz AWPJSFJMYNYZAS-JTQLQIEISA-N 1 0 287.325 3.835 20 10 CHCDRO C[C@@H]1CC[C@H]([NH2+]Cc2ccc3c(c2)CCCN3C)C[C@@H]1C ZINC000085039311 1120703816 /nfs/dbraw/zinc/70/38/16/1120703816.db2.gz WTHPTFSTBZQOCU-VKJFTORMSA-N 1 0 286.463 3.983 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCOCC2CCCC2)c(O)c1 ZINC000313299082 1120706257 /nfs/dbraw/zinc/70/62/57/1120706257.db2.gz NDERGAWVHBZZHL-CQSZACIVSA-N 1 0 277.408 3.558 20 10 CHCDRO CC[C@H]([NH2+]CCOCC1CCCC1)c1ccccc1O ZINC000313291445 1120706320 /nfs/dbraw/zinc/70/63/20/1120706320.db2.gz GVKGYWHZJKVAKM-INIZCTEOSA-N 1 0 277.408 3.640 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC(C)(C)[C@@H]2CCCCO2)c(O)c1 ZINC000756759818 1120806795 /nfs/dbraw/zinc/80/67/95/1120806795.db2.gz ZQBICHHTJIECHV-PBHICJAKSA-N 1 0 291.435 3.947 20 10 CHCDRO CSCC[C@H](C)[N@H+](C)Cc1cc(Cl)ccc1O ZINC000093558739 1120822498 /nfs/dbraw/zinc/82/24/98/1120822498.db2.gz WAVZUPRYAXUFQB-JTQLQIEISA-N 1 0 273.829 3.619 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCCN(C)c2ccccc2)c(O)c1 ZINC000314041389 1120855150 /nfs/dbraw/zinc/85/51/50/1120855150.db2.gz BOWWFWPLVBZNLZ-MRXNPFEDSA-N 1 0 298.430 3.878 20 10 CHCDRO COC1(C[NH2+][C@H](C)c2ccc3ccccc3c2O)CCC1 ZINC000186509357 1120920629 /nfs/dbraw/zinc/92/06/29/1120920629.db2.gz VJJLDZYCOIHAQR-CYBMUJFWSA-N 1 0 285.387 3.765 20 10 CHCDRO C[C@H]1C[N@@H+](Cc2c(O)cccc2Cl)CC[C@@H]1C ZINC000162897536 1120923657 /nfs/dbraw/zinc/92/36/57/1120923657.db2.gz AADSSOBQWGMYGS-QWRGUYRKSA-N 1 0 253.773 3.524 20 10 CHCDRO CO[C@@H](C)CC[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000273617859 1120973175 /nfs/dbraw/zinc/97/31/75/1120973175.db2.gz YCSOSONNEIMJNT-STQMWFEESA-N 1 0 273.376 3.621 20 10 CHCDRO CO[C@H](C)CC[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000273617855 1120973290 /nfs/dbraw/zinc/97/32/90/1120973290.db2.gz YCSOSONNEIMJNT-OLZOCXBDSA-N 1 0 273.376 3.621 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(C)c(C)n1)c1ccccc1O ZINC000314846385 1120978588 /nfs/dbraw/zinc/97/85/88/1120978588.db2.gz UYHXINBVTLYUCP-MRXNPFEDSA-N 1 0 270.376 3.645 20 10 CHCDRO CC(C)(C)C1CCC([NH2+]Cc2ccc(O)cc2O)CC1 ZINC000225029320 1121129586 /nfs/dbraw/zinc/12/95/86/1121129586.db2.gz QDABKIBHJYDMSC-UHFFFAOYSA-N 1 0 277.408 3.792 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]C2(CC(C)C)CC2)c1O ZINC000701488216 1121154917 /nfs/dbraw/zinc/15/49/17/1121154917.db2.gz CLSZMTBUTYHIKF-UHFFFAOYSA-N 1 0 283.799 3.723 20 10 CHCDRO CCC[N@H+](Cc1c(O)ccc2ccccc21)C1CC1 ZINC000728903421 1121173470 /nfs/dbraw/zinc/17/34/70/1121173470.db2.gz YLPMWRUNBFEWRH-UHFFFAOYSA-N 1 0 255.361 3.920 20 10 CHCDRO CC[C@@H]1CCC[C@@H]1[NH2+]CCCSc1nccs1 ZINC000766070316 1121180258 /nfs/dbraw/zinc/18/02/58/1121180258.db2.gz COADRODXEUDSOO-NEPJUHHUSA-N 1 0 270.467 3.794 20 10 CHCDRO CC(C)O[C@@H]1C[C@@H]([NH2+]Cc2c(O)cccc2Cl)C1(C)C ZINC000766089319 1121210293 /nfs/dbraw/zinc/21/02/93/1121210293.db2.gz QAPKBNUDGCWRSH-HUUCEWRRSA-N 1 0 297.826 3.727 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(F)cc1)c1cc(F)ccc1O ZINC000094616718 1121216182 /nfs/dbraw/zinc/21/61/82/1121216182.db2.gz MVWAJYILTUIJON-SNVBAGLBSA-N 1 0 263.287 3.521 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CCCC[C@H](C)C2)c1O ZINC000703203779 1121239376 /nfs/dbraw/zinc/23/93/76/1121239376.db2.gz FMVVPGYAJDYUOK-NSHDSACASA-N 1 0 283.799 3.676 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)CC(F)(F)F)c(O)c1 ZINC000231791503 1121244403 /nfs/dbraw/zinc/24/44/03/1121244403.db2.gz PYVKAOSZCBJJSG-UWVGGRQHSA-N 1 0 261.287 3.692 20 10 CHCDRO Cc1cc(F)ccc1CC[NH2+]Cc1cc(Cl)ccc1O ZINC000094950715 1121247650 /nfs/dbraw/zinc/24/76/50/1121247650.db2.gz ZLVDYJCOCIGPSA-UHFFFAOYSA-N 1 0 293.769 3.825 20 10 CHCDRO Cc1scc(C[NH2+]Cc2ccc(N(C)C)cc2)c1C ZINC000399802801 1121287512 /nfs/dbraw/zinc/28/75/12/1121287512.db2.gz CLUZSFYXBJNLPX-UHFFFAOYSA-N 1 0 274.433 3.721 20 10 CHCDRO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1c(O)ccc(F)c1Cl ZINC001237121022 1128980723 /nfs/dbraw/zinc/98/07/23/1128980723.db2.gz JYJNNXKZMPLLAM-AOOOYVTPSA-N 1 0 271.763 3.948 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C[C@@H]2C[C@H]2c2ccccc2)cc1 ZINC000237125083 1121373488 /nfs/dbraw/zinc/37/34/88/1121373488.db2.gz JBQYKFMSQGDDFA-HKUYNNGSSA-N 1 0 280.415 3.646 20 10 CHCDRO CCC[C@H](C[NH2+][C@H](CC)c1ccccc1O)OCC ZINC000705317184 1121396576 /nfs/dbraw/zinc/39/65/76/1121396576.db2.gz OZANMPOICANNHA-UKRRQHHQSA-N 1 0 265.397 3.638 20 10 CHCDRO CCC[C@@H](C[NH2+][C@H](C)c1ccc(C)cc1O)OCC ZINC000705319224 1121396824 /nfs/dbraw/zinc/39/68/24/1121396824.db2.gz XMMMDEOIACUOOH-KGLIPLIRSA-N 1 0 265.397 3.556 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCCC12CC2)c1cc(F)ccc1O ZINC000706226657 1121420174 /nfs/dbraw/zinc/42/01/74/1121420174.db2.gz SDSWRBHGIMQVAW-VXGBXAGGSA-N 1 0 263.356 3.762 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CC[C@H]2SC)cc1 ZINC000706504235 1121432255 /nfs/dbraw/zinc/43/22/55/1121432255.db2.gz GSXUUHAABIQGKK-HZPDHXFCSA-N 1 0 278.465 3.516 20 10 CHCDRO CCC[C@@H](C[NH2+][C@@H](C)c1ccc(N(C)C)cc1)OCC ZINC000707801304 1121463600 /nfs/dbraw/zinc/46/36/00/1121463600.db2.gz OORPKQNYHCGJSL-YOEHRIQHSA-N 1 0 278.440 3.608 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@]2(C)CCOc3ccccc32)cc1 ZINC000923023796 1121513902 /nfs/dbraw/zinc/51/39/02/1121513902.db2.gz BKGSTNKWULLYCG-LJQANCHMSA-N 1 0 296.414 3.540 20 10 CHCDRO O=C(c1ccc(F)cc1)c1ccccc1Nc1[nH]cc[nH+]1 ZINC001176082971 1121533820 /nfs/dbraw/zinc/53/38/20/1121533820.db2.gz QZEQIZBFTFMAKH-UHFFFAOYSA-N 1 0 281.290 3.523 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)C1CCSCC1 ZINC000187117975 1121538338 /nfs/dbraw/zinc/53/83/38/1121538338.db2.gz VCPPVBUKHXYCCG-GFCCVEGCSA-N 1 0 296.455 3.513 20 10 CHCDRO COc1cc(C)cc(C[NH2+][C@@H]2CCCc3ccccc32)c1O ZINC000894144848 1121665771 /nfs/dbraw/zinc/66/57/71/1121665771.db2.gz CFMDVSBKUCGDIL-QGZVFWFLSA-N 1 0 297.398 3.876 20 10 CHCDRO C[C@@H]([NH2+]C1CCC(F)(F)CC1)c1cc(F)ccc1O ZINC000688499440 1129004130 /nfs/dbraw/zinc/00/41/30/1129004130.db2.gz BFKBQMVYYUPUME-SECBINFHSA-N 1 0 273.298 3.760 20 10 CHCDRO Cc1cc(CC[NH2+]CC2CC2)c(C)n1-c1ccccc1 ZINC000727465347 1121720345 /nfs/dbraw/zinc/72/03/45/1121720345.db2.gz BEVDRQGFDJFMJK-UHFFFAOYSA-N 1 0 268.404 3.636 20 10 CHCDRO C[C@H]1CC(C)(C)C[C@H]1[NH2+]Cc1ccc2c(c1)CCCN2C ZINC001177529987 1121736560 /nfs/dbraw/zinc/73/65/60/1121736560.db2.gz XSQNAIZFCLIEHR-WMLDXEAASA-N 1 0 286.463 3.983 20 10 CHCDRO CCC[N@H+](Cc1ccccc1)Cc1ccccc1O ZINC000727831286 1121751098 /nfs/dbraw/zinc/75/10/98/1121751098.db2.gz TVEWLQDCDARSJA-UHFFFAOYSA-N 1 0 255.361 3.804 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1C=CCCC1 ZINC001178059740 1121764388 /nfs/dbraw/zinc/76/43/88/1121764388.db2.gz IARAJNULUKBOND-CQSZACIVSA-N 1 0 254.377 3.685 20 10 CHCDRO CCN(C)c1ccc(C[N@H+](C)C(C2CC2)C2CC2)cc1 ZINC000773755912 1121798488 /nfs/dbraw/zinc/79/84/88/1121798488.db2.gz OIZAJLIZOHCVNZ-UHFFFAOYSA-N 1 0 272.436 3.763 20 10 CHCDRO C[N@H+](Cc1cc2oc3ccccc3c2cc1O)[C@H]1CCOC1 ZINC000730259799 1121799505 /nfs/dbraw/zinc/79/95/05/1121799505.db2.gz DFJZCVXAZPYFQT-ZDUSSCGKSA-N 1 0 297.354 3.512 20 10 CHCDRO CC/C=C/C[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC001178800440 1121818232 /nfs/dbraw/zinc/81/82/32/1121818232.db2.gz BYFPLVPFYOFTEN-AATRIKPKSA-N 1 0 286.341 3.827 20 10 CHCDRO C[C@@H]1C[NH+](Cc2ccc(N(C)C)c3ccccc23)C[C@@H](C)O1 ZINC001204233575 1121830909 /nfs/dbraw/zinc/83/09/09/1121830909.db2.gz RPVVQDIGGITWEL-HUUCEWRRSA-N 1 0 298.430 3.515 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2C[C@@H]3CC[C@@H](C3)C2)c1 ZINC001179054224 1121844255 /nfs/dbraw/zinc/84/42/55/1121844255.db2.gz SGWLJJBQWGWVTL-IGQOVBAYSA-N 1 0 275.392 3.630 20 10 CHCDRO CCN(C)c1ccc(C[NH2+][C@@H](C)c2ccccc2)cc1 ZINC000773812805 1121873550 /nfs/dbraw/zinc/87/35/50/1121873550.db2.gz SSEKFGNAAVUMLP-HNNXBMFYSA-N 1 0 268.404 3.994 20 10 CHCDRO CCN(C)c1ccc(C[NH2+][C@H](C)c2c(C)noc2C)cc1 ZINC000773815101 1121880752 /nfs/dbraw/zinc/88/07/52/1121880752.db2.gz YQOSKABGCZOBIF-GFCCVEGCSA-N 1 0 287.407 3.598 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+][C@@H]2C[C@@H]3CCCC[C@H]23)cc1 ZINC001179464467 1121881993 /nfs/dbraw/zinc/88/19/93/1121881993.db2.gz RHYPWWLXLUHYHK-VMKIGCFOSA-N 1 0 284.447 3.934 20 10 CHCDRO C[C@H]([NH2+]Cc1c[nH]nc1-c1ccsc1)c1ccccc1O ZINC001179489038 1121883193 /nfs/dbraw/zinc/88/31/93/1121883193.db2.gz DUGPXRFSRLLRCN-NSHDSACASA-N 1 0 299.399 3.695 20 10 CHCDRO Cc1ccccc1OCCC[N@@H+](C)Cc1ccccc1O ZINC000731842813 1121889148 /nfs/dbraw/zinc/88/91/48/1121889148.db2.gz GXHHGTWWUGJPAM-UHFFFAOYSA-N 1 0 285.387 3.602 20 10 CHCDRO c1cc2c(cc1C[NH2+][C@H]1CCCC3(CC3)C1)CCCO2 ZINC001179670144 1121901685 /nfs/dbraw/zinc/90/16/85/1121901685.db2.gz DUDMVFDEOIGUDQ-INIZCTEOSA-N 1 0 271.404 3.824 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@H+]1CCC[C@@H](C)[C@H]1C ZINC001179858352 1121916751 /nfs/dbraw/zinc/91/67/51/1121916751.db2.gz DBJLRRYTVWTFNH-UKRRQHHQSA-N 1 0 260.425 3.681 20 10 CHCDRO CN(C)c1ccc(/C=C\C[N@H+](C)C(C2CC2)C2CC2)cc1 ZINC001180006473 1121937599 /nfs/dbraw/zinc/93/75/99/1121937599.db2.gz FLGUHIYLBKBPAA-PLNGDYQASA-N 1 0 284.447 3.886 20 10 CHCDRO CN(C)c1ccc(/C=C/C[N@H+](C)C(C2CC2)C2CC2)cc1 ZINC001180006474 1121937776 /nfs/dbraw/zinc/93/77/76/1121937776.db2.gz FLGUHIYLBKBPAA-SNAWJCMRSA-N 1 0 284.447 3.886 20 10 CHCDRO CC[C@H](C)[C@@H](O)C[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000732820719 1121940745 /nfs/dbraw/zinc/94/07/45/1121940745.db2.gz NDLZZIIQMBQPGJ-LIRRHRJNSA-N 1 0 299.414 3.556 20 10 CHCDRO C[C@@H]([NH2+]C1CCC(F)(F)CC1)c1ccc(N(C)C)cc1 ZINC000688516758 1129021021 /nfs/dbraw/zinc/02/10/21/1129021021.db2.gz CWSYQVKIHZYAIG-GFCCVEGCSA-N 1 0 282.378 3.981 20 10 CHCDRO CC(C)c1ccc(O)c(C[N@@H+]2CC[C@H]3OCCC[C@@H]3C2)c1 ZINC001180203729 1121962579 /nfs/dbraw/zinc/96/25/79/1121962579.db2.gz YJCBLTKYXIITKB-CRAIPNDOSA-N 1 0 289.419 3.517 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+][C@H](C)CC2CCC2)c1O ZINC000710248645 1121963397 /nfs/dbraw/zinc/96/33/97/1121963397.db2.gz MWCZYJAOTPWGQZ-SNVBAGLBSA-N 1 0 283.799 3.723 20 10 CHCDRO COC1(CC[NH2+][C@H](C)c2cc(Cl)ccc2O)CCC1 ZINC000815642082 1121972092 /nfs/dbraw/zinc/97/20/92/1121972092.db2.gz QYOXVRLYOUGFQG-LLVKDONJSA-N 1 0 283.799 3.655 20 10 CHCDRO CN(C)c1ccc(C[NH2+]CCC2=CCCCC2)cc1F ZINC000733322295 1121975464 /nfs/dbraw/zinc/97/54/64/1121975464.db2.gz QOOWSUNSFMGJEC-UHFFFAOYSA-N 1 0 276.399 3.872 20 10 CHCDRO Cc1[nH]c2ccccc2c1C[N@@H+](C)Cc1ccccc1O ZINC001204295651 1122048986 /nfs/dbraw/zinc/04/89/86/1122048986.db2.gz UGLISUQWOXGCMU-UHFFFAOYSA-N 1 0 280.371 3.814 20 10 CHCDRO CCOC[C@H]([NH2+]Cc1cc(Cl)c(C)cc1O)C(C)C ZINC001181391283 1122054264 /nfs/dbraw/zinc/05/42/64/1122054264.db2.gz WMXAIBSOMFNTEZ-AWEZNQCLSA-N 1 0 285.815 3.505 20 10 CHCDRO CCC[C@@H]([NH2+]Cc1cccc(OC)c1O)[C@@H]1CC1(C)C ZINC001181487962 1122058534 /nfs/dbraw/zinc/05/85/34/1122058534.db2.gz RFWQXAKBNJBVCW-UONOGXRCSA-N 1 0 277.408 3.705 20 10 CHCDRO CC[C@H]([NH2+]CCN1CCCC(C)(C)C1)c1ccccc1O ZINC000774490471 1122169656 /nfs/dbraw/zinc/16/96/56/1122169656.db2.gz XSNOHXIDYVATEB-INIZCTEOSA-N 1 0 290.451 3.555 20 10 CHCDRO Cc1cccc(C[N@@H+](Cc2ccco2)C(C)C)c1O ZINC000271710980 1122171672 /nfs/dbraw/zinc/17/16/72/1122171672.db2.gz AYEIRXQRCHJLNC-UHFFFAOYSA-N 1 0 259.349 3.704 20 10 CHCDRO Cc1ccc(C[NH+]2CCC(c3ccco3)CC2)c(O)c1 ZINC001182796460 1122187507 /nfs/dbraw/zinc/18/75/07/1122187507.db2.gz VJHPIFCNNVSPJQ-UHFFFAOYSA-N 1 0 271.360 3.673 20 10 CHCDRO CC(C)C[C@@H]1C[C@@H]([NH2+]Cc2c(O)cccc2Cl)CCO1 ZINC000272034712 1122188412 /nfs/dbraw/zinc/18/84/12/1122188412.db2.gz UYMQQNSWSKWSCK-QWHCGFSZSA-N 1 0 297.826 3.729 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CCC[C@H](C2CCC2)C1 ZINC001182969779 1122198277 /nfs/dbraw/zinc/19/82/77/1122198277.db2.gz JVEBMEVLFDACBV-ZDUSSCGKSA-N 1 0 263.356 3.543 20 10 CHCDRO Cc1ccc(CC2C[NH+](Cc3ccc(C)cc3O)C2)cc1 ZINC001182929987 1122198828 /nfs/dbraw/zinc/19/88/28/1122198828.db2.gz SIUVDCDYQSVFBU-UHFFFAOYSA-N 1 0 281.399 3.684 20 10 CHCDRO Oc1cccc2sc(C[N@@H+]3Cc4cccc(O)c4C3)cc21 ZINC001183455688 1122224938 /nfs/dbraw/zinc/22/49/38/1122224938.db2.gz VZDXZSVUDZEDQC-UHFFFAOYSA-N 1 0 297.379 3.828 20 10 CHCDRO COCC[C@H]([NH2+][C@@H](C)c1ccc(C)cc1O)c1ccco1 ZINC000273431098 1122232562 /nfs/dbraw/zinc/23/25/62/1122232562.db2.gz LCGWRLHBSMHXTF-ZFWWWQNUSA-N 1 0 289.375 3.722 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCO[C@H](C(C)(C)C)C2)c1 ZINC000273483349 1122235082 /nfs/dbraw/zinc/23/50/82/1122235082.db2.gz MRCSZSIJKNWHLA-VBQJREDUSA-N 1 0 291.435 3.945 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCOC2(CCC2)C1)c1cc(Cl)ccc1O ZINC000273491821 1122236769 /nfs/dbraw/zinc/23/67/69/1122236769.db2.gz OKIKZCKABGZJPX-DGCLKSJQSA-N 1 0 295.810 3.798 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(Cl)cn2)c(O)c1C ZINC000273542925 1122237244 /nfs/dbraw/zinc/23/72/44/1122237244.db2.gz YRQVRUGCUFUYCP-LBPRGKRZSA-N 1 0 290.794 3.908 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCO[C@H](CC(C)C)C2)c1 ZINC000273519292 1122237516 /nfs/dbraw/zinc/23/75/16/1122237516.db2.gz TYOZEFMOIOMJOZ-HRCADAONSA-N 1 0 291.435 3.945 20 10 CHCDRO Cc1ncc(C[NH2+][C@H](C)c2cc(Cl)ccc2O)s1 ZINC000273563801 1122238771 /nfs/dbraw/zinc/23/87/71/1122238771.db2.gz IUKTVUGQFOVGGE-MRVPVSSYSA-N 1 0 282.796 3.661 20 10 CHCDRO Cc1nc(C)c(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)s1 ZINC000273598036 1122239819 /nfs/dbraw/zinc/23/98/19/1122239819.db2.gz RCEMDWSXSNJZQI-LLVKDONJSA-N 1 0 290.432 3.933 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2cccc(N(C)C)c2)c(O)c1C ZINC000273607955 1122240087 /nfs/dbraw/zinc/24/00/87/1122240087.db2.gz UWGQYDZAPAZJDI-OAHLLOKOSA-N 1 0 298.430 3.926 20 10 CHCDRO CCCC[C@H](C)[C@H](C)[NH2+]Cc1c([O-])cccc1F ZINC001183918661 1122248319 /nfs/dbraw/zinc/24/83/19/1122248319.db2.gz BETWXKUEOLOTSF-RYUDHWBXSA-N 1 0 253.361 3.836 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2cc(Cl)ccc2C)c(O)c1 ZINC001184153027 1122256972 /nfs/dbraw/zinc/25/69/72/1122256972.db2.gz CENHGZXIHCQRRV-UHFFFAOYSA-N 1 0 275.779 3.952 20 10 CHCDRO C[C@H]([NH2+]CC1(c2ccccc2)CC1)c1ccccc1O ZINC000183402496 1129050926 /nfs/dbraw/zinc/05/09/26/1129050926.db2.gz SVLZGOLUGASRJC-AWEZNQCLSA-N 1 0 267.372 3.775 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCC[C@H](CO)C1)c1ccc2ccccc2c1O ZINC000319798434 1122411963 /nfs/dbraw/zinc/41/19/63/1122411963.db2.gz ANXLDSVOVFWBLO-DZKIICNBSA-N 1 0 299.414 3.747 20 10 CHCDRO C[C@@H]([NH2+]C[C@H](C)COCc1ccccc1)c1ccccc1O ZINC000183459149 1129055802 /nfs/dbraw/zinc/05/58/02/1129055802.db2.gz VVXXUDUNAKKOMP-JKSUJKDBSA-N 1 0 299.414 3.896 20 10 CHCDRO Cc1cc2cc(C[NH2+]Cc3ccc4c(c3)CCO4)ccc2[nH]1 ZINC000285604853 1122515852 /nfs/dbraw/zinc/51/58/52/1122515852.db2.gz WWPUHADVQDAXRM-UHFFFAOYSA-N 1 0 292.382 3.701 20 10 CHCDRO CCOc1ccc(C[NH2+]C2(Cc3ccccc3)CC2)c(O)c1 ZINC000775328158 1122517765 /nfs/dbraw/zinc/51/77/65/1122517765.db2.gz YZRFBJMAQAVDFZ-UHFFFAOYSA-N 1 0 297.398 3.656 20 10 CHCDRO CC(C)C[C@H]1OCCC[C@@H]1[NH2+]Cc1cc(Cl)ccc1O ZINC000775373661 1122532402 /nfs/dbraw/zinc/53/24/02/1122532402.db2.gz ZLGATGURBMWEGK-GOEBONIOSA-N 1 0 297.826 3.729 20 10 CHCDRO C[C@H](C[NH2+][C@@H](C)c1ccccc1O)Oc1cccc(F)c1 ZINC000183534237 1129060957 /nfs/dbraw/zinc/06/09/57/1129060957.db2.gz LWTQICHZPWXJGK-OLZOCXBDSA-N 1 0 289.350 3.649 20 10 CHCDRO COc1cccc(F)c1[C@H](C)[NH2+][C@H](C)c1ccccc1O ZINC000183533433 1129061103 /nfs/dbraw/zinc/06/11/03/1129061103.db2.gz PSCRNVLYHKQOMX-NEPJUHHUSA-N 1 0 289.350 3.952 20 10 CHCDRO Cc1cccc(O[C@H](C)C[NH2+][C@H](C)c2ccccc2O)c1 ZINC000183533749 1129061227 /nfs/dbraw/zinc/06/12/27/1129061227.db2.gz YNMMOZNNJXCJAT-HUUCEWRRSA-N 1 0 285.387 3.819 20 10 CHCDRO CC(C)C1CC[NH+](Cc2ccc(N(C)C)cc2)CC1 ZINC001191013254 1122565223 /nfs/dbraw/zinc/56/52/23/1122565223.db2.gz HETRQQFSLFYYOG-UHFFFAOYSA-N 1 0 260.425 3.621 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cccc(C)n1)c1cc(Cl)ccc1O ZINC000775490315 1122620422 /nfs/dbraw/zinc/62/04/22/1122620422.db2.gz BQPGRCFHBPCTMK-OAHLLOKOSA-N 1 0 290.794 3.990 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](C)N1CCCC[C@H]1C)c1ccccc1O ZINC000775492757 1122622168 /nfs/dbraw/zinc/62/21/68/1122622168.db2.gz QLVIMIPPUIHBDE-VYDXJSESSA-N 1 0 290.451 3.696 20 10 CHCDRO CCOCCCC[NH2+][C@H](CC)c1cc(Cl)ccc1O ZINC000775491321 1122622271 /nfs/dbraw/zinc/62/22/71/1122622271.db2.gz IDQZJHDMGDWAGZ-CQSZACIVSA-N 1 0 285.815 3.903 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](C)N1CCCC[C@@H]1C)c1ccccc1O ZINC000775492756 1122622613 /nfs/dbraw/zinc/62/26/13/1122622613.db2.gz QLVIMIPPUIHBDE-UXLLHSPISA-N 1 0 290.451 3.696 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](C)N(C)C1CC1)c1cc(Cl)ccc1O ZINC000775501746 1122628461 /nfs/dbraw/zinc/62/84/61/1122628461.db2.gz KTDWBYZGDNWZGU-XHDPSFHLSA-N 1 0 296.842 3.569 20 10 CHCDRO CC[C@H]([NH2+]CCCC(C)(C)CO)c1cc(Cl)ccc1O ZINC000775508602 1122630123 /nfs/dbraw/zinc/63/01/23/1122630123.db2.gz DJKUZILHXYLRAV-AWEZNQCLSA-N 1 0 299.842 3.885 20 10 CHCDRO CC[C@@H]([NH2+]CCN1CCCC[C@H]1CC)c1ccccc1O ZINC000775504089 1122630970 /nfs/dbraw/zinc/63/09/70/1122630970.db2.gz SCHKSXLEZPJRMR-NVXWUHKLSA-N 1 0 290.451 3.697 20 10 CHCDRO CC[C@H]([NH2+]CCN1CCCC[C@H]1CC)c1ccccc1O ZINC000775504091 1122631296 /nfs/dbraw/zinc/63/12/96/1122631296.db2.gz SCHKSXLEZPJRMR-WBVHZDCISA-N 1 0 290.451 3.697 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CCCSC1)c1cc(Cl)ccc1O ZINC000775510940 1122633154 /nfs/dbraw/zinc/63/31/54/1122633154.db2.gz BGPYOPZJOOKZIB-DGCLKSJQSA-N 1 0 285.840 3.982 20 10 CHCDRO CC[C@H]([NH2+]CCN1CCC[C@@H]1C)c1cc(Cl)ccc1O ZINC000775509611 1122633333 /nfs/dbraw/zinc/63/33/33/1122633333.db2.gz STDVXJOOFSFBTI-WFASDCNBSA-N 1 0 296.842 3.571 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CC)c1ccccc1O)C1CCOCC1 ZINC000775512048 1122633654 /nfs/dbraw/zinc/63/36/54/1122633654.db2.gz JNGIRTSZNAMXRX-CVEARBPZSA-N 1 0 277.408 3.638 20 10 CHCDRO CC[C@H](C[C@H](C)CO)[NH2+][C@H](CC)c1cc(Cl)ccc1O ZINC000775513276 1122633659 /nfs/dbraw/zinc/63/36/59/1122633659.db2.gz PLVVRBQJFXNPCX-NJZAAPMLSA-N 1 0 299.842 3.883 20 10 CHCDRO CC[C@H]([NH2+][C@@H](CC)C1CCOCC1)c1ccccc1O ZINC000775512049 1122633770 /nfs/dbraw/zinc/63/37/70/1122633770.db2.gz JNGIRTSZNAMXRX-HOTGVXAUSA-N 1 0 277.408 3.638 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCCS1)c1cc(Cl)ccc1O ZINC000775512315 1122633877 /nfs/dbraw/zinc/63/38/77/1122633877.db2.gz JBJKVQJMYYZUHB-AAEUAGOBSA-N 1 0 285.840 3.982 20 10 CHCDRO CC[C@H]([NH2+]CC(CC)(CC)CO)c1cc(Cl)ccc1O ZINC000775523532 1122640965 /nfs/dbraw/zinc/64/09/65/1122640965.db2.gz JVUZGHLXFZIQHP-AWEZNQCLSA-N 1 0 299.842 3.885 20 10 CHCDRO CC[C@H]([NH2+]CC1(C)CCOCC1)c1cc(Cl)ccc1O ZINC000775524564 1122642946 /nfs/dbraw/zinc/64/29/46/1122642946.db2.gz CFFUWGSQFLVTKH-AWEZNQCLSA-N 1 0 297.826 3.903 20 10 CHCDRO Cc1cc(C[NH2+]C(C(C)C)C(C)C)ccc1N(C)C ZINC001192617476 1122653570 /nfs/dbraw/zinc/65/35/70/1122653570.db2.gz SZZDROLUWSQYPF-UHFFFAOYSA-N 1 0 262.441 3.831 20 10 CHCDRO COc1ccc(C[C@@H](C)C[NH2+][C@H](C)c2ccccc2O)cc1 ZINC000183631348 1129072811 /nfs/dbraw/zinc/07/28/11/1129072811.db2.gz ZHPGZDHWTOAVKW-HUUCEWRRSA-N 1 0 299.414 3.930 20 10 CHCDRO Cc1cc(C[NH2+]C[C@@H]2C[C@H]2C)c(C)n1-c1ccccc1 ZINC000159037699 1122769998 /nfs/dbraw/zinc/76/99/98/1122769998.db2.gz FXBRBULNQFAPKB-CJNGLKHVSA-N 1 0 268.404 3.840 20 10 CHCDRO Cc1cc(C[NH2+]C[C@H]2C[C@@H]2C)c(C)n1-c1ccccc1 ZINC000159037621 1122770093 /nfs/dbraw/zinc/77/00/93/1122770093.db2.gz FXBRBULNQFAPKB-XJKSGUPXSA-N 1 0 268.404 3.840 20 10 CHCDRO CCOC(C)(C)C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC000159253554 1122799954 /nfs/dbraw/zinc/79/99/54/1122799954.db2.gz XEDUIJLKMHKUQR-CHWSQXEVSA-N 1 0 277.408 3.654 20 10 CHCDRO C[N@H+](Cc1ccccc1)Cc1cc(Cl)cc(F)c1[O-] ZINC000775634209 1122838467 /nfs/dbraw/zinc/83/84/67/1122838467.db2.gz ORHDRIXRXVJJLH-UHFFFAOYSA-N 1 0 279.742 3.817 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCc3ccccc3[C@@H]2C)c1O ZINC000775680167 1122900860 /nfs/dbraw/zinc/90/08/60/1122900860.db2.gz BDWMRAYKSWVVRZ-AWEZNQCLSA-N 1 0 267.372 3.820 20 10 CHCDRO CC[N@@H+](Cc1cc(Br)cc(C)c1O)CC1CC1 ZINC000775700070 1122911797 /nfs/dbraw/zinc/91/17/97/1122911797.db2.gz AGDMSQHOOCPKGZ-UHFFFAOYSA-N 1 0 298.224 3.695 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2CCc3ccsc3C2)c1O ZINC000775699704 1122912116 /nfs/dbraw/zinc/91/21/16/1122912116.db2.gz CBPZJQCQZGRKFO-UHFFFAOYSA-N 1 0 293.819 3.974 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCS[C@@H](c3ccccc3)C2)c1O ZINC000775698215 1122912135 /nfs/dbraw/zinc/91/21/35/1122912135.db2.gz MBSJRMMZLLUWDH-QGZVFWFLSA-N 1 0 299.439 3.991 20 10 CHCDRO CCOCc1cc(C[NH2+][C@H]2CCCC[C@H]2C)ccc1OC ZINC001198959167 1123017302 /nfs/dbraw/zinc/01/73/02/1123017302.db2.gz JJUWPDSQQXSVFW-PBHICJAKSA-N 1 0 291.435 3.900 20 10 CHCDRO Cc1cccc(C[N@H+]2CCC[C@@H](C(F)(F)F)[C@@H]2C)c1O ZINC000776013186 1123035300 /nfs/dbraw/zinc/03/53/00/1123035300.db2.gz LFDDVBTVWZOCBI-WCQYABFASA-N 1 0 287.325 3.863 20 10 CHCDRO C[C@@H]1[C@H](C(F)(F)F)CCC[N@@H+]1Cc1cc(F)ccc1O ZINC000776012504 1123036038 /nfs/dbraw/zinc/03/60/38/1123036038.db2.gz HFNQRRYJXWAIKQ-BXKDBHETSA-N 1 0 291.288 3.694 20 10 CHCDRO C[C@@H]([NH2+]CCCC1CCOCC1)c1ccc(N(C)C)cc1 ZINC000776008658 1123036307 /nfs/dbraw/zinc/03/63/07/1123036307.db2.gz ULFPPCGEQOBBBN-OAHLLOKOSA-N 1 0 290.451 3.610 20 10 CHCDRO COc1cccc(C[NH2+]C[C@H](C)C2CCCCC2)c1O ZINC000776076021 1123053250 /nfs/dbraw/zinc/05/32/50/1123053250.db2.gz AWQSUQSFJZWOIU-ZDUSSCGKSA-N 1 0 277.408 3.707 20 10 CHCDRO COc1cccc(C[NH2+]C(C)(C)Cc2ccccc2C)c1O ZINC000105492180 1123053725 /nfs/dbraw/zinc/05/37/25/1123053725.db2.gz MBEAYSXRWJTGIZ-UHFFFAOYSA-N 1 0 299.414 3.820 20 10 CHCDRO Cc1cccc(C[NH2+]Cc2cc(-c3ccccc3)on2)c1O ZINC000776151828 1123084171 /nfs/dbraw/zinc/08/41/71/1123084171.db2.gz WIDMIWOSMXISAK-UHFFFAOYSA-N 1 0 294.354 3.645 20 10 CHCDRO COc1ccc2c(c1)c1c(n2C)CC[N@@H+](CC(C)(C)C)C1 ZINC001201440539 1123104640 /nfs/dbraw/zinc/10/46/40/1123104640.db2.gz RPEWNLZSBKVMSJ-UHFFFAOYSA-N 1 0 286.419 3.591 20 10 CHCDRO C[C@@H](Cc1cccc(F)c1)[NH2+]Cc1cc(Cl)ccc1O ZINC000776207914 1123146080 /nfs/dbraw/zinc/14/60/80/1123146080.db2.gz RIBCIGCHSSDZND-NSHDSACASA-N 1 0 293.769 3.906 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+]CC2(O)CCCCCC2)c1O ZINC000776208766 1123147674 /nfs/dbraw/zinc/14/76/74/1123147674.db2.gz FYSLIIPDDWTXHH-UHFFFAOYSA-N 1 0 297.826 3.529 20 10 CHCDRO CCOc1ccc(C[NH2+][C@H](C)C2CCCCC2)c(O)c1 ZINC000776213066 1123150019 /nfs/dbraw/zinc/15/00/19/1123150019.db2.gz PNMFDADBQXCBHP-CYBMUJFWSA-N 1 0 277.408 3.849 20 10 CHCDRO Cc1cccc(C[NH2+][C@H](C)[C@H]2Oc3ccccc3[C@@H]2C)c1O ZINC000776230451 1123159445 /nfs/dbraw/zinc/15/94/45/1123159445.db2.gz ITQPILMLPXRSQT-KSMMKXTCSA-N 1 0 297.398 3.743 20 10 CHCDRO CCc1cnccc1[C@H](C)[NH2+]Cc1cccc(C)c1O ZINC000776255732 1123188006 /nfs/dbraw/zinc/18/80/06/1123188006.db2.gz HLDIKBPBDBCYKP-ZDUSSCGKSA-N 1 0 270.376 3.509 20 10 CHCDRO Cc1ccncc1[C@@H](C)[NH2+]Cc1cc(Cl)cc(C)c1O ZINC000776255436 1123188448 /nfs/dbraw/zinc/18/84/48/1123188448.db2.gz XIFDUMHSZKWJOQ-GFCCVEGCSA-N 1 0 290.794 3.908 20 10 CHCDRO Fc1ccc(CC2([NH2+]Cc3ccc4c(c3)CCO4)CC2)cc1 ZINC001202408785 1123204940 /nfs/dbraw/zinc/20/49/40/1123204940.db2.gz SFDLSBGREUHBDI-UHFFFAOYSA-N 1 0 297.373 3.626 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]CC2(C)CCCC2)c1 ZINC000108941282 1123233950 /nfs/dbraw/zinc/23/39/50/1123233950.db2.gz LPWWFIHJQZNNEF-GFCCVEGCSA-N 1 0 263.381 3.632 20 10 CHCDRO COc1cc(C[NH2+]C(C)(C)C)c(O)c(C(C)(C)C)c1 ZINC000850024480 1123237818 /nfs/dbraw/zinc/23/78/18/1123237818.db2.gz ZRCXJCYZHMVECK-UHFFFAOYSA-N 1 0 265.397 3.586 20 10 CHCDRO COc1cc(C[NH2+]C2(C)CCC2)c(O)c(C(C)(C)C)c1 ZINC000850225606 1123248238 /nfs/dbraw/zinc/24/82/38/1123248238.db2.gz FXCXGTLMCSXVNK-UHFFFAOYSA-N 1 0 277.408 3.731 20 10 CHCDRO CCOCc1cc(C[NH2+][C@@H](CC)C2CC2)ccc1OC ZINC000850382466 1123261370 /nfs/dbraw/zinc/26/13/70/1123261370.db2.gz VIVNXKSHJQBFNM-INIZCTEOSA-N 1 0 277.408 3.510 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H](c2ccccc2)[C@H](O)C(C)C)c1 ZINC000850395051 1123262092 /nfs/dbraw/zinc/26/20/92/1123262092.db2.gz MTECGXCTJXCZSI-RTBURBONSA-N 1 0 299.414 3.548 20 10 CHCDRO CCOc1cccc(C[NH2+][C@H](C)C2CCC(F)CC2)c1O ZINC000850395186 1123262129 /nfs/dbraw/zinc/26/21/29/1123262129.db2.gz DXTMVAVHINWDNN-DNOWBOINSA-N 1 0 295.398 3.797 20 10 CHCDRO c1csc(SCCC[NH2+][C@H]2CCCSCC2)n1 ZINC000850435490 1123266338 /nfs/dbraw/zinc/26/63/38/1123266338.db2.gz AJYNYRHDNPZLSJ-NSHDSACASA-N 1 0 288.507 3.501 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@H](C)c2ccccn2)cc1 ZINC000850482397 1123273165 /nfs/dbraw/zinc/27/31/65/1123273165.db2.gz OYCSIDPQPLJWLE-HOTGVXAUSA-N 1 0 297.446 3.992 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCN2C(C)(C)C)c(O)c1C ZINC000850480544 1123273813 /nfs/dbraw/zinc/27/38/13/1123273813.db2.gz BXCNYDXUWSLXBF-LSDHHAIUSA-N 1 0 290.451 3.532 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H]2CCN2C(C)(C)C)c(O)c1 ZINC000850482850 1123274016 /nfs/dbraw/zinc/27/40/16/1123274016.db2.gz VGUXKGVUTZFDTE-CABCVRRESA-N 1 0 290.451 3.532 20 10 CHCDRO CC[C@@H](COCC1CC1)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000850495105 1123275399 /nfs/dbraw/zinc/27/53/99/1123275399.db2.gz WKCSYJQFSOKJRK-YOEHRIQHSA-N 1 0 290.451 3.608 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1C=CCC1)c1cc(Br)ccc1O ZINC000850507191 1123277106 /nfs/dbraw/zinc/27/71/06/1123277106.db2.gz DOONKBVDHDCJHK-MWLCHTKSSA-N 1 0 282.181 3.524 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2cscn2)c(O)c1C ZINC000850511499 1123277654 /nfs/dbraw/zinc/27/76/54/1123277654.db2.gz GTUZBSLCDNCBRM-NEPJUHHUSA-N 1 0 276.405 3.877 20 10 CHCDRO C[C@H]([NH2+][C@@H]1COC2(CCC2)C1)c1ccc2ccccc2c1O ZINC000850525082 1123281117 /nfs/dbraw/zinc/28/11/17/1123281117.db2.gz KYGCOUWPAYIGCM-ZFWWWQNUSA-N 1 0 297.398 3.908 20 10 CHCDRO C[C@H]1C[C@H]([NH2+]CCCOC(C)(C)C)c2c1c(F)ccc2O ZINC000850527224 1123282028 /nfs/dbraw/zinc/28/20/28/1123282028.db2.gz VNKCWFZHJCHVBN-AAEUAGOBSA-N 1 0 295.398 3.874 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1C[C@H](c2ccccc2)CO1)c1ccccc1O ZINC000850531491 1123285169 /nfs/dbraw/zinc/28/51/69/1123285169.db2.gz JXTHCYKIJILNCU-XIRDDKMYSA-N 1 0 297.398 3.616 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCc2ccoc2)cc1 ZINC000850532002 1123285182 /nfs/dbraw/zinc/28/51/82/1123285182.db2.gz PGRXHASYQRGVKU-CQSZACIVSA-N 1 0 272.392 3.629 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccoc1)c1ccc(N(C)C)cc1 ZINC000850532346 1123286102 /nfs/dbraw/zinc/28/61/02/1123286102.db2.gz SZWDMLJZHADYPL-KRWDZBQOSA-N 1 0 272.392 3.629 20 10 CHCDRO C[C@@H]([NH2+]CC[C@@]1(C)CC1(F)F)c1cc(F)ccc1O ZINC000850537674 1123288256 /nfs/dbraw/zinc/28/82/56/1123288256.db2.gz WYNBJRCTVCRKBD-RNCFNFMXSA-N 1 0 273.298 3.617 20 10 CHCDRO CC(C)[C@H](O)[C@@H]([NH2+][C@@H](C)c1ccccc1O)c1ccccc1 ZINC000850555145 1123290797 /nfs/dbraw/zinc/29/07/97/1123290797.db2.gz MIQAYACUKFTLQK-JVPBZIDWSA-N 1 0 299.414 3.801 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2C(C)(C)C2(F)F)c(O)c1C ZINC000850553651 1123291193 /nfs/dbraw/zinc/29/11/93/1123291193.db2.gz ZXVTWRPJMSVAST-YPMHNXCESA-N 1 0 283.362 3.951 20 10 CHCDRO CC[C@H]([NH2+]CC1SCCS1)c1ccc(N(C)C)cc1 ZINC000850559766 1123292023 /nfs/dbraw/zinc/29/20/23/1123292023.db2.gz GCWTWOITQDZCRK-AWEZNQCLSA-N 1 0 296.505 3.599 20 10 CHCDRO CC(C)CC1([NH2+][C@@H](C)c2cc(F)ccc2O)CC1 ZINC000850567179 1123293518 /nfs/dbraw/zinc/29/35/18/1123293518.db2.gz XZDXLRBHZLIEJF-NSHDSACASA-N 1 0 251.345 3.761 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCCc2ccco2)c(O)c1C ZINC000850570540 1123294495 /nfs/dbraw/zinc/29/44/95/1123294495.db2.gz VSBBEOPVGXLXEM-AWEZNQCLSA-N 1 0 273.376 3.885 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@@H]2CCOC2(C)C)cc1 ZINC000850571730 1123294975 /nfs/dbraw/zinc/29/49/75/1123294975.db2.gz VEBBUZBTHJPTRE-ZBFHGGJFSA-N 1 0 290.451 3.608 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCOC1(C)C)c1cc(Cl)ccc1O ZINC000850572009 1123295058 /nfs/dbraw/zinc/29/50/58/1123295058.db2.gz XWFBOJUCPNBLEP-FZMZJTMJSA-N 1 0 297.826 3.901 20 10 CHCDRO C[N@H+](Cc1ccccc1O)Cc1ccc(F)c2cccnc12 ZINC000109770374 1123326125 /nfs/dbraw/zinc/32/61/25/1123326125.db2.gz IWEFPXYIMJXLAL-UHFFFAOYSA-N 1 0 296.345 3.712 20 10 CHCDRO CSC1(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)CCC1 ZINC000193810615 1129114921 /nfs/dbraw/zinc/11/49/21/1129114921.db2.gz PIUQIZHIJFPDDD-CYBMUJFWSA-N 1 0 278.465 3.689 20 10 CHCDRO Oc1ccccc1C[N@H+](CCC1CCC1)C[C@@H]1CCCO1 ZINC000851840911 1123384218 /nfs/dbraw/zinc/38/42/18/1123384218.db2.gz LQZUKPWUXLUDBG-KRWDZBQOSA-N 1 0 289.419 3.563 20 10 CHCDRO C[C@@H](C[NH2+][C@H](C)c1ccccc1O)c1ccc(F)cc1 ZINC000783508738 1123400181 /nfs/dbraw/zinc/40/01/81/1123400181.db2.gz KQTZGACBWVIIDO-QWHCGFSZSA-N 1 0 273.351 3.986 20 10 CHCDRO COc1cc(C[N@@H+]2CC[C@@H]3C[C@@H]3C2)c(O)c(C(C)(C)C)c1 ZINC000853581671 1123444071 /nfs/dbraw/zinc/44/40/71/1123444071.db2.gz WXKUMFXQRUFFGC-CHWSQXEVSA-N 1 0 289.419 3.540 20 10 CHCDRO Cc1ccc([C@@H](C)C[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC000738435168 1123462468 /nfs/dbraw/zinc/46/24/68/1123462468.db2.gz BMQOTEUDRMEEIV-HNNXBMFYSA-N 1 0 281.399 3.823 20 10 CHCDRO COc1cccc(C[C@H](C)[NH2+][C@@H](C)c2ccccc2O)c1 ZINC000783521092 1123470291 /nfs/dbraw/zinc/47/02/91/1123470291.db2.gz DTRMFCIBIJBMAS-KBPBESRZSA-N 1 0 285.387 3.683 20 10 CHCDRO COc1ccc(C2([NH2+][C@@H](C)c3ccccc3O)CC2)cc1 ZINC000783522843 1123475851 /nfs/dbraw/zinc/47/58/51/1123475851.db2.gz BEDXEQUGQZHDQH-ZDUSSCGKSA-N 1 0 283.371 3.741 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCc2cc(N)ccc21)c1ccc(N(C)C)cc1 ZINC000854227147 1123478913 /nfs/dbraw/zinc/47/89/13/1123478913.db2.gz SQDQLNQDGLJZMG-ORAYPTAESA-N 1 0 295.430 3.673 20 10 CHCDRO COc1ccc(C2CC2)cc1C[NH2+]Cc1cccc(C)c1O ZINC000895538264 1123489112 /nfs/dbraw/zinc/48/91/12/1123489112.db2.gz ARTADCCOCIJVJH-UHFFFAOYSA-N 1 0 297.398 3.876 20 10 CHCDRO COc1ccc(C2CC2)cc1C[NH2+]Cc1ccc(C)cc1O ZINC000895537220 1123489270 /nfs/dbraw/zinc/48/92/70/1123489270.db2.gz RCIQEYRWODYOGE-UHFFFAOYSA-N 1 0 297.398 3.876 20 10 CHCDRO CCC[N@H+](Cc1ccc(F)cc1)Cc1ccccc1O ZINC000112516921 1123492194 /nfs/dbraw/zinc/49/21/94/1123492194.db2.gz PJPVSCZCXGMZKW-UHFFFAOYSA-N 1 0 273.351 3.944 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H]2c3ccccc3CC[C@H]2F)c1O ZINC000895693153 1123505586 /nfs/dbraw/zinc/50/55/86/1123505586.db2.gz YZTRBBDJPMDXRJ-IAGOWNOFSA-N 1 0 285.362 3.816 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]C[C@@]1(C)CCOC2(CCC2)C1 ZINC000895820433 1123518001 /nfs/dbraw/zinc/51/80/01/1123518001.db2.gz FTFIHLFRKCACIH-KRWDZBQOSA-N 1 0 289.419 3.530 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)[C@@H]1COc2ccccc2C1)c1ccccc1O ZINC000895851038 1123521917 /nfs/dbraw/zinc/52/19/17/1123521917.db2.gz IIJUPZQVTPKIFR-DZKIICNBSA-N 1 0 297.398 3.683 20 10 CHCDRO Cc1cc(O)c(C[NH+]2CC(Cc3ccsc3)C2)cc1C ZINC000857067843 1123584050 /nfs/dbraw/zinc/58/40/50/1123584050.db2.gz HAEDDXHCFNDPAY-UHFFFAOYSA-N 1 0 287.428 3.745 20 10 CHCDRO COc1ccc(F)c(C[NH2+][C@@H](C)c2cc(C)ccc2O)c1 ZINC000857080570 1123584628 /nfs/dbraw/zinc/58/46/28/1123584628.db2.gz IEYMRLNZFBMOGT-LBPRGKRZSA-N 1 0 289.350 3.699 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC[C@H]2CC2(Cl)Cl)c(O)c1 ZINC000857082299 1123585514 /nfs/dbraw/zinc/58/55/14/1123585514.db2.gz MJOBFTXJSWCOIB-QWRGUYRKSA-N 1 0 288.218 3.935 20 10 CHCDRO CC(C)c1ccc(O)c(C[NH2+][C@H]2CC(C)(C)OC2(C)C)c1 ZINC001205007303 1123626643 /nfs/dbraw/zinc/62/66/43/1123626643.db2.gz INLGUAQXRQLYJY-INIZCTEOSA-N 1 0 291.435 3.951 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)[C@@H]1C[C@H]1C1CC1 ZINC000858094728 1123631251 /nfs/dbraw/zinc/63/12/51/1123631251.db2.gz RQHVSNLWGJOPRR-CCKFTAQKSA-N 1 0 284.447 3.811 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2cc(C)cc(Cl)c2)c1 ZINC000858239583 1123639023 /nfs/dbraw/zinc/63/90/23/1123639023.db2.gz QBLGFPCLUUQGBM-UHFFFAOYSA-N 1 0 275.779 3.952 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H]2CCC[C@H](c3cccnc3)C2)c1 ZINC000858238522 1123639115 /nfs/dbraw/zinc/63/91/15/1123639115.db2.gz AFADRUKCRSNHRV-MAUKXSAKSA-N 1 0 296.414 3.912 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H]2CCC[C@@H](c3cccnc3)C2)c1 ZINC000858238518 1123639143 /nfs/dbraw/zinc/63/91/43/1123639143.db2.gz AFADRUKCRSNHRV-CRAIPNDOSA-N 1 0 296.414 3.912 20 10 CHCDRO CCC[C@H](C[NH2+][C@H](C)c1ccc(C)c(C)c1O)OCC ZINC000858451226 1123655516 /nfs/dbraw/zinc/65/55/16/1123655516.db2.gz PJFAZLBSYFKVQG-HUUCEWRRSA-N 1 0 279.424 3.865 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1ccns1)c1ccc(C)cc1O ZINC000858578288 1123664746 /nfs/dbraw/zinc/66/47/46/1123664746.db2.gz YEPHYHGAYADSFR-AAEUAGOBSA-N 1 0 276.405 3.959 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H](c2cncc(F)c2)C2CC2)cc1 ZINC000281403679 1123705681 /nfs/dbraw/zinc/70/56/81/1123705681.db2.gz YXHNEPUEEXJPNQ-GOSISDBHSA-N 1 0 299.393 3.528 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H]2CCSC3(CCC3)C2)c1O ZINC000896950395 1123792428 /nfs/dbraw/zinc/79/24/28/1123792428.db2.gz FVGBDUBARHOJCL-CQSZACIVSA-N 1 0 277.433 3.609 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2C)C1CC(F)(F)C1 ZINC000862275143 1123797406 /nfs/dbraw/zinc/79/74/06/1123797406.db2.gz LWUOCQMXHSIXKL-GFCCVEGCSA-N 1 0 294.389 3.592 20 10 CHCDRO CC[C@H]([NH2+]C1CCC(OC)CC1)c1ccc(C)cc1O ZINC000840791702 1123806791 /nfs/dbraw/zinc/80/67/91/1123806791.db2.gz BZEJBECBMCVXAH-XUJLQICISA-N 1 0 277.408 3.699 20 10 CHCDRO C[C@H]1C[NH+](Cc2cc(Cl)ccc2O)C[C@H](C)C1(F)F ZINC000862443421 1123812159 /nfs/dbraw/zinc/81/21/59/1123812159.db2.gz OWZJEDGKOZVMJV-UWVGGRQHSA-N 1 0 289.753 3.769 20 10 CHCDRO CN(C)c1ccc(/C=C\C[N@@H+]2CCCC(F)(F)CC2)cc1 ZINC000862467137 1123812835 /nfs/dbraw/zinc/81/28/35/1123812835.db2.gz QRBVBKKQNXOOES-HYXAFXHYSA-N 1 0 294.389 3.887 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCCC(F)(F)CC2)cc1F ZINC000862466796 1123813253 /nfs/dbraw/zinc/81/32/53/1123813253.db2.gz LDAPFSHUQPHNCO-UHFFFAOYSA-N 1 0 286.341 3.513 20 10 CHCDRO C[C@H]1C[NH+](Cc2cc3c(cc2O)CCC3)C[C@H](C)C1(F)F ZINC000863274972 1123857517 /nfs/dbraw/zinc/85/75/17/1123857517.db2.gz OVERCQVXNHPGDK-RYUDHWBXSA-N 1 0 295.373 3.604 20 10 CHCDRO Oc1ccc2ccccc2c1C[NH+](C1CC1)C1CC1 ZINC000863304648 1123859780 /nfs/dbraw/zinc/85/97/80/1123859780.db2.gz JFXZKYFVLDGUQA-UHFFFAOYSA-N 1 0 253.345 3.672 20 10 CHCDRO CCCC[N@H+](Cc1ccccc1O)[C@H](C)c1cnc(C)cn1 ZINC000794545977 1123886723 /nfs/dbraw/zinc/88/67/23/1123886723.db2.gz NKHOOELFROSBRU-OAHLLOKOSA-N 1 0 299.418 3.854 20 10 CHCDRO C[C@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1cc2c(cc1O)CCC2 ZINC000794670530 1123924206 /nfs/dbraw/zinc/92/42/06/1123924206.db2.gz XRVJLMONKNLURK-HZMBPMFUSA-N 1 0 299.336 3.654 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccc(O)cc1)c1ccc(C)cc1O ZINC000794800725 1123950754 /nfs/dbraw/zinc/95/07/54/1123950754.db2.gz FEEKQVNJLBKFOM-KRWDZBQOSA-N 1 0 285.387 3.690 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccc(C)cc1O ZINC000794803382 1123953250 /nfs/dbraw/zinc/95/32/50/1123953250.db2.gz ISFWJQQZUHGAIK-KRWDZBQOSA-N 1 0 297.398 3.876 20 10 CHCDRO CC[C@H]([NH2+][C@H]1C[C@H](OC)C1(C)C)c1ccc(C)cc1O ZINC000794811596 1123956815 /nfs/dbraw/zinc/95/68/15/1123956815.db2.gz RYQZJEBRNGMCRG-BPUTZDHNSA-N 1 0 277.408 3.555 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccc(C)nc1)c1ccc(C)cc1O ZINC000794809122 1123957195 /nfs/dbraw/zinc/95/71/95/1123957195.db2.gz QKJSMQBMMSOSIV-QGZVFWFLSA-N 1 0 284.403 3.687 20 10 CHCDRO CCC(CC)[C@@H](O)C[NH2+][C@H](CC)c1ccc(C)cc1O ZINC000794809116 1123957525 /nfs/dbraw/zinc/95/75/25/1123957525.db2.gz QJILAAXDZXXUAD-WBVHZDCISA-N 1 0 279.424 3.538 20 10 CHCDRO CC[C@@H]([NH2+]CCOC(C)(C)C)c1ccc(C)cc1O ZINC000794816235 1123959087 /nfs/dbraw/zinc/95/90/87/1123959087.db2.gz YHOKBOGJXJQVOI-CQSZACIVSA-N 1 0 265.397 3.556 20 10 CHCDRO CC[C@@H]([NH2+]CCc1cccc(C)n1)c1ccc(N(C)C)cc1 ZINC000794829599 1123961993 /nfs/dbraw/zinc/96/19/93/1123961993.db2.gz UHTUEQJTNOBKJY-LJQANCHMSA-N 1 0 297.446 3.739 20 10 CHCDRO CC[C@H]([NH2+]CC1(SC)CC1)c1ccc(C)cc1O ZINC000794826716 1123962038 /nfs/dbraw/zinc/96/20/38/1123962038.db2.gz DCLJXOGOEXVKHZ-ZDUSSCGKSA-N 1 0 265.422 3.637 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCc2cccc(C)n2)cc1 ZINC000794828001 1123962109 /nfs/dbraw/zinc/96/21/09/1123962109.db2.gz NUPOMARBJBXRSF-MRXNPFEDSA-N 1 0 297.446 3.739 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](C)N(CC)CC)c1ccc(N(C)C)cc1 ZINC000794828498 1123962404 /nfs/dbraw/zinc/96/24/04/1123962404.db2.gz BLPGRWKXCXUURD-CRAIPNDOSA-N 1 0 291.483 3.524 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2cccnc2F)cc1 ZINC000794837843 1123982209 /nfs/dbraw/zinc/98/22/09/1123982209.db2.gz VWDCIBHLFUVFSD-CYBMUJFWSA-N 1 0 287.382 3.528 20 10 CHCDRO COc1cccc(C[NH2+]Cc2ccc(C(C)(C)C)o2)c1O ZINC000865814891 1124016202 /nfs/dbraw/zinc/01/62/02/1124016202.db2.gz QCFUXZNJGOQMHK-UHFFFAOYSA-N 1 0 289.375 3.581 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H](CF)c2ccc(F)cc2)c1 ZINC000865823072 1124017489 /nfs/dbraw/zinc/01/74/89/1124017489.db2.gz RGTHMEVZNLNUEQ-HNNXBMFYSA-N 1 0 277.314 3.640 20 10 CHCDRO FC(F)(F)[C@@H]1CC=CC[C@H]1[NH2+]Cc1ccc2c(c1)CCO2 ZINC000865832181 1124018547 /nfs/dbraw/zinc/01/85/47/1124018547.db2.gz KKQKYRCYBBQXSS-ZIAGYGMSSA-N 1 0 297.320 3.608 20 10 CHCDRO Cc1ncc([C@@H](C)[NH2+][C@@H](C)c2ccc(C)cc2O)s1 ZINC000866454573 1124067913 /nfs/dbraw/zinc/06/79/13/1124067913.db2.gz CXVJUBLFQZMYQJ-WDEREUQCSA-N 1 0 276.405 3.877 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1cnc(C)s1)c1ccccc1O ZINC000866456235 1124067937 /nfs/dbraw/zinc/06/79/37/1124067937.db2.gz XMWMNXGOQHCXJF-GWCFXTLKSA-N 1 0 276.405 3.959 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccnc(F)c1)c1ccc(N(C)C)cc1 ZINC000866472980 1124068798 /nfs/dbraw/zinc/06/87/98/1124068798.db2.gz IGKRWTJCXWUBAU-MRXNPFEDSA-N 1 0 287.382 3.528 20 10 CHCDRO C[C@H]([NH2+]CC1([C@H]2CCCCO2)CCC1)c1ccccc1O ZINC000866480626 1124070924 /nfs/dbraw/zinc/07/09/24/1124070924.db2.gz GNJYAKDBQHCUQL-WMLDXEAASA-N 1 0 289.419 3.782 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2cccc3c2CCOC3)c(O)c1 ZINC000866479320 1124071181 /nfs/dbraw/zinc/07/11/81/1124071181.db2.gz RPQWTJVRAAPHGP-CQSZACIVSA-N 1 0 297.398 3.624 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)o1 ZINC000866479098 1124071310 /nfs/dbraw/zinc/07/13/10/1124071310.db2.gz PSMYDFVTNXTZJQ-TVQRCGJNSA-N 1 0 275.323 3.771 20 10 CHCDRO CCc1onc(C)c1C[NH2+]Cc1cc(Cl)c(C)cc1O ZINC000897336924 1124074911 /nfs/dbraw/zinc/07/49/11/1124074911.db2.gz RNVWRCLFABLVDF-UHFFFAOYSA-N 1 0 294.782 3.503 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H](C2CCC2)[C@H]2CCOC2)c(O)c1 ZINC000866513007 1124076200 /nfs/dbraw/zinc/07/62/00/1124076200.db2.gz RADDFZCHHPJQLN-DHSIGJKJSA-N 1 0 289.419 3.556 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1c2ccccc2CN1C)c1ccccc1O ZINC000866562727 1124082548 /nfs/dbraw/zinc/08/25/48/1124082548.db2.gz GNWZXAPBGPWMEB-ROUUACIJSA-N 1 0 296.414 3.620 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CC=CC[C@H]1C(F)(F)F)c1ccccc1O ZINC000866609369 1124087843 /nfs/dbraw/zinc/08/78/43/1124087843.db2.gz MGQNYFMNROISAI-RAIGVLPGSA-N 1 0 285.309 3.940 20 10 CHCDRO CC[C@H](C[C@H](C)O)[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O ZINC000866632681 1124092203 /nfs/dbraw/zinc/09/22/03/1124092203.db2.gz BDAJYNPXXVYDTC-GMXVVIOVSA-N 1 0 285.815 3.554 20 10 CHCDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]Cc1ccnc(F)c1 ZINC001118994277 1131244434 /nfs/dbraw/zinc/24/44/34/1131244434.db2.gz SCPUKTTZNZTPRF-WCQYABFASA-N 1 0 286.350 3.573 20 10 CHCDRO C[C@@H]1C[C@@H]([NH2+]CCCC(F)F)c2c1c(F)ccc2O ZINC001119607222 1131259601 /nfs/dbraw/zinc/25/96/01/1131259601.db2.gz ZDOJKWLARDQFGJ-PSASIEDQSA-N 1 0 273.298 3.715 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)c1cccs1 ZINC000122683725 1124523983 /nfs/dbraw/zinc/52/39/83/1124523983.db2.gz XFBULJIBUPZDRY-CYBMUJFWSA-N 1 0 274.433 3.973 20 10 CHCDRO Oc1ccccc1C[NH2+]Cc1cccc(C(F)F)c1 ZINC000228407877 1124580174 /nfs/dbraw/zinc/58/01/74/1124580174.db2.gz BPEYFNSDBYLQFO-UHFFFAOYSA-N 1 0 263.287 3.620 20 10 CHCDRO CC[N@H+](Cc1ccc(N)cc1)[C@H](C)c1ccc(F)cc1 ZINC001120370774 1131274639 /nfs/dbraw/zinc/27/46/39/1131274639.db2.gz DYGCXEDXHSADSW-CYBMUJFWSA-N 1 0 272.367 3.991 20 10 CHCDRO Nc1ccc(C[N@@H+]2C[C@@H]3C[C@@H](c4ccccc4)[C@@H]3C2)cc1 ZINC001120371666 1131274951 /nfs/dbraw/zinc/27/49/51/1131274951.db2.gz NFJSGNLTAOHSSE-YTQUADARSA-N 1 0 278.399 3.504 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1ccccc1O)[C@H](O)c1ccccc1 ZINC000872134421 1124692862 /nfs/dbraw/zinc/69/28/62/1124692862.db2.gz WCJZVVWXUDRNIQ-QANKJYHBSA-N 1 0 285.387 3.555 20 10 CHCDRO CCCOc1ccc(C[NH2+]Cc2c(C)noc2C)cc1C ZINC000873023531 1124734551 /nfs/dbraw/zinc/73/45/51/1124734551.db2.gz ZNOPCESTQLODMF-UHFFFAOYSA-N 1 0 288.391 3.678 20 10 CHCDRO CCCOc1ccc(C[NH2+][C@H](CO)c2ccccc2)cc1C ZINC000873051841 1124736494 /nfs/dbraw/zinc/73/64/94/1124736494.db2.gz IETPLCYUDOBJGA-GOSISDBHSA-N 1 0 299.414 3.607 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC[C@@H]2CNc3ccccc32)c(O)c1 ZINC000873236421 1124753167 /nfs/dbraw/zinc/75/31/67/1124753167.db2.gz HBSKRNXTQWRKNL-LSDHHAIUSA-N 1 0 296.414 3.951 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]C2CCC(C)CC2)c1 ZINC000019917949 1124770570 /nfs/dbraw/zinc/77/05/70/1124770570.db2.gz XJJCAWAQCAYHIZ-CPCZMJQVSA-N 1 0 263.381 3.630 20 10 CHCDRO Cc1cc(C[N@H+](C)Cc2ccccc2O)c2ccccc2n1 ZINC000124742280 1124810685 /nfs/dbraw/zinc/81/06/85/1124810685.db2.gz BKBSXELOCVFFGX-UHFFFAOYSA-N 1 0 292.382 3.881 20 10 CHCDRO Cc1ccc(C[C@H](C)[NH2+]Cc2cccc(C)c2O)s1 ZINC000124831715 1124820520 /nfs/dbraw/zinc/82/05/20/1124820520.db2.gz PQGUMEATJBXJQT-LBPRGKRZSA-N 1 0 275.417 3.791 20 10 CHCDRO CCC(C)(C)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000020552962 1124850590 /nfs/dbraw/zinc/85/05/90/1124850590.db2.gz JFKBQXWAKOICKL-UHFFFAOYSA-N 1 0 260.425 3.955 20 10 CHCDRO C[C@@H]([NH2+]CCCOC1CCCC1)c1ccc(N(C)C)cc1 ZINC000125250597 1124876546 /nfs/dbraw/zinc/87/65/46/1124876546.db2.gz GOARXOXYIXLFFV-OAHLLOKOSA-N 1 0 290.451 3.753 20 10 CHCDRO CCC(CC)[C@@H](C[NH2+][C@H](C)c1ccc(C)cc1O)N(C)C ZINC000021521146 1124932698 /nfs/dbraw/zinc/93/26/98/1124932698.db2.gz XHCKRADYTMRTNU-RHSMWYFYSA-N 1 0 292.467 3.718 20 10 CHCDRO COc1ccccc1[C@@H]1CC[N@H+](Cc2c(C)cccc2O)C1 ZINC000876758218 1124975064 /nfs/dbraw/zinc/97/50/64/1124975064.db2.gz JWAUWHSYTCMKIO-OAHLLOKOSA-N 1 0 297.398 3.699 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H]2CCCc3ccccc32)c(O)c1 ZINC000876886175 1124986617 /nfs/dbraw/zinc/98/66/17/1124986617.db2.gz RZZAWJRRQURHFI-QGZVFWFLSA-N 1 0 267.372 3.868 20 10 CHCDRO CCCOCc1ccccc1C[NH2+]Cc1c(C)cccc1O ZINC000876942740 1124991464 /nfs/dbraw/zinc/99/14/64/1124991464.db2.gz DCLLQBTXGNKHDF-UHFFFAOYSA-N 1 0 299.414 3.917 20 10 CHCDRO CSc1ccc(C[NH2+]Cc2c(C)cccc2O)cc1 ZINC000876967743 1124992675 /nfs/dbraw/zinc/99/26/75/1124992675.db2.gz ABKZDLBMFUCYJK-UHFFFAOYSA-N 1 0 273.401 3.712 20 10 CHCDRO Cc1ccc(C[NH2+][C@H]2CSCc3ccccc32)c(O)c1 ZINC000876974644 1124994484 /nfs/dbraw/zinc/99/44/84/1124994484.db2.gz NVAZWKLGPWVBIT-INIZCTEOSA-N 1 0 285.412 3.778 20 10 CHCDRO CC[C@H]([NH2+]Cc1c(C)cccc1O)c1nc(C)cs1 ZINC000877025222 1125000264 /nfs/dbraw/zinc/00/02/64/1125000264.db2.gz DEAIIXMHBGAXBT-ZDUSSCGKSA-N 1 0 276.405 3.706 20 10 CHCDRO CSc1ccc(F)cc1C[NH2+]Cc1c(C)cccc1O ZINC000877067857 1125006006 /nfs/dbraw/zinc/00/60/06/1125006006.db2.gz NBZMXJHDBKFQHI-UHFFFAOYSA-N 1 0 291.391 3.851 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H]2COc3c2cccc3Cl)c(O)c1 ZINC000877094217 1125007731 /nfs/dbraw/zinc/00/77/31/1125007731.db2.gz IDNWORCVNLDCTJ-CQSZACIVSA-N 1 0 289.762 3.577 20 10 CHCDRO CCOc1cc(C)ccc1C[NH2+]Cc1ccc(C)cc1O ZINC000877087669 1125008782 /nfs/dbraw/zinc/00/87/82/1125008782.db2.gz OTOBAEPZWUJDHS-UHFFFAOYSA-N 1 0 285.387 3.698 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](c2ccccc2)[C@H]2CCOC2)c(O)c1 ZINC000877133651 1125013530 /nfs/dbraw/zinc/01/35/30/1125013530.db2.gz FUJLSVVXKLLCPK-HKUYNNGSSA-N 1 0 297.398 3.568 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H]2[C@H]3Cc4cc(Cl)ccc4[C@@H]23)c1O ZINC000529644400 1125029145 /nfs/dbraw/zinc/02/91/45/1125029145.db2.gz YUCJAKCREDWJHD-GVDBMIGSSA-N 1 0 299.801 3.782 20 10 CHCDRO CSc1cccc(F)c1C[NH2+]Cc1c(C)cccc1O ZINC000877514715 1125035746 /nfs/dbraw/zinc/03/57/46/1125035746.db2.gz OLRDXPXDEXWOFJ-UHFFFAOYSA-N 1 0 291.391 3.851 20 10 CHCDRO CSCc1ccc(C[NH2+]Cc2c(C)cccc2O)cc1 ZINC000877519987 1125039107 /nfs/dbraw/zinc/03/91/07/1125039107.db2.gz VXYZQSOMDMRUIW-UHFFFAOYSA-N 1 0 287.428 3.853 20 10 CHCDRO CCO[P@@](C)(=O)CC[C@H](C)[NH2+]Cc1cc(C)ccc1O ZINC000877652772 1125058147 /nfs/dbraw/zinc/05/81/47/1125058147.db2.gz NSZHHIUXAPXQMZ-RNODOKPDSA-N 1 0 299.351 3.513 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]C[C@@H]1CC=CC[C@H]1C(F)(F)F ZINC000877728549 1125068963 /nfs/dbraw/zinc/06/89/63/1125068963.db2.gz GGHLUBSVLPDAKA-GXTWGEPZSA-N 1 0 299.336 3.935 20 10 CHCDRO Cc1ccc(C[NH2+]C[C@@H]2CC=CC[C@H]2C(F)(F)F)c(O)c1 ZINC000877729151 1125069963 /nfs/dbraw/zinc/06/99/63/1125069963.db2.gz NORXLUDIOIJSIM-GXTWGEPZSA-N 1 0 299.336 3.935 20 10 CHCDRO CC(C)[C@@H]1C[C@H]([NH2+][C@H](C)c2ccccc2O)CS1 ZINC000877755650 1125071482 /nfs/dbraw/zinc/07/14/82/1125071482.db2.gz JRPUOBGIXFNZLH-XUJVJEKNSA-N 1 0 265.422 3.573 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H](C)c2ccccc2O)cc1C ZINC000877756246 1125071843 /nfs/dbraw/zinc/07/18/43/1125071843.db2.gz ASIDICSPMBZAPU-CYBMUJFWSA-N 1 0 271.360 3.565 20 10 CHCDRO Cc1ccc(C)c(C[NH2+][C@H](C)c2ccccc2O)c1 ZINC000877756489 1125072482 /nfs/dbraw/zinc/07/24/82/1125072482.db2.gz MCBIUMXLCLAUMP-CQSZACIVSA-N 1 0 255.361 3.860 20 10 CHCDRO CCc1cccc(C[NH2+][C@H](C)c2ccccc2O)c1O ZINC000877755973 1125073520 /nfs/dbraw/zinc/07/35/20/1125073520.db2.gz VPIHDSPFQTYOPJ-GFCCVEGCSA-N 1 0 271.360 3.511 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H](C)c2ccccc2O)c1F ZINC000877758101 1125075025 /nfs/dbraw/zinc/07/50/25/1125075025.db2.gz IUXAZDWOONFFMC-LBPRGKRZSA-N 1 0 259.324 3.691 20 10 CHCDRO C[C@@H]([NH2+]CC[C@H]1CCCC1(F)F)c1ccccc1O ZINC000878354162 1125143373 /nfs/dbraw/zinc/14/33/73/1125143373.db2.gz DAGZETWPKPKODT-VXGBXAGGSA-N 1 0 269.335 3.868 20 10 CHCDRO CC[N@@H+]1CC[C@H](C[NH2+][C@@H](C)c2ccc3ccccc3c2O)C1 ZINC000193494863 1125199372 /nfs/dbraw/zinc/19/93/72/1125199372.db2.gz AKWOZKOBNZUWOX-LSDHHAIUSA-N 1 0 298.430 3.538 20 10 CHCDRO C[C@@H]([NH2+]Cc1cc(C(F)(F)F)co1)c1ccccc1O ZINC000879650327 1125223867 /nfs/dbraw/zinc/22/38/67/1125223867.db2.gz UXLDOOHTEJBBSK-SECBINFHSA-N 1 0 285.265 3.855 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(C(F)(F)F)cn1)c1ccccc1O ZINC000879650824 1125224625 /nfs/dbraw/zinc/22/46/25/1125224625.db2.gz RGQJWNTZYHFHRO-JTQLQIEISA-N 1 0 296.292 3.657 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CCCCC[C@H]2C)c1O ZINC000228666486 1125251144 /nfs/dbraw/zinc/25/11/44/1125251144.db2.gz ILXDMJHDZSHKHQ-LLVKDONJSA-N 1 0 283.799 3.819 20 10 CHCDRO Cc1cc(Br)cc(C[NH2+][C@H]2CC[C@@H](C)C2)c1O ZINC000783710099 1125285726 /nfs/dbraw/zinc/28/57/26/1125285726.db2.gz JNSWVPRREQEBDK-RNCFNFMXSA-N 1 0 298.224 3.741 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCC(CC)(CC)C2)c1O ZINC000211558716 1125308599 /nfs/dbraw/zinc/30/85/99/1125308599.db2.gz QOPYAXVAGBPUIQ-UHFFFAOYSA-N 1 0 277.408 3.803 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)C1CCC1 ZINC000130037164 1125355784 /nfs/dbraw/zinc/35/57/84/1125355784.db2.gz PUQBXGJHJLKCLV-OAHLLOKOSA-N 1 0 272.436 3.955 20 10 CHCDRO C[C@@H](c1ccco1)[N@H+](C)Cc1cc(Cl)ccc1O ZINC000131076537 1125373827 /nfs/dbraw/zinc/37/38/27/1125373827.db2.gz ZHHZAJXVWFXJKM-JTQLQIEISA-N 1 0 265.740 3.832 20 10 CHCDRO CCOc1cccc(C[NH2+]CC[C@@H]2CCCC2(F)F)c1O ZINC000883267018 1125389563 /nfs/dbraw/zinc/38/95/63/1125389563.db2.gz QOXINASCFCCOMK-ZDUSSCGKSA-N 1 0 299.361 3.706 20 10 CHCDRO CO[C@H]1C[C@H](C[NH2+][C@H](C)c2ccc3ccccc3c2O)C1 ZINC000883272173 1125389741 /nfs/dbraw/zinc/38/97/41/1125389741.db2.gz FSIFLZODDJTPGK-UMVBOHGHSA-N 1 0 285.387 3.621 20 10 CHCDRO CO[C@H]1C[C@H](C[NH2+][C@@H](C)c2ccc3ccccc3c2O)C1 ZINC000883272174 1125390248 /nfs/dbraw/zinc/39/02/48/1125390248.db2.gz FSIFLZODDJTPGK-YDHLFZDLSA-N 1 0 285.387 3.621 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CCC[C@H]2c2ccccc2)c1 ZINC000131584989 1125398778 /nfs/dbraw/zinc/39/87/78/1125398778.db2.gz HBGQZTPAHLHUSS-KRWDZBQOSA-N 1 0 283.371 3.738 20 10 CHCDRO CC[C@H]([NH2+][C@@H](CC)[C@H]1CCCOC1)c1ccc(C)cc1O ZINC000883353281 1125400035 /nfs/dbraw/zinc/40/00/35/1125400035.db2.gz RNIGAGAPSNQZEG-XIRDDKMYSA-N 1 0 291.435 3.947 20 10 CHCDRO CC[C@H]([NH2+]C1CCC2(COC2)CC1)c1ccc(C)cc1O ZINC000883381118 1125406411 /nfs/dbraw/zinc/40/64/11/1125406411.db2.gz GWYRFCRPWVJANF-INIZCTEOSA-N 1 0 289.419 3.701 20 10 CHCDRO Oc1ccccc1C[NH2+][C@H]1c2ccccc2CC[C@H]1F ZINC000883382436 1125406986 /nfs/dbraw/zinc/40/69/86/1125406986.db2.gz GXMQXJHCVYUVTP-WBVHZDCISA-N 1 0 271.335 3.507 20 10 CHCDRO C[C@@H]1C[C@H](C)C[N@@H+](Cc2c(O)cccc2Cl)C1 ZINC000131818462 1125410395 /nfs/dbraw/zinc/41/03/95/1125410395.db2.gz CHEPATDYEKKAMP-PHIMTYICSA-N 1 0 253.773 3.524 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CCC[C@@H]2C2CCCC2)c1 ZINC000132824433 1125423998 /nfs/dbraw/zinc/42/39/98/1125423998.db2.gz PHYZMHXRTLVOIG-MRXNPFEDSA-N 1 0 275.392 3.555 20 10 CHCDRO CC[C@H]([NH2+]C1C[C@H](C)O[C@@H](C)C1)c1ccc(N(C)C)cc1 ZINC000245584219 1129212913 /nfs/dbraw/zinc/21/29/13/1129212913.db2.gz IQCVLLGJQGYALP-DEYYWGMASA-N 1 0 290.451 3.749 20 10 CHCDRO C[C@H](CCc1ccco1)[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000295989590 1129220546 /nfs/dbraw/zinc/22/05/46/1129220546.db2.gz NRRIJSUUFWAVEG-IUODEOHRSA-N 1 0 271.360 3.583 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]Cc1cccc(Cl)c1)CC2 ZINC000296183021 1129220675 /nfs/dbraw/zinc/22/06/75/1129220675.db2.gz YFGLCEBBJZHQFU-AWEZNQCLSA-N 1 0 273.763 3.823 20 10 CHCDRO COc1ccc([C@H](C)[NH2+][C@H]2CCc3cccc(O)c32)cc1 ZINC000296237673 1129221077 /nfs/dbraw/zinc/22/10/77/1129221077.db2.gz APXKFXPAMUNGCB-LRDDRELGSA-N 1 0 283.371 3.739 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCCCC1(F)F)c1ccccc1O ZINC000296443377 1129222390 /nfs/dbraw/zinc/22/23/90/1129222390.db2.gz ZQTLIROAQIFPBA-NWDGAFQWSA-N 1 0 269.335 3.868 20 10 CHCDRO CSC(C)(C)C[C@H](C)[N@H+](C)Cc1ccccc1O ZINC001258347585 1129232389 /nfs/dbraw/zinc/23/23/89/1129232389.db2.gz XGYSWVBEPDCKJX-LBPRGKRZSA-N 1 0 267.438 3.744 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2ccccc2F)c1 ZINC000037764023 1129266898 /nfs/dbraw/zinc/26/68/98/1129266898.db2.gz AAZYFEFHCYGLKS-NEPJUHHUSA-N 1 0 289.350 3.952 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1ccc(N(C)CC)cc1)[C@H]1CCCO1 ZINC000246496628 1129287593 /nfs/dbraw/zinc/28/75/93/1129287593.db2.gz SGXMGMSAAIOPLD-FHLIZLRMSA-N 1 0 290.451 3.751 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H](C)CCc2cccc(F)c2)c1 ZINC000734510598 1129311419 /nfs/dbraw/zinc/31/14/19/1129311419.db2.gz XYUABSWRGAXNIA-CQSZACIVSA-N 1 0 287.378 3.951 20 10 CHCDRO C[C@H]1SCC[N@H+](Cc2c(O)ccc3ccccc32)[C@H]1C ZINC000735668130 1129355833 /nfs/dbraw/zinc/35/58/33/1129355833.db2.gz POLZXCWPNSQWGK-QWHCGFSZSA-N 1 0 287.428 3.871 20 10 CHCDRO C[C@H]1C[C@H]1c1ccc(C[N@H+](C)Cc2ccccc2O)o1 ZINC000091974434 1129376256 /nfs/dbraw/zinc/37/62/56/1129376256.db2.gz QFRVYBNEOQMGLH-SWLSCSKDSA-N 1 0 271.360 3.741 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CCC[C@H]2C2CCC2)c1 ZINC000092781216 1129407279 /nfs/dbraw/zinc/40/72/79/1129407279.db2.gz MWTROSDFHCFESE-INIZCTEOSA-N 1 0 275.392 3.555 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CC2CCC2)cc1F ZINC000740004468 1129409062 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Cc1ccc(O)c(C[N@H+]2C[C@H](C)OC[C@@H]2c2ccccc2)c1 ZINC000093660756 1129427087 /nfs/dbraw/zinc/42/70/87/1129427087.db2.gz SFCNRSSYPWFHJT-MAUKXSAKSA-N 1 0 297.398 3.663 20 10 CHCDRO CCO[C@@H]1C[C@H]([NH2+][C@@H](CC)c2ccccc2O)C12CCC2 ZINC000248894976 1129430696 /nfs/dbraw/zinc/43/06/96/1129430696.db2.gz UPNGIJQUSVSVEX-BHYGNILZSA-N 1 0 289.419 3.781 20 10 CHCDRO C[C@H](Cc1cccs1)[NH2+][C@H](C)c1cc(F)ccc1O ZINC000094617298 1129448487 /nfs/dbraw/zinc/44/84/87/1129448487.db2.gz HLCODAGVIVTZCQ-GHMZBOCLSA-N 1 0 279.380 3.875 20 10 CHCDRO C[C@@H](Cc1cccs1)[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000094617295 1129448565 /nfs/dbraw/zinc/44/85/65/1129448565.db2.gz HLCODAGVIVTZCQ-QWRGUYRKSA-N 1 0 279.380 3.875 20 10 CHCDRO CCOCCC[N@H+](Cc1ccccc1O)C1CCCC1 ZINC000741784111 1129452887 /nfs/dbraw/zinc/45/28/87/1129452887.db2.gz GPYIMLRKIMQNGZ-UHFFFAOYSA-N 1 0 277.408 3.563 20 10 CHCDRO Cc1cccc(F)c1C[NH2+]Cc1c(O)cccc1Cl ZINC000742381038 1129473113 /nfs/dbraw/zinc/47/31/13/1129473113.db2.gz NKGINAWQHWYCSA-UHFFFAOYSA-N 1 0 279.742 3.783 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCS[C@@H](C(C)C)C2)cc1C ZINC000743400084 1129522033 /nfs/dbraw/zinc/52/20/33/1129522033.db2.gz QOIYSKZGEFIFTN-MRXNPFEDSA-N 1 0 279.449 3.582 20 10 CHCDRO CCCc1ccc(C[NH2+]Cc2ccc(N(C)C)cc2)cc1 ZINC000743768024 1129536271 /nfs/dbraw/zinc/53/62/71/1129536271.db2.gz XNWYOYBMDPIBGA-UHFFFAOYSA-N 1 0 282.431 3.995 20 10 CHCDRO CN(C)c1ccc(C[N@H+](CCC2CC2)CC2CC2)cc1 ZINC000743847699 1129538910 /nfs/dbraw/zinc/53/89/10/1129538910.db2.gz GLQIXULBSYKMHA-UHFFFAOYSA-N 1 0 272.436 3.765 20 10 CHCDRO CCC[N@@H+](Cc1ccccc1O)C[C@H]1CC1(Cl)Cl ZINC000743869855 1129541894 /nfs/dbraw/zinc/54/18/94/1129541894.db2.gz CODHIQIETJJYJE-GFCCVEGCSA-N 1 0 288.218 3.798 20 10 CHCDRO CC[C@@H](C)[N@H+](C)Cc1ccc(N2CCC(OC)CC2)cc1 ZINC000828273139 1131381469 /nfs/dbraw/zinc/38/14/69/1131381469.db2.gz IADNUJSYFGDYPP-OAHLLOKOSA-N 1 0 290.451 3.532 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CC[C@@H](C)CC1)c1cc(F)ccc1O ZINC000252814284 1129598016 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CCO[C@H](CC[NH2+][C@@H](C)c1ccc(N(C)C)cc1)C(C)C ZINC000766387513 1129663809 /nfs/dbraw/zinc/66/38/09/1129663809.db2.gz HEKBJFOPIPJVLB-MAUKXSAKSA-N 1 0 292.467 3.854 20 10 CHCDRO CC[N@@H+](Cc1cc(C(C)C)c(C)cc1O)C[C@H]1CCOC1 ZINC000738082189 1129665272 /nfs/dbraw/zinc/66/52/72/1129665272.db2.gz PFFFNAVOGXWGMP-OAHLLOKOSA-N 1 0 291.435 3.682 20 10 CHCDRO C[C@@H](C[NH2+][C@H](C)c1ccc(N(C)C)cc1)c1ccncc1 ZINC000766490984 1129669480 /nfs/dbraw/zinc/66/94/80/1129669480.db2.gz XMFNFMVDBYKEKB-LSDHHAIUSA-N 1 0 283.419 3.602 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cc(C)ccc2F)c1 ZINC000828681688 1131396124 /nfs/dbraw/zinc/39/61/24/1131396124.db2.gz FRZLUEFFWKZSGU-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO Oc1cc(Br)ccc1C[NH2+]C1CCCCC1 ZINC000691426863 1129754041 /nfs/dbraw/zinc/75/40/41/1129754041.db2.gz LXTAGUWAMMAQLS-UHFFFAOYSA-N 1 0 284.197 3.577 20 10 CHCDRO C[C@H]1CC[C@@H]1[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000796525768 1129772871 /nfs/dbraw/zinc/77/28/71/1129772871.db2.gz FVDPHERHQKOKLB-GUYCJALGSA-N 1 0 267.372 3.947 20 10 CHCDRO CC/C=C\CC[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1 ZINC000767339063 1129785769 /nfs/dbraw/zinc/78/57/69/1129785769.db2.gz SGVLVEAGZAFALP-AWFCHZOYSA-N 1 0 288.435 3.530 20 10 CHCDRO Oc1cc(Br)ccc1C[NH2+]C1CC2(CCC2)C1 ZINC000691441849 1129787467 /nfs/dbraw/zinc/78/74/67/1129787467.db2.gz BORBAGVEIOCUPB-UHFFFAOYSA-N 1 0 296.208 3.577 20 10 CHCDRO CCC[C@@H](C)[C@H]1CCC[N@@H+]1Cc1cc2c(cc1O)OCO2 ZINC000767763303 1129813112 /nfs/dbraw/zinc/81/31/12/1129813112.db2.gz LKDVNYCTUQFQIN-TZMCWYRMSA-N 1 0 291.391 3.522 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC3CCC2CC3)c1 ZINC000380548649 1129831492 /nfs/dbraw/zinc/83/14/92/1129831492.db2.gz XFWYCTMLDOARAU-PIISCBOPSA-N 1 0 275.392 3.630 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]Cc2cc(C)cs2)c1O ZINC000380841115 1129833178 /nfs/dbraw/zinc/83/31/78/1129833178.db2.gz XSZYOWWMDHMESE-UHFFFAOYSA-N 1 0 297.807 3.714 20 10 CHCDRO CCOc1ccc(C[NH+]2CCCCCCC2)c(O)c1 ZINC000768142331 1129833236 /nfs/dbraw/zinc/83/32/36/1129833236.db2.gz AYQODHSUTVEFIC-UHFFFAOYSA-N 1 0 263.381 3.557 20 10 CHCDRO Cc1cscc1C[NH2+][C@H]1CCc2cccc(O)c21 ZINC000381000622 1129834665 /nfs/dbraw/zinc/83/46/65/1129834665.db2.gz IAGMHNBEYFPVLP-ZDUSSCGKSA-N 1 0 259.374 3.539 20 10 CHCDRO CC[N@H+](Cc1ccc(C)o1)Cc1ccc(N(C)C)cc1 ZINC000768134895 1129835207 /nfs/dbraw/zinc/83/52/07/1129835207.db2.gz XGWMIGZHDHJHKF-UHFFFAOYSA-N 1 0 272.392 3.676 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCC(F)(F)C2)c(O)c1 ZINC000381322874 1129837051 /nfs/dbraw/zinc/83/70/51/1129837051.db2.gz GLHXQOAXZUCJOW-MNOVXSKESA-N 1 0 255.308 3.539 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](C)Cc2ccc(C)cc2)c1 ZINC000768172993 1129839338 /nfs/dbraw/zinc/83/93/38/1129839338.db2.gz SPOMNHFHKJPUMQ-UHFFFAOYSA-N 1 0 285.387 3.731 20 10 CHCDRO COc1cccc(O)c1C[N@@H+]1CCC[C@H]1c1cccs1 ZINC000768194816 1129842064 /nfs/dbraw/zinc/84/20/64/1129842064.db2.gz FFHNPVKEOBHAGR-ZDUSSCGKSA-N 1 0 289.400 3.799 20 10 CHCDRO COc1cccc(C[N@H+]2Cc3ccccc3[C@@H](C)C2)c1O ZINC000768196645 1129842722 /nfs/dbraw/zinc/84/27/22/1129842722.db2.gz SYVVCJYNWFVBRG-ZDUSSCGKSA-N 1 0 283.371 3.520 20 10 CHCDRO Cc1cccc(CC[NH2+][C@@H](C)c2ccc(C)c(C)c2O)n1 ZINC000280245583 1129845156 /nfs/dbraw/zinc/84/51/56/1129845156.db2.gz WGYGFIUSASCTJX-HNNXBMFYSA-N 1 0 284.403 3.606 20 10 CHCDRO c1cc(N2CCCCC2)ccc1C[NH+]1C2CCC1CC2 ZINC000768229946 1129845690 /nfs/dbraw/zinc/84/56/90/1129845690.db2.gz OXYVZFQFAFZJNJ-UHFFFAOYSA-N 1 0 270.420 3.804 20 10 CHCDRO COc1ccccc1C[N@H+](Cc1cc(C)ccc1O)C1CC1 ZINC000768253039 1129847496 /nfs/dbraw/zinc/84/74/96/1129847496.db2.gz WKMQARRSTFFAMT-UHFFFAOYSA-N 1 0 297.398 3.874 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2cc(C)c(C)cc2O)o1 ZINC000119654105 1129848745 /nfs/dbraw/zinc/84/87/45/1129848745.db2.gz NVBDZKBFAAORKS-UHFFFAOYSA-N 1 0 259.349 3.542 20 10 CHCDRO CCC(CC)C[N@H+](CC)Cc1cc(OC)c(OC)cc1O ZINC000768440232 1129855933 /nfs/dbraw/zinc/85/59/33/1129855933.db2.gz UPOCNFOBHOQLGV-UHFFFAOYSA-N 1 0 295.423 3.668 20 10 CHCDRO COc1cc(C[N@@H+]2Cc3ccccc3C[C@@H]2C)c(O)cc1C ZINC000768466145 1129859503 /nfs/dbraw/zinc/85/95/03/1129859503.db2.gz MUJWQBHYXNJMPQ-AWEZNQCLSA-N 1 0 297.398 3.656 20 10 CHCDRO COC[C@H]1CCCC[N@H+](Cc2cc(Cl)cc(C)c2O)C1 ZINC000768541519 1129862033 /nfs/dbraw/zinc/86/20/33/1129862033.db2.gz ORSHMNSCFTWTLP-ZDUSSCGKSA-N 1 0 297.826 3.603 20 10 CHCDRO Cc1nc([C@H](C)[NH2+]CCCSc2nccs2)cs1 ZINC000772864541 1131402750 /nfs/dbraw/zinc/40/27/50/1131402750.db2.gz LJZQCLLOXGTABK-VIFPVBQESA-N 1 0 299.490 3.741 20 10 CHCDRO Cc1cc(C[NH2+][C@H](C)c2cn[nH]c2)ccc1N1CCCCC1 ZINC000828858060 1131402822 /nfs/dbraw/zinc/40/28/22/1131402822.db2.gz NAGCINMYODVGLY-OAHLLOKOSA-N 1 0 298.434 3.559 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C2(C)Cc3ccccc3C2)cc1F ZINC000768661649 1129867322 /nfs/dbraw/zinc/86/73/22/1129867322.db2.gz JLAKMCXVTDNTSJ-UHFFFAOYSA-N 1 0 298.405 3.539 20 10 CHCDRO CC[N@H+](CCc1cccs1)Cc1c(O)cccc1OC ZINC000768760890 1129870143 /nfs/dbraw/zinc/87/01/43/1129870143.db2.gz SAHCYGMHFJICGU-UHFFFAOYSA-N 1 0 291.416 3.527 20 10 CHCDRO COc1cccc(C[N@@H+]2CC[C@H](C)[C@@H]3CCCC[C@H]32)c1O ZINC000768848455 1129876872 /nfs/dbraw/zinc/87/68/72/1129876872.db2.gz CDKSJYFAYYXNLN-CWRNSKLLSA-N 1 0 289.419 3.801 20 10 CHCDRO CC[C@@H]([NH2+]CC1(COC)CCC1)c1cc(Cl)ccc1O ZINC000800493072 1129879477 /nfs/dbraw/zinc/87/94/77/1129879477.db2.gz ILCUCHXHYZYJAT-CQSZACIVSA-N 1 0 297.826 3.903 20 10 CHCDRO CCSCCC[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000800492124 1129879824 /nfs/dbraw/zinc/87/98/24/1129879824.db2.gz CAQIFDVUIVGYMQ-SNVBAGLBSA-N 1 0 273.829 3.839 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](CC)[C@@H](C)C(C)C)c1 ZINC000769155202 1129893560 /nfs/dbraw/zinc/89/35/60/1129893560.db2.gz UZINVGDLYYNMAI-ZDUSSCGKSA-N 1 0 265.397 3.657 20 10 CHCDRO COc1cccc(O)c1C[N@H+](C)C[C@H](C)c1ccccc1 ZINC000769317925 1129902043 /nfs/dbraw/zinc/90/20/43/1129902043.db2.gz ATMRIYFECMRIJX-AWEZNQCLSA-N 1 0 285.387 3.636 20 10 CHCDRO Oc1ccc(Br)cc1C[N@@H+]1CCC[C@@H]1C1CC1 ZINC000769328504 1129902202 /nfs/dbraw/zinc/90/22/02/1129902202.db2.gz JBUIZISCSBMMOK-CYBMUJFWSA-N 1 0 296.208 3.529 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](O)c2cc(C)cc(C)c2)c(O)c1 ZINC000800992818 1129902958 /nfs/dbraw/zinc/90/29/58/1129902958.db2.gz TUKXXJYMZOGNIH-BEFAXECRSA-N 1 0 299.414 3.702 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC[C@H](c3cccc(F)c3)C2)c1 ZINC000769337601 1129903467 /nfs/dbraw/zinc/90/34/67/1129903467.db2.gz FXVHSXQKCBDXDF-HNNXBMFYSA-N 1 0 285.362 3.829 20 10 CHCDRO CCOc1cccc(C[N@@H+]2[C@H](C)C[C@@H]3CCCC[C@H]32)c1O ZINC000769404051 1129906706 /nfs/dbraw/zinc/90/67/06/1129906706.db2.gz IGOVIEDRAPVRBZ-IJEWVQPXSA-N 1 0 289.419 3.944 20 10 CHCDRO C[C@H]1COCC[N@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000769458227 1129911920 /nfs/dbraw/zinc/91/19/20/1129911920.db2.gz YXXNXEXMVILISQ-OAHLLOKOSA-N 1 0 297.398 3.528 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2C[C@@H](C)[C@H]2c2ccccc2)c1 ZINC000769541283 1129916044 /nfs/dbraw/zinc/91/60/44/1129916044.db2.gz TXCZYWOCSHVHOP-KUHUBIRLSA-N 1 0 297.398 3.984 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2ccc(N(C)C)cc2)[C@@H]1c1ccccc1 ZINC000769538890 1129916081 /nfs/dbraw/zinc/91/60/81/1129916081.db2.gz GCPRIDMFJDAVNK-BEFAXECRSA-N 1 0 280.415 3.946 20 10 CHCDRO Cc1ccc(O)c(C[N@H+]2C[C@@H](C)[C@@H]2c2ccccc2)c1 ZINC000769541987 1129916579 /nfs/dbraw/zinc/91/65/79/1129916579.db2.gz XXKGMBZWBFCETR-RDTXWAMCSA-N 1 0 267.372 3.894 20 10 CHCDRO CCOc1ccc(C[N@H+](CC)C[C@@H](C)CC)c(O)c1 ZINC000769538790 1129916637 /nfs/dbraw/zinc/91/66/37/1129916637.db2.gz WPKNUUHLVMENBR-ZDUSSCGKSA-N 1 0 265.397 3.659 20 10 CHCDRO CCCC[N@H+](CC[C@@H]1CCCCO1)Cc1ccccc1O ZINC000801594652 1129931224 /nfs/dbraw/zinc/93/12/24/1129931224.db2.gz JFEQLSARJZIKHU-KRWDZBQOSA-N 1 0 291.435 3.954 20 10 CHCDRO CCCC[N@@H+](Cc1ccccc1O)C[C@H]1CCO[C@H](C)C1 ZINC000801594986 1129931270 /nfs/dbraw/zinc/93/12/70/1129931270.db2.gz TVTPTSJYNJEVCU-CVEARBPZSA-N 1 0 291.435 3.809 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CC[C@@H]1c1ccc(Cl)cc1 ZINC000770505369 1129948158 /nfs/dbraw/zinc/94/81/58/1129948158.db2.gz RLXCCXVKKGBTBB-OAHLLOKOSA-N 1 0 273.763 3.993 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CC[C@H]1c1ccc(Cl)cc1 ZINC000770505368 1129948392 /nfs/dbraw/zinc/94/83/92/1129948392.db2.gz RLXCCXVKKGBTBB-HNNXBMFYSA-N 1 0 273.763 3.993 20 10 CHCDRO Cc1ccncc1[C@@H](C)[NH2+]Cc1cc(Cl)ccc1O ZINC000770747703 1129958153 /nfs/dbraw/zinc/95/81/53/1129958153.db2.gz CKCYFHJXLPFIFF-LLVKDONJSA-N 1 0 276.767 3.600 20 10 CHCDRO CCc1cccc(C[NH2+]Cc2sccc2C)c1O ZINC000691491476 1129976779 /nfs/dbraw/zinc/97/67/79/1129976779.db2.gz CQANECFOMPADAZ-UHFFFAOYSA-N 1 0 261.390 3.614 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccccc1O)[C@@H]1C[C@H]1c1ccccc1 ZINC000802302782 1129990722 /nfs/dbraw/zinc/99/07/22/1129990722.db2.gz SCPXJYJYZXHVIJ-COXVUDFISA-N 1 0 267.372 3.674 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CC[C@@H]2c2ccccc2)cc1 ZINC000771937339 1129997298 /nfs/dbraw/zinc/99/72/98/1129997298.db2.gz ASSSDRHKOURLNT-GOSISDBHSA-N 1 0 266.388 3.700 20 10 CHCDRO COc1cccc(C[N@H+](C)[C@H](C)C2CCCCC2)c1O ZINC000802658900 1130027924 /nfs/dbraw/zinc/02/79/24/1130027924.db2.gz KYRPGKSZSYYJNP-CYBMUJFWSA-N 1 0 277.408 3.801 20 10 CHCDRO COc1cccc(C[NH2+]CC[C@H](C)CC(C)(C)C)c1O ZINC000785554966 1130039938 /nfs/dbraw/zinc/03/99/38/1130039938.db2.gz RQAKSJYIRNHEGO-ZDUSSCGKSA-N 1 0 279.424 3.953 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]Cc1cccc2cc[nH]c21 ZINC000786160151 1130080823 /nfs/dbraw/zinc/08/08/23/1130080823.db2.gz FIECYCALPRHMRC-UHFFFAOYSA-N 1 0 286.762 3.817 20 10 CHCDRO COc1ccc(C[NH2+]CCc2cc(C)c(O)c(C)c2)cc1C ZINC000786826201 1130117376 /nfs/dbraw/zinc/11/73/76/1130117376.db2.gz CTZBFTAZMZOCNG-UHFFFAOYSA-N 1 0 299.414 3.658 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2cnn(CC3CCC3)c2)c1 ZINC000903240132 1130133794 /nfs/dbraw/zinc/13/37/94/1130133794.db2.gz PDNOMDJCGKTWOB-AWEZNQCLSA-N 1 0 299.418 3.548 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1ccc2c(c1)CCO2 ZINC000903235237 1130134316 /nfs/dbraw/zinc/13/43/16/1130134316.db2.gz VTSOZLXUAJTAQP-MLGOLLRUSA-N 1 0 295.382 3.665 20 10 CHCDRO Oc1ccccc1C[N@H+](C[C@@H]1CCSC1)C1CCCC1 ZINC000787164768 1130134940 /nfs/dbraw/zinc/13/49/40/1130134940.db2.gz ODEIZMHEJIONNY-AWEZNQCLSA-N 1 0 291.460 3.890 20 10 CHCDRO C[C@@H]([NH2+]CC[C@H]1CCC(C)(C)CO1)c1ccccc1O ZINC000903247359 1130136317 /nfs/dbraw/zinc/13/63/17/1130136317.db2.gz UZGCHJRLFYZVDR-ZIAGYGMSSA-N 1 0 277.408 3.638 20 10 CHCDRO C[C@@H]([NH2+]CC[C@@H]1CCCC[C@@H]1O)c1cc(Cl)ccc1O ZINC000903262954 1130139311 /nfs/dbraw/zinc/13/93/11/1130139311.db2.gz HTPSHOLTVUXEBC-XUJVJEKNSA-N 1 0 297.826 3.637 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCOC12CCCCC2)c1ccccc1O ZINC000903274195 1130142551 /nfs/dbraw/zinc/14/25/51/1130142551.db2.gz JPDFFQUFANDSPR-BBRMVZONSA-N 1 0 275.392 3.535 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H]2CCSC(C)(C)C2)c1O ZINC000903280459 1130144289 /nfs/dbraw/zinc/14/42/89/1130144289.db2.gz BORAPIKRJSOJFV-NWDGAFQWSA-N 1 0 295.448 3.726 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)c1cncs1 ZINC000903312136 1130152207 /nfs/dbraw/zinc/15/22/07/1130152207.db2.gz SORDFAGHZXGCKT-DTWKUNHWSA-N 1 0 282.796 3.914 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)C(C)(C)OC)c1ccc(C)cc1O ZINC000903331435 1130157796 /nfs/dbraw/zinc/15/77/96/1130157796.db2.gz NKVFDZSRPHRVEP-TZMCWYRMSA-N 1 0 265.397 3.555 20 10 CHCDRO C[C@@H]([NH2+][C@@H](c1ccccn1)C1CC1)c1ccccc1O ZINC000903337543 1130161335 /nfs/dbraw/zinc/16/13/35/1130161335.db2.gz DUOHKGNOIDCJOT-SJKOYZFVSA-N 1 0 268.360 3.589 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CCOC12CCCC2)c1ccc(C)cc1O ZINC000903387065 1130169806 /nfs/dbraw/zinc/16/98/06/1130169806.db2.gz FUBJOUGOWMTRLJ-WBVHZDCISA-N 1 0 289.419 3.843 20 10 CHCDRO C[C@@H]1C[C@H]1C[N@H+](Cc1ccco1)Cc1ccccc1O ZINC000788444034 1130186957 /nfs/dbraw/zinc/18/69/57/1130186957.db2.gz WOYVJIFKGLJCDY-HIFRSBDPSA-N 1 0 271.360 3.643 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H](C)C(C)(C)OC)cc1F ZINC000788589708 1130196101 /nfs/dbraw/zinc/19/61/01/1130196101.db2.gz CMCUTNGDGFCJDO-CYBMUJFWSA-N 1 0 296.430 3.575 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@H]2CCO[C@H](C(C)C)C2)c(O)c1 ZINC000788652991 1130198389 /nfs/dbraw/zinc/19/83/89/1130198389.db2.gz UREWTZPVQNENES-ZOBUZTSGSA-N 1 0 291.435 3.863 20 10 CHCDRO CC1(C)Nc2ccccc2[C@@H]1[NH2+]Cc1ccc2c(c1)CCO2 ZINC000903947638 1130211200 /nfs/dbraw/zinc/21/12/00/1130211200.db2.gz DAVITLTXOKTTMY-SFHVURJKSA-N 1 0 294.398 3.657 20 10 CHCDRO CCOC[C@H]([NH2+][C@@H](CC)c1ccc(N(C)C)cc1)C(C)C ZINC000788983656 1130222477 /nfs/dbraw/zinc/22/24/77/1130222477.db2.gz FCJYOMHWVNIJEU-ROUUACIJSA-N 1 0 292.467 3.854 20 10 CHCDRO CCOC[C@@H]([NH2+][C@@H](CC)c1ccc(N(C)C)cc1)C(C)C ZINC000788983659 1130222537 /nfs/dbraw/zinc/22/25/37/1130222537.db2.gz FCJYOMHWVNIJEU-ZWKOTPCHSA-N 1 0 292.467 3.854 20 10 CHCDRO CCOC[C@@H]([NH2+][C@@H](C)c1ccc(C)c(C)c1O)C(C)C ZINC000788983676 1130222569 /nfs/dbraw/zinc/22/25/69/1130222569.db2.gz FIRFOXABCMIHIH-GOEBONIOSA-N 1 0 279.424 3.721 20 10 CHCDRO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)C[C@@H]1CC[C@@H](C)O1 ZINC000789310642 1130242557 /nfs/dbraw/zinc/24/25/57/1130242557.db2.gz SYYVFQPQBJRBEG-QAPCUYQASA-N 1 0 290.451 3.531 20 10 CHCDRO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)C[C@H]1CC[C@@H](C)O1 ZINC000789310638 1130242769 /nfs/dbraw/zinc/24/27/69/1130242769.db2.gz SYYVFQPQBJRBEG-CRAIPNDOSA-N 1 0 290.451 3.531 20 10 CHCDRO C[C@@H]1CC[C@@H]([NH2+]Cc2cc3ccccc3cc2O)C1 ZINC001170112114 1130263955 /nfs/dbraw/zinc/26/39/55/1130263955.db2.gz HDRVPHCESCUCOU-MLGOLLRUSA-N 1 0 255.361 3.824 20 10 CHCDRO C[C@H]1CC[C@@H]([NH2+]Cc2cc3ccccc3cc2O)C1 ZINC001170112112 1130264214 /nfs/dbraw/zinc/26/42/14/1130264214.db2.gz HDRVPHCESCUCOU-BLLLJJGKSA-N 1 0 255.361 3.824 20 10 CHCDRO Cc1cccc(C[NH+]2CCC(c3ccco3)CC2)c1O ZINC000826877561 1130303175 /nfs/dbraw/zinc/30/31/75/1130303175.db2.gz IWAHWYCAGCMLLL-UHFFFAOYSA-N 1 0 271.360 3.673 20 10 CHCDRO Oc1ccc(F)cc1C[NH+]1CCC(c2ccco2)CC1 ZINC000826877373 1130303938 /nfs/dbraw/zinc/30/39/38/1130303938.db2.gz FWIDDNOOWFPFNW-UHFFFAOYSA-N 1 0 275.323 3.504 20 10 CHCDRO C[C@@H]1CCSCC[N@@H+]1Cc1cc2c(cc1O)CCCC2 ZINC000790479220 1130315161 /nfs/dbraw/zinc/31/51/61/1130315161.db2.gz DIVCWYCNIGIQCM-CYBMUJFWSA-N 1 0 291.460 3.598 20 10 CHCDRO COCC[N@H+](Cc1cc(C)c(C)cc1O)[C@@H]1CC[C@H](C)C1 ZINC000790475517 1130315493 /nfs/dbraw/zinc/31/54/93/1130315493.db2.gz AQSRXNKESWAGQX-SUMWQHHRSA-N 1 0 291.435 3.646 20 10 CHCDRO C[C@H](C[NH2+]Cc1ccc2c(c1)CCO2)c1ccc(F)cc1 ZINC001649176255 1130320373 /nfs/dbraw/zinc/32/03/73/1130320373.db2.gz ZGWBKUALPNAUQC-CYBMUJFWSA-N 1 0 285.362 3.654 20 10 CHCDRO COCC1([NH2+]Cc2cc(-c3ccccc3)ccc2O)CCC1 ZINC000790652209 1130325755 /nfs/dbraw/zinc/32/57/55/1130325755.db2.gz ICVFRUACKONASB-UHFFFAOYSA-N 1 0 297.398 3.718 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C(C)C)C(C)(C)O)c1cc(Cl)ccc1O ZINC000790702052 1130326509 /nfs/dbraw/zinc/32/65/09/1130326509.db2.gz PYTAELOBBIKBDS-ZFWWWQNUSA-N 1 0 299.842 3.882 20 10 CHCDRO CCOCc1cc(C[NH2+]CCC=C(C)C)ccc1OC ZINC000790990593 1130341954 /nfs/dbraw/zinc/34/19/54/1130341954.db2.gz GYCUJBXHYQFKBT-UHFFFAOYSA-N 1 0 277.408 3.678 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)Cc2cc(C)ccn2)cc1 ZINC000792197990 1130437350 /nfs/dbraw/zinc/43/73/50/1130437350.db2.gz GJSLPIDUPBFXJJ-UHFFFAOYSA-N 1 0 297.446 3.868 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC000792794236 1130498689 /nfs/dbraw/zinc/49/86/89/1130498689.db2.gz XVZVQQOKESSJKN-LLVKDONJSA-N 1 0 286.341 3.613 20 10 CHCDRO CN(C)c1ccc(C[NH2+]CC2(C)CC2)c(C(F)(F)F)c1 ZINC000793001508 1130511531 /nfs/dbraw/zinc/51/15/31/1130511531.db2.gz RWTZJYUCPSCYOL-UHFFFAOYSA-N 1 0 286.341 3.661 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]CCc1cc(F)ccc1F ZINC000747100700 1130517889 /nfs/dbraw/zinc/51/78/89/1130517889.db2.gz OHJZDSVEIKHZGQ-UHFFFAOYSA-N 1 0 297.732 3.656 20 10 CHCDRO C[C@H]1C[N@H+](Cc2c(O)ccc3ccccc32)C[C@@H](C2CC2)O1 ZINC000793214621 1130530975 /nfs/dbraw/zinc/53/09/75/1130530975.db2.gz PPHDCZPPVDQRFJ-DJJJIMSYSA-N 1 0 297.398 3.545 20 10 CHCDRO CN(C)c1ccc(C[NH2+]CCCc2ccccc2F)cc1 ZINC000793346121 1130541563 /nfs/dbraw/zinc/54/15/63/1130541563.db2.gz GTFHKLXCLNLSRL-UHFFFAOYSA-N 1 0 286.394 3.614 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)C2CCC(F)(F)CC2)c(O)c1 ZINC000793390907 1130552158 /nfs/dbraw/zinc/55/21/58/1130552158.db2.gz 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/nfs/dbraw/zinc/68/22/19/1130682219.db2.gz PEPGULUMPWCKII-YOEHRIQHSA-N 1 0 285.362 3.957 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2cccc(-c3ccccc3)c2O)[C@H](C)CO1 ZINC001234999507 1130699859 /nfs/dbraw/zinc/69/98/59/1130699859.db2.gz WEMQCZQAVLEXNS-HUUCEWRRSA-N 1 0 297.398 3.668 20 10 CHCDRO CC(C)[N@H+](C)Cc1cccc(-c2ccccc2)c1O ZINC001234993220 1130700511 /nfs/dbraw/zinc/70/05/11/1130700511.db2.gz XFHDOTAQSNNUDM-UHFFFAOYSA-N 1 0 255.361 3.899 20 10 CHCDRO CSCC[N@H+](C)Cc1cccc(-c2ccccc2)c1O ZINC001234999376 1130701510 /nfs/dbraw/zinc/70/15/10/1130701510.db2.gz UWYZEBJBDZBZSQ-UHFFFAOYSA-N 1 0 287.428 3.854 20 10 CHCDRO C=Cc1ccc(CC[NH2+][C@H](C)c2ccccc2O)cc1 ZINC000812733869 1130710072 /nfs/dbraw/zinc/71/00/72/1130710072.db2.gz COIPANGHZAHWDC-CQSZACIVSA-N 1 0 267.372 3.929 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc2cnn(C)c2c1)c1ccccc1O ZINC000812738551 1130710346 /nfs/dbraw/zinc/71/03/46/1130710346.db2.gz VROPYGGCBGQBDX-INIZCTEOSA-N 1 0 295.386 3.520 20 10 CHCDRO CCc1cccc(C[NH2+][C@@H]2CCC[C@H](SC)C2)c1O 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CCc1ccc(C[N@H+](C)Cc2nc3ccccc3o2)c(O)c1 ZINC001236791837 1131010103 /nfs/dbraw/zinc/01/01/03/1131010103.db2.gz MJLZNFUEQBJDNZ-UHFFFAOYSA-N 1 0 296.370 3.728 20 10 CHCDRO COc1cc(O)c(C[NH+]2CCCCCCC2)c(Cl)c1 ZINC001236804790 1131010599 /nfs/dbraw/zinc/01/05/99/1131010599.db2.gz ZOGAIVXRJGBJLF-UHFFFAOYSA-N 1 0 283.799 3.820 20 10 CHCDRO COc1cc(C)c(C[N@@H+]2CCC[C@H]3CCCC[C@H]32)c(O)c1 ZINC001236811646 1131010612 /nfs/dbraw/zinc/01/06/12/1131010612.db2.gz UQHPHSDXTQZLPG-RHSMWYFYSA-N 1 0 289.419 3.864 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CCC[C@H]2C(C)C)c(Cl)c1 ZINC001236808620 1131011121 /nfs/dbraw/zinc/01/11/21/1131011121.db2.gz QBTCXMKYKGWCTJ-AWEZNQCLSA-N 1 0 283.799 3.675 20 10 CHCDRO COc1cc(C)c(C[N@@H+]2CC[C@H](C)C(F)(F)CC2)c(O)c1 ZINC001236808101 1131011932 /nfs/dbraw/zinc/01/19/32/1131011932.db2.gz MILJZUPAHZFALX-LBPRGKRZSA-N 1 0 299.361 3.576 20 10 CHCDRO CC[C@H]1CCCC[N@@H+]1Cc1c(O)cc(OC)cc1Cl ZINC001236804789 1131012700 /nfs/dbraw/zinc/01/27/00/1131012700.db2.gz 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CCC[N@H+](CC)Cc1ccc(OCC(F)(F)F)cc1O ZINC001237050564 1131040470 /nfs/dbraw/zinc/04/04/70/1131040470.db2.gz CKJYSTLBSFQWEC-UHFFFAOYSA-N 1 0 291.313 3.565 20 10 CHCDRO CO[C@@H]1CC[N@H+](Cc2ccc(C(C)C)cc2O)[C@@H](C)C1 ZINC001237051518 1131040606 /nfs/dbraw/zinc/04/06/06/1131040606.db2.gz MKYPJHDSPMRPIK-XJKSGUPXSA-N 1 0 277.408 3.515 20 10 CHCDRO CC(C)c1ccc(C[N@H+](C)C[C@H]2CC2(C)C)c(O)c1 ZINC001237050205 1131041447 /nfs/dbraw/zinc/04/14/47/1131041447.db2.gz YTNFIDLPGGLUPX-OAHLLOKOSA-N 1 0 261.409 3.994 20 10 CHCDRO CC(C)c1ccc(C[N@@H+]2CCC[C@@](C)(CO)CC2)c(O)c1 ZINC001237044836 1131041867 /nfs/dbraw/zinc/04/18/67/1131041867.db2.gz DYCVPOQZQLHHQQ-GOSISDBHSA-N 1 0 291.435 3.500 20 10 CHCDRO CC[C@H](C)[N@H+](C)Cc1ccc(OCC(F)(F)F)cc1O ZINC001237052240 1131042348 /nfs/dbraw/zinc/04/23/48/1131042348.db2.gz REPNKUKHFPFPJW-JTQLQIEISA-N 1 0 291.313 3.564 20 10 CHCDRO C[C@@]1(CF)CC[N@H+](Cc2cc(C(F)(F)F)ccc2O)C1 ZINC001237135526 1131054574 /nfs/dbraw/zinc/05/45/74/1131054574.db2.gz 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/nfs/dbraw/zinc/10/37/13/1131103713.db2.gz FOBFEHVRASBDGG-UHFFFAOYSA-N 1 0 257.736 3.559 20 10 CHCDRO C[C@H]1CC[N@H+](Cc2ccc3ccccc3c2O)[C@H]1C ZINC000816520448 1131101743 /nfs/dbraw/zinc/10/17/43/1131101743.db2.gz PRZBPLSCZLNKTC-STQMWFEESA-N 1 0 255.361 3.776 20 10 CHCDRO Oc1c(C[NH2+]CCOc2ccccc2)ccc2ccccc21 ZINC000816529533 1131103220 /nfs/dbraw/zinc/10/32/20/1131103220.db2.gz WJYGFUFBEZNMQM-UHFFFAOYSA-N 1 0 293.366 3.714 20 10 CHCDRO CC1=CC[N@H+](Cc2ccc3ccccc3c2O)CC1 ZINC000816513383 1131103514 /nfs/dbraw/zinc/10/35/14/1131103514.db2.gz OWILFWJYZFWLGR-UHFFFAOYSA-N 1 0 253.345 3.697 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+]1CC[C@H](c2cccc(F)c2)C1 ZINC001237486682 1131103726 /nfs/dbraw/zinc/10/37/26/1131103726.db2.gz BLENNIGVFXBISO-HNNXBMFYSA-N 1 0 285.362 3.829 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+]1CC[C@H](Cc2ccccc2)C1 ZINC001237490643 1131104013 /nfs/dbraw/zinc/10/40/13/1131104013.db2.gz YNOPNAOEMGDVNV-QGZVFWFLSA-N 1 0 281.399 3.765 20 10 CHCDRO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2c(C)cccc2O)cn1 ZINC001237492546 1131104278 /nfs/dbraw/zinc/10/42/78/1131104278.db2.gz SFSCDCJUVIFVRQ-KRWDZBQOSA-N 1 0 282.387 3.741 20 10 CHCDRO COc1ccc([C@H](C)[N@H+](C)Cc2c(C)cccc2O)cc1 ZINC001237487370 1131105007 /nfs/dbraw/zinc/10/50/07/1131105007.db2.gz IFRYMNGHPBAQLB-AWEZNQCLSA-N 1 0 285.387 3.902 20 10 CHCDRO Cc1nc(C[NH2+]Cc2ccc3ccccc3c2O)cs1 ZINC000816531861 1131105246 /nfs/dbraw/zinc/10/52/46/1131105246.db2.gz IRXQGHLQBRLFGP-UHFFFAOYSA-N 1 0 284.384 3.600 20 10 CHCDRO Cc1ncc(C[NH2+]Cc2ccc3ccccc3c2O)s1 ZINC000816548979 1131106516 /nfs/dbraw/zinc/10/65/16/1131106516.db2.gz ZHTOSOHSQVYWOT-UHFFFAOYSA-N 1 0 284.384 3.600 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CC[C@@H](OC)C[C@H]2C)cc1 ZINC000799736020 1131106866 /nfs/dbraw/zinc/10/68/66/1131106866.db2.gz GFPGFAOIPBXYJH-CRAIPNDOSA-N 1 0 290.451 3.532 20 10 CHCDRO CSC(C)(C)C[NH2+]Cc1ccc2ccccc2c1O ZINC000816553671 1131109506 /nfs/dbraw/zinc/10/95/06/1131109506.db2.gz CYBBDNBFPRGIGA-UHFFFAOYSA-N 1 0 275.417 3.777 20 10 CHCDRO Oc1c(C[NH2+]CCCC(F)(F)F)ccc2ccccc21 ZINC000816554370 1131109705 /nfs/dbraw/zinc/10/97/05/1131109705.db2.gz WVUVTUNGCSTNQV-UHFFFAOYSA-N 1 0 283.293 3.978 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2ccc3ccccc3c2O)C[C@@H](C2CC2)O1 ZINC000816594516 1131109935 /nfs/dbraw/zinc/10/99/35/1131109935.db2.gz HBVIFPMINIQMRZ-ACJLOTCBSA-N 1 0 297.398 3.545 20 10 CHCDRO CC(C)[C@@H]1C[C@H]([NH2+]Cc2ccc3ccccc3c2O)CCO1 ZINC000816560171 1131110814 /nfs/dbraw/zinc/11/08/14/1131110814.db2.gz HAYDLNSLEJPZIY-AEFFLSMTSA-N 1 0 299.414 3.839 20 10 CHCDRO C[N@@H+](Cc1ccc2ccccc2c1O)C[C@H]1CCCC[C@H]1O ZINC000816564942 1131110915 /nfs/dbraw/zinc/11/09/15/1131110915.db2.gz WCUYSYDAZVUTQY-CRAIPNDOSA-N 1 0 299.414 3.528 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CCCC23CCCC3)c(O)c1 ZINC000816597257 1131114890 /nfs/dbraw/zinc/11/48/90/1131114890.db2.gz KZRUTJWPKVSFSW-MRXNPFEDSA-N 1 0 275.392 3.603 20 10 CHCDRO CC(C)(C)[C@H]1C[N@H+](Cc2ccc3ccccc3c2O)CCO1 ZINC000816594837 1131115104 /nfs/dbraw/zinc/11/51/04/1131115104.db2.gz QEMKWTAWYGLIBQ-QGZVFWFLSA-N 1 0 299.414 3.792 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]C[C@H](c1ccccc1)C1CC1 ZINC000816619176 1131116529 /nfs/dbraw/zinc/11/65/29/1131116529.db2.gz VOYRCSAZSVGZEG-QGZVFWFLSA-N 1 0 285.362 3.815 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](C)C2CC(C)C2)cc1Br ZINC001237676092 1131126376 /nfs/dbraw/zinc/12/63/76/1131126376.db2.gz FABVNQLKUNEJAI-UHFFFAOYSA-N 1 0 298.224 3.693 20 10 CHCDRO CCC[N@@H+](Cc1ccc(N2CCCC2)cc1)CC1CC1 ZINC001116322475 1131140285 /nfs/dbraw/zinc/14/02/85/1131140285.db2.gz GWGMFOSWGHUPJE-UHFFFAOYSA-N 1 0 272.436 3.909 20 10 CHCDRO C[C@H]([NH2+]C1(C)CC1)c1ccc(N2CCCCC2)cc1 ZINC001116494761 1131151090 /nfs/dbraw/zinc/15/10/90/1131151090.db2.gz JJMSXSJJYDNADM-AWEZNQCLSA-N 1 0 258.409 3.880 20 10 CHCDRO C[C@H]1CCC[N@H+](Cc2cc(F)c(Cl)cc2[O-])[C@H]1C ZINC001237937056 1131154189 /nfs/dbraw/zinc/15/41/89/1131154189.db2.gz NKHBIQXXYIQTRT-UWVGGRQHSA-N 1 0 271.763 3.805 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCc2ccc(N(C)C)cc2)c1 ZINC001116564961 1131155466 /nfs/dbraw/zinc/15/54/66/1131155466.db2.gz CDPCWLWLYFRWIH-HNNXBMFYSA-N 1 0 298.430 3.660 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CC(C)(C)C2(C)C)c1O ZINC001116583745 1131155601 /nfs/dbraw/zinc/15/56/01/1131155601.db2.gz PRLDFQHLZXFSOQ-UHFFFAOYSA-N 1 0 283.799 3.675 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCC[C@H](CC(F)(F)F)C2)c1O ZINC000817413400 1131160385 /nfs/dbraw/zinc/16/03/85/1131160385.db2.gz XJHAFOHFYARZPC-GFCCVEGCSA-N 1 0 287.325 3.865 20 10 CHCDRO CCC[N@H+](Cc1cc(F)cc(C)c1O)[C@H](C)CC ZINC001238056218 1131164973 /nfs/dbraw/zinc/16/49/73/1131164973.db2.gz FUEJGUPMEQNRRJ-GFCCVEGCSA-N 1 0 253.361 3.850 20 10 CHCDRO Cc1cc(F)cc(C[N@@H+]2CCc3c(C)cccc3C2)c1O ZINC001238056146 1131165511 /nfs/dbraw/zinc/16/55/11/1131165511.db2.gz DXDHUAHLZGLYBJ-UHFFFAOYSA-N 1 0 285.362 3.706 20 10 CHCDRO COc1cccc(C[NH2+]C(C)(C)C2CCCCC2)c1O ZINC001116840541 1131166350 /nfs/dbraw/zinc/16/63/50/1131166350.db2.gz YRMLIQRPLXAWCU-UHFFFAOYSA-N 1 0 277.408 3.849 20 10 CHCDRO Cc1cc(F)cc(C[NH+]2CCC3(CCC3)CC2)c1O ZINC001238063748 1131167074 /nfs/dbraw/zinc/16/70/74/1131167074.db2.gz LXUJBJZYURVPHL-UHFFFAOYSA-N 1 0 263.356 3.606 20 10 CHCDRO Cc1cc(F)cc(C[N@H+](Cc2ccco2)C2CC2)c1O ZINC001238071157 1131168600 /nfs/dbraw/zinc/16/86/00/1131168600.db2.gz UPKXQUWEXLTDET-UHFFFAOYSA-N 1 0 275.323 3.597 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2cc(C)nc(C)c2)c(O)c1 ZINC000817590187 1131174711 /nfs/dbraw/zinc/17/47/11/1131174711.db2.gz VVYICWUHLTWWPR-OAHLLOKOSA-N 1 0 284.403 3.872 20 10 CHCDRO CCN(Cc1ccccc1O)Cc1c(F)ccnc1Cl ZINC001238232012 1131185907 /nfs/dbraw/zinc/18/59/07/1131185907.db2.gz CMSQPIVGRLVFQE-UHFFFAOYSA-N 1 0 294.757 3.602 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccc(N)cc1)c1ccc(F)cc1F ZINC000817955485 1131190287 /nfs/dbraw/zinc/19/02/87/1131190287.db2.gz BWXSHQVJFAVUHS-QGZVFWFLSA-N 1 0 290.357 3.830 20 10 CHCDRO CC(C)[C@H]1CCCC[C@H]1[NH2+]CCc1ccc(N)cc1 ZINC000817955989 1131190533 /nfs/dbraw/zinc/19/05/33/1131190533.db2.gz MYZWCXYMBYBJJR-IAGOWNOFSA-N 1 0 260.425 3.616 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccc(N)cc1)c1ccc(C)cc1 ZINC000817955422 1131190591 /nfs/dbraw/zinc/19/05/91/1131190591.db2.gz AJOBCNHOBWBMTE-SFHVURJKSA-N 1 0 268.404 3.861 20 10 CHCDRO CC(C)c1ccc([C@@H](N)C[NH2+][C@@H](C)c2ccccc2O)cc1 ZINC000817953404 1131190661 /nfs/dbraw/zinc/19/06/61/1131190661.db2.gz MXSDVMPWIABDOC-KSSFIOAISA-N 1 0 298.430 3.866 20 10 CHCDRO C[C@H]([NH2+]CCc1ccc(N)cc1)c1cc2c(s1)CCC2 ZINC000817955447 1131190680 /nfs/dbraw/zinc/19/06/80/1131190680.db2.gz BCXGEWOZAOUIJV-LBPRGKRZSA-N 1 0 286.444 3.712 20 10 CHCDRO Cc1cc([C@@H](C)[NH2+]CCc2ccc(N)cc2)c(C)s1 ZINC000817955883 1131190731 /nfs/dbraw/zinc/19/07/31/1131190731.db2.gz KDXZRXOUFFGKSC-GFCCVEGCSA-N 1 0 274.433 3.840 20 10 CHCDRO Cc1ccc2c(c1)[C@H]([NH2+]CCc1ccc(N)cc1)[C@@H](C)C2 ZINC000817958526 1131191108 /nfs/dbraw/zinc/19/11/08/1131191108.db2.gz WRPYGDGZZADKQW-IFXJQAMLSA-N 1 0 280.415 3.643 20 10 CHCDRO CC1(C)[C@H]([NH2+]CCc2ccc(N)cc2)C[C@@H]1c1ccccc1 ZINC000817956962 1131191202 /nfs/dbraw/zinc/19/12/02/1131191202.db2.gz GLLIRRKXLLEOEO-RTBURBONSA-N 1 0 294.442 3.983 20 10 CHCDRO Nc1ccc(CC[NH2+][C@@H]2CCCC23CCCCC3)cc1 ZINC000817956989 1131191212 /nfs/dbraw/zinc/19/12/12/1131191212.db2.gz GXUBZLLJAPTVCE-QGZVFWFLSA-N 1 0 272.436 3.904 20 10 CHCDRO Cc1cc(F)ccc1[C@@H](C)[NH2+]CCc1ccc(N)cc1 ZINC000817958186 1131191591 /nfs/dbraw/zinc/19/15/91/1131191591.db2.gz SSVFKHOWMNKAQY-CYBMUJFWSA-N 1 0 272.367 3.610 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2cccc3c2CCCN3)c1 ZINC000817976059 1131193953 /nfs/dbraw/zinc/19/39/53/1131193953.db2.gz USHYKWWJKZWJDJ-CQSZACIVSA-N 1 0 296.414 3.910 20 10 CHCDRO COc1cc(C[N@H+](C)Cc2ccccc2O)ccc1Cl ZINC001117756392 1131197640 /nfs/dbraw/zinc/19/76/40/1131197640.db2.gz CPPXLCLJFJEWOZ-UHFFFAOYSA-N 1 0 291.778 3.686 20 10 CHCDRO CCn1ccnc1[C@H](C)[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001117831517 1131203692 /nfs/dbraw/zinc/20/36/92/1131203692.db2.gz PGMXPGMBCWMETE-RDBSUJKOSA-N 1 0 299.418 3.816 20 10 CHCDRO CCCC[C@H](C)[NH2+]C[C@@H]1CCN(c2ccc(OC)cc2)C1 ZINC000818344325 1131209863 /nfs/dbraw/zinc/20/98/63/1131209863.db2.gz LDOWUCRAAFSWRE-HOTGVXAUSA-N 1 0 290.451 3.690 20 10 CHCDRO C[C@H]([NH2+][C@@H]1C[C@H]1C1CCC1)c1ccc(N(C)C)cc1 ZINC000818355881 1131210871 /nfs/dbraw/zinc/21/08/71/1131210871.db2.gz KRRHKDCAJJFZAJ-AFAVFJNCSA-N 1 0 258.409 3.592 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]Cc2ccc3c(c2)CCC3)c1O ZINC001118246061 1131216337 /nfs/dbraw/zinc/21/63/37/1131216337.db2.gz MHCIYIZQIAWSJS-ZDUSSCGKSA-N 1 0 297.398 3.740 20 10 CHCDRO Cc1cc(CN2CCCC(=O)CC2)c(C)n1-c1ccccc1 ZINC001137856095 1131424107 /nfs/dbraw/zinc/42/41/07/1131424107.db2.gz QCTIFVZYGHOMEK-UHFFFAOYSA-N 1 0 296.414 3.649 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)C1CCC(COC)CC1 ZINC000824291686 1131461923 /nfs/dbraw/zinc/46/19/23/1131461923.db2.gz GKZUYNCTZQLYSS-UHFFFAOYSA-N 1 0 290.451 3.567 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)Cc2ccoc2)cc1Cl ZINC000824606680 1131476293 /nfs/dbraw/zinc/47/62/93/1131476293.db2.gz VFXTXZRRTRPFNQ-UHFFFAOYSA-N 1 0 265.740 3.579 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](Cc1ccccc1)OC)c1ccccc1O ZINC000824590759 1131476571 /nfs/dbraw/zinc/47/65/71/1131476571.db2.gz PJDMMTMOMWCRHD-SJLPKXTDSA-N 1 0 299.414 3.691 20 10 CHCDRO Cc1c(C[N@H+](C)Cc2ccccc2O)c2ccccc2n1C ZINC001138258648 1131483600 /nfs/dbraw/zinc/48/36/00/1131483600.db2.gz XNNBSKWLIGMSJA-UHFFFAOYSA-N 1 0 294.398 3.824 20 10 CHCDRO C[C@H]1C[N@H+](Cc2ccc3c(c2)CCCN3C)CCC1(F)F ZINC001138354473 1131493912 /nfs/dbraw/zinc/49/39/12/1131493912.db2.gz LBLOURMGAJOALT-ZDUSSCGKSA-N 1 0 294.389 3.546 20 10 CHCDRO CC(C)[N@@H+](Cc1ccc2c(c1)CCCN2C)CC1CC1 ZINC001138357736 1131494283 /nfs/dbraw/zinc/49/42/83/1131494283.db2.gz IHMZSEDRAXKZAZ-UHFFFAOYSA-N 1 0 272.436 3.689 20 10 CHCDRO Oc1c(C[N@@H+]2CCC[C@]3(CCOC3)C2)ccc2ccccc21 ZINC000825134153 1131499740 /nfs/dbraw/zinc/49/97/40/1131499740.db2.gz WCNPWICGVMIWIQ-IBGZPJMESA-N 1 0 297.398 3.548 20 10 CHCDRO Cc1cccc(Cl)c1C[N@H+](C)Cc1ccccc1O ZINC001138721616 1131541695 /nfs/dbraw/zinc/54/16/95/1131541695.db2.gz BBKNCGYTRVTINY-UHFFFAOYSA-N 1 0 275.779 3.986 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)CCCO2)[C@@H]1CC1(C)C ZINC001202870778 1131555806 /nfs/dbraw/zinc/55/58/06/1131555806.db2.gz WYUVZEHNYMEWAL-JKSUJKDBSA-N 1 0 273.420 3.926 20 10 CHCDRO Cc1cccc2[nH]cc(C[N@@H+]3CCc4cccc(O)c4C3)c21 ZINC001139200500 1131595298 /nfs/dbraw/zinc/59/52/98/1131595298.db2.gz ZFMDVMIRQOECBT-UHFFFAOYSA-N 1 0 292.382 3.740 20 10 CHCDRO Cn1ccc2ccc(C[N@H+](C)Cc3ccccc3O)cc21 ZINC001139206620 1131596685 /nfs/dbraw/zinc/59/66/85/1131596685.db2.gz GZYKKDNMAZMTGA-UHFFFAOYSA-N 1 0 280.371 3.516 20 10 CHCDRO Cc1cc(C[NH+]2CCC3(CCC3)CC2)ccc1N(C)C ZINC001139671181 1131626561 /nfs/dbraw/zinc/62/65/61/1131626561.db2.gz UAXSNAHCIORGKH-UHFFFAOYSA-N 1 0 272.436 3.827 20 10 CHCDRO CC[C@H]1CCC[N@H+](Cc2ccc(N(C)C)c(C)c2)C1 ZINC001139672671 1131626940 /nfs/dbraw/zinc/62/69/40/1131626940.db2.gz AOBBOKDEIPCYPX-HNNXBMFYSA-N 1 0 260.425 3.683 20 10 CHCDRO Cc1cc(C[NH+]2C[C@H](C)C[C@@H](C)C2)ccc1N(C)C ZINC001139673461 1131628080 /nfs/dbraw/zinc/62/80/80/1131628080.db2.gz RTHAWWWQNACBEJ-ZIAGYGMSSA-N 1 0 260.425 3.539 20 10 CHCDRO Cc1cc(C[N@@H+]2CCc3cc(F)ccc3C2)ccc1N(C)C ZINC001139673820 1131628237 /nfs/dbraw/zinc/62/82/37/1131628237.db2.gz LAWLNKOLAVFXBO-UHFFFAOYSA-N 1 0 298.405 3.758 20 10 CHCDRO C[N@H+](Cc1cc(F)ccc1O)C12CC3CC(CC(C3)C1)C2 ZINC001140055173 1131659836 /nfs/dbraw/zinc/65/98/36/1131659836.db2.gz AKGHFFBFUUZFBD-UHFFFAOYSA-N 1 0 289.394 3.932 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CCC[C@H](Cc2ccccc2)C1 ZINC001140055601 1131659880 /nfs/dbraw/zinc/65/98/80/1131659880.db2.gz MISZKXIVVILGOB-MRXNPFEDSA-N 1 0 299.389 3.986 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCC[C@@H]2c2cccnc2)c1O ZINC001140178631 1131672826 /nfs/dbraw/zinc/67/28/26/1131672826.db2.gz RPGXTHYGMPTNRJ-QGZVFWFLSA-N 1 0 282.387 3.741 20 10 CHCDRO Cc1ccc(C)c(C[N@H+]2CCC[C@@H](C)[C@@H](C)C2)c1O ZINC001140178695 1131673367 /nfs/dbraw/zinc/67/33/67/1131673367.db2.gz VBIJPIQVIMKICQ-DOMZBBRYSA-N 1 0 261.409 3.877 20 10 CHCDRO Cc1ccc(C)c(C[N@H+]2CC[C@@H](C)C(F)(F)CC2)c1O ZINC001140178744 1131673573 /nfs/dbraw/zinc/67/35/73/1131673573.db2.gz WILJKHRKXIRXQU-CYBMUJFWSA-N 1 0 283.362 3.876 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccsc2C)c1 ZINC000845973382 1131674521 /nfs/dbraw/zinc/67/45/21/1131674521.db2.gz ZOCPMWNQQJBQTF-SNVBAGLBSA-N 1 0 277.389 3.622 20 10 CHCDRO C[C@@H]1C[C@H]1c1ccc(C[NH2+][C@@H]2CCc3cccc(O)c32)o1 ZINC000834518167 1131680805 /nfs/dbraw/zinc/68/08/05/1131680805.db2.gz DYAWEPAUVMCXLD-KCPJHIHWSA-N 1 0 283.371 3.886 20 10 CHCDRO CC[C@H]([NH2+][C@H](C1CC1)C1CCOCC1)c1ccccc1O ZINC000846042823 1131683822 /nfs/dbraw/zinc/68/38/22/1131683822.db2.gz QHAVSDLFWPIOIY-FUHWJXTLSA-N 1 0 289.419 3.638 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C1CC1)C1CCOCC1)c1ccccc1O ZINC000846042828 1131683920 /nfs/dbraw/zinc/68/39/20/1131683920.db2.gz QHAVSDLFWPIOIY-WMZOPIPTSA-N 1 0 289.419 3.638 20 10 CHCDRO C[C@@H](C[NH2+][C@@H]1CCc2cccc(O)c21)c1ccc(F)cc1 ZINC000834566409 1131684118 /nfs/dbraw/zinc/68/41/18/1131684118.db2.gz MOVKAHZKJXYPHX-BLLLJJGKSA-N 1 0 285.362 3.912 20 10 CHCDRO C[C@H](C[NH2+][C@H]1CCc2cccc(O)c21)c1ccc(F)cc1 ZINC000834566412 1131684185 /nfs/dbraw/zinc/68/41/85/1131684185.db2.gz MOVKAHZKJXYPHX-WBMJQRKESA-N 1 0 285.362 3.912 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2CC[C@@]3(CC3(F)F)C2)c1O ZINC000846118668 1131688057 /nfs/dbraw/zinc/68/80/57/1131688057.db2.gz YIOQPEHLLXWGDM-CYBMUJFWSA-N 1 0 287.737 3.585 20 10 CHCDRO CCOc1ccc(C[NH2+]Cc2cccc(CC)c2)c(O)c1 ZINC000846100685 1131689350 /nfs/dbraw/zinc/68/93/50/1131689350.db2.gz SGXHSCOLYDFIIE-UHFFFAOYSA-N 1 0 285.387 3.643 20 10 CHCDRO COc1cccc(C[C@H](C)[NH2+][C@H]2CCc3cccc(O)c32)c1 ZINC000834646015 1131689949 /nfs/dbraw/zinc/68/99/49/1131689949.db2.gz UEMHDZJZBNLVBQ-GUYCJALGSA-N 1 0 297.398 3.609 20 10 CHCDRO Cc1cccc2c1CC[C@@H]2[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000834641050 1131690321 /nfs/dbraw/zinc/69/03/21/1131690321.db2.gz VSUJHMFLYRQOIP-DLBZAZTESA-N 1 0 279.383 3.965 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]C2CC3(CCC3)C2)cc1 ZINC000846106618 1131691091 /nfs/dbraw/zinc/69/10/91/1131691091.db2.gz GRZIHGZMMBXYEZ-HWKANZROSA-N 1 0 270.420 3.688 20 10 CHCDRO Cc1ccc(CC[NH2+][C@@H]2CCc3cccc(O)c32)cc1 ZINC000834654507 1131691176 /nfs/dbraw/zinc/69/11/76/1131691176.db2.gz OOMVFAMKVFEXTI-MRXNPFEDSA-N 1 0 267.372 3.520 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]C(C(C)C)C(C)C)c1O ZINC000846158043 1131691911 /nfs/dbraw/zinc/69/19/11/1131691911.db2.gz ZKWLIWUTXSCUSK-LBPRGKRZSA-N 1 0 265.397 3.732 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@@H](c2cccnc2)C2CC2)c1O ZINC000846157649 1131691981 /nfs/dbraw/zinc/69/19/81/1131691981.db2.gz NPXGVWZTQZSLSL-SJKOYZFVSA-N 1 0 298.386 3.598 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H](C)CC(C)(C)C)c1O ZINC000846167802 1131693013 /nfs/dbraw/zinc/69/30/13/1131693013.db2.gz DWUCVZMSVUTYCT-NEPJUHHUSA-N 1 0 265.397 3.876 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H](C)CCC2CC2)c1O ZINC000846163855 1131693148 /nfs/dbraw/zinc/69/31/48/1131693148.db2.gz MEJGNSURTLSMJA-RYUDHWBXSA-N 1 0 263.381 3.630 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]C[C@H]2C[C@@H]2c2ccccc2)c1O ZINC000846171773 1131693685 /nfs/dbraw/zinc/69/36/85/1131693685.db2.gz HLQLCSBZRYHPFF-YSVLISHTSA-N 1 0 297.398 3.855 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@@H]2CCc3ccccc3C2)c1O ZINC000846135472 1131693725 /nfs/dbraw/zinc/69/37/25/1131693725.db2.gz CUCDQLPDSOVNNM-CZUORRHYSA-N 1 0 297.398 3.609 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]C[C@H](C)c2ccccc2)c1O ZINC000846138121 1131693966 /nfs/dbraw/zinc/69/39/66/1131693966.db2.gz SVLJNGBWSDTGJY-UONOGXRCSA-N 1 0 285.387 3.855 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]Cc2ccc(Cl)cc2)c1O ZINC000846135543 1131693977 /nfs/dbraw/zinc/69/39/77/1131693977.db2.gz DMORBWTZTUWXOY-NSHDSACASA-N 1 0 291.778 3.905 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]Cc2ccc(C)cc2C)c1O ZINC000846140849 1131694487 /nfs/dbraw/zinc/69/44/87/1131694487.db2.gz GTSLLTKDJNNKDE-CQSZACIVSA-N 1 0 285.387 3.868 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H]2CCC[C@@H](SC)C2)c1O ZINC000846145116 1131694736 /nfs/dbraw/zinc/69/47/36/1131694736.db2.gz MVZSQWKVKJTURR-YNEHKIRRSA-N 1 0 295.448 3.726 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@@H](C)c2cnccc2C)c1O ZINC000846145897 1131694906 /nfs/dbraw/zinc/69/49/06/1131694906.db2.gz DHOPDBBFWHIKDK-OLZOCXBDSA-N 1 0 286.375 3.516 20 10 CHCDRO CCc1ccc(C[NH2+][C@H](C)c2cccc(OC)c2O)s1 ZINC000846140141 1131694988 /nfs/dbraw/zinc/69/49/88/1131694988.db2.gz HGPVAJQSSAFXDI-LLVKDONJSA-N 1 0 291.416 3.876 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H](C2CC2)C2CCOCC2)c1 ZINC000846187592 1131697673 /nfs/dbraw/zinc/69/76/73/1131697673.db2.gz LDWNUOCXJKMDMT-FZKQIMNGSA-N 1 0 289.419 3.556 20 10 CHCDRO CC(C)C[C@@H]1OCCC[C@H]1[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000834769402 1131704677 /nfs/dbraw/zinc/70/46/77/1131704677.db2.gz MPQVSGIBSZBBTC-INMHGKMJSA-N 1 0 289.419 3.563 20 10 CHCDRO C[C@H]([NH2+]CCCC1CCOCC1)c1cc(Cl)ccc1O ZINC000834818757 1131707245 /nfs/dbraw/zinc/70/72/45/1131707245.db2.gz OPBSXOWOSNSBFN-LBPRGKRZSA-N 1 0 297.826 3.903 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2ccnc(C)c2)c(O)c1 ZINC000834859883 1131714148 /nfs/dbraw/zinc/71/41/48/1131714148.db2.gz LGTPCOLAXDKOAO-AWEZNQCLSA-N 1 0 270.376 3.563 20 10 CHCDRO CCC1([NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)CC1 ZINC000834874532 1131714829 /nfs/dbraw/zinc/71/48/29/1131714829.db2.gz FAIQOAVNZSHISH-JTQLQIEISA-N 1 0 253.773 3.947 20 10 CHCDRO CC[C@@H]([NH2+]Cc1nccn1CC)c1cc(Cl)ccc1O ZINC000834878422 1131716404 /nfs/dbraw/zinc/71/64/04/1131716404.db2.gz CPAZVKMYXROWGE-CYBMUJFWSA-N 1 0 293.798 3.503 20 10 CHCDRO CO[C@@H]1CCC[C@H]1[NH2+][C@H](C)c1cc(Cl)cc(C)c1O ZINC000834885859 1131718539 /nfs/dbraw/zinc/71/85/39/1131718539.db2.gz FSEDJXNZFYZVHH-LERXQTSPSA-N 1 0 283.799 3.572 20 10 CHCDRO Cc1ccncc1C[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O ZINC000834886486 1131718884 /nfs/dbraw/zinc/71/88/84/1131718884.db2.gz MODXOJHRXLXEPZ-LBPRGKRZSA-N 1 0 290.794 3.908 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@H]2C[C@@H](C)n3ccnc32)c(O)c1 ZINC000834892117 1131720720 /nfs/dbraw/zinc/72/07/20/1131720720.db2.gz BCFAZLBYYYYQMT-RDBSUJKOSA-N 1 0 285.391 3.562 20 10 CHCDRO CCc1ncc(C[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)o1 ZINC000834900909 1131726055 /nfs/dbraw/zinc/72/60/55/1131726055.db2.gz TVFOOUWLTPOSEZ-JTQLQIEISA-N 1 0 294.782 3.755 20 10 CHCDRO CC[C@@H]([NH2+]CCC1CC(F)(F)C1)c1ccccc1O ZINC000834908152 1131730501 /nfs/dbraw/zinc/73/05/01/1131730501.db2.gz HGHVVCMFAUXEDK-CYBMUJFWSA-N 1 0 269.335 3.868 20 10 CHCDRO CCO[C@@H]1CCC[C@H]1[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O ZINC000834911011 1131732025 /nfs/dbraw/zinc/73/20/25/1131732025.db2.gz HJGVVMUVAQNAAD-NILFDRSVSA-N 1 0 297.826 3.962 20 10 CHCDRO C[N@H+](Cc1ccccc1)Cc1ccc(Cl)cc1O ZINC001140461629 1131746900 /nfs/dbraw/zinc/74/69/00/1131746900.db2.gz NYPMUGZLMBAFNK-UHFFFAOYSA-N 1 0 261.752 3.678 20 10 CHCDRO Cc1cccc2c1CC[N@H+](Cc1ccc(Cl)cc1O)C2 ZINC001140461875 1131748923 /nfs/dbraw/zinc/74/89/23/1131748923.db2.gz WOVYLNDPGSIONE-UHFFFAOYSA-N 1 0 287.790 3.912 20 10 CHCDRO C[N@H+](CCc1ccccc1F)Cc1ccc(Cl)cc1O ZINC001140464456 1131750504 /nfs/dbraw/zinc/75/05/04/1131750504.db2.gz QQZRYDAAWASVJX-UHFFFAOYSA-N 1 0 293.769 3.859 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2ccc(Cl)cc2O)cc1 ZINC001140465995 1131750854 /nfs/dbraw/zinc/75/08/54/1131750854.db2.gz XYGZIWSCOFCZBB-UHFFFAOYSA-N 1 0 275.779 3.986 20 10 CHCDRO Oc1cc(Cl)ccc1C[N@@H+]1CCCC2(CCC2)C1 ZINC001140464318 1131751106 /nfs/dbraw/zinc/75/11/06/1131751106.db2.gz LDJWEXZIIKPJSG-UHFFFAOYSA-N 1 0 265.784 3.812 20 10 CHCDRO Oc1cc(Cl)ccc1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC001140465398 1131751398 /nfs/dbraw/zinc/75/13/98/1131751398.db2.gz LWEBDLVWLCVVOD-HNNXBMFYSA-N 1 0 273.763 3.993 20 10 CHCDRO COc1cccc(C[NH2+]C/C=C\c2ccc(N(C)C)cc2)c1 ZINC000835032718 1131760249 /nfs/dbraw/zinc/76/02/49/1131760249.db2.gz ITGUUZCTCASTBT-ALCCZGGFSA-N 1 0 296.414 3.564 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]CCc2ccsc2)cc1 ZINC000835035140 1131760339 /nfs/dbraw/zinc/76/03/39/1131760339.db2.gz FYCQROGMKRZNHZ-ONEGZZNKSA-N 1 0 286.444 3.660 20 10 CHCDRO C[C@@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)C1(C)CC1 ZINC000835037256 1131761110 /nfs/dbraw/zinc/76/11/10/1131761110.db2.gz PGKVVWHNWCTQFK-VBROQKIQSA-N 1 0 258.409 3.544 20 10 CHCDRO C[C@H](c1ccccn1)[N@H+](C)C/C=C/c1ccc(N(C)C)cc1 ZINC000835043616 1131763076 /nfs/dbraw/zinc/76/30/76/1131763076.db2.gz ADNRAIJETNOKQX-KXPUMZMLSA-N 1 0 295.430 3.854 20 10 CHCDRO C[C@H](c1ccncc1)[N@H+](C)C/C=C/c1ccc(N(C)C)cc1 ZINC000835046973 1131764135 /nfs/dbraw/zinc/76/41/35/1131764135.db2.gz AZQDGUXOEXAWBV-SQRWCISFSA-N 1 0 295.430 3.854 20 10 CHCDRO CC(C)C1([NH2+]C/C=C/c2ccc(N(C)C)cc2)CC1 ZINC000835055452 1131766851 /nfs/dbraw/zinc/76/68/51/1131766851.db2.gz JWRNFBBUSFREQQ-AATRIKPKSA-N 1 0 258.409 3.544 20 10 CHCDRO C[C@H]1CC[C@@H](C[NH2+]Cc2cc(-c3ccccc3)ccc2O)O1 ZINC000835088832 1131770986 /nfs/dbraw/zinc/77/09/86/1131770986.db2.gz VIPOMLSSWNAOCV-KSSFIOAISA-N 1 0 297.398 3.716 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(OC)c(C)c1)[C@H]1CC1(C)C ZINC001171285456 1131798346 /nfs/dbraw/zinc/79/83/46/1131798346.db2.gz AHICEYKJNGFTLC-CABCVRRESA-N 1 0 261.409 3.918 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCCC(F)(F)C1)c1ccccc1O ZINC000282753122 1131893589 /nfs/dbraw/zinc/89/35/89/1131893589.db2.gz NUZSSLRJUNBSIV-RYUDHWBXSA-N 1 0 269.335 3.868 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CCCC(F)(F)C2)c1 ZINC000282786006 1131900531 /nfs/dbraw/zinc/90/05/31/1131900531.db2.gz PVJIKVVCQOGHQM-NEPJUHHUSA-N 1 0 299.361 3.877 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H]2CC=CCC2)cc1 ZINC000772999049 1131911111 /nfs/dbraw/zinc/91/11/11/1131911111.db2.gz HVSIBKLBLDUEKK-ZBFHGGJFSA-N 1 0 258.409 3.902 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]Cc2ccc(N(C)C)c(C)c2)c1 ZINC000773001841 1131913710 /nfs/dbraw/zinc/91/37/10/1131913710.db2.gz SPVUKIFFSLKXON-HNNXBMFYSA-N 1 0 298.430 3.920 20 10 CHCDRO COc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)c(C)c2)cc1 ZINC000772999435 1131914886 /nfs/dbraw/zinc/91/48/86/1131914886.db2.gz LDAOPIURUPHKLY-HNNXBMFYSA-N 1 0 298.430 3.920 20 10 CHCDRO Cc1ccc(C[N@@H+]2CCc3cccc(O)c3C2)c(Cl)c1 ZINC001140800570 1131924784 /nfs/dbraw/zinc/92/47/84/1131924784.db2.gz MONXVJICYNSDAJ-UHFFFAOYSA-N 1 0 287.790 3.912 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2cccc(F)n2)cc1 ZINC000773096016 1131944649 /nfs/dbraw/zinc/94/46/49/1131944649.db2.gz NJGMABCTZWXJTN-ZDUSSCGKSA-N 1 0 287.382 3.528 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CC2(C3CC3)CC2)cc1 ZINC000773097624 1131945914 /nfs/dbraw/zinc/94/59/14/1131945914.db2.gz HCPYEIZKIVECCS-AWEZNQCLSA-N 1 0 272.436 3.984 20 10 CHCDRO CN(C)c1ccc(CN(C)C2CC(F)(F)C2)c(Cl)c1 ZINC001140921576 1131963927 /nfs/dbraw/zinc/96/39/27/1131963927.db2.gz IMFUZOMELYACAQ-UHFFFAOYSA-N 1 0 288.769 3.636 20 10 CHCDRO Cc1ccc(C[N@H+]2CC[C@H](C)C(F)(F)CC2)c(O)c1 ZINC001140947979 1131969357 /nfs/dbraw/zinc/96/93/57/1131969357.db2.gz ODTAGTUCAWKTLE-LBPRGKRZSA-N 1 0 269.335 3.568 20 10 CHCDRO Cc1ccc(C[N@@H+]2CCc3cc(Cl)ccc3C2)c(O)c1 ZINC001140950681 1131969620 /nfs/dbraw/zinc/96/96/20/1131969620.db2.gz CKAMTHWVGXLIGZ-UHFFFAOYSA-N 1 0 287.790 3.912 20 10 CHCDRO C[NH+](C)Cc1cccc(NCc2cc(Cl)ccc2O)c1 ZINC000036979936 1131985774 /nfs/dbraw/zinc/98/57/74/1131985774.db2.gz XLNYMWQUTZPURF-UHFFFAOYSA-N 1 0 290.794 3.719 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)Cc2ccco2)c1 ZINC000036994208 1131987497 /nfs/dbraw/zinc/98/74/97/1131987497.db2.gz ZKHAOBYBTYHTKW-OLZOCXBDSA-N 1 0 259.349 3.575 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCC[C@@H](C)[C@H]2C)c1 ZINC000037021698 1131988131 /nfs/dbraw/zinc/98/81/31/1131988131.db2.gz RTYOOPIAZDHRTK-NFFDBFGFSA-N 1 0 277.408 3.876 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc(OC)ccc1O)c1ccc(C)cc1 ZINC000037048038 1131990735 /nfs/dbraw/zinc/99/07/35/1131990735.db2.gz KWPDTYCFUZMKGT-QGZVFWFLSA-N 1 0 285.387 3.950 20 10 CHCDRO c1cc(N2CCCCC2)ccc1C[NH2+]CC1CCC1 ZINC000037179544 1132006957 /nfs/dbraw/zinc/00/69/57/1132006957.db2.gz ILVRUCHHUWFICC-UHFFFAOYSA-N 1 0 258.409 3.567 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2CSCc3ccccc32)cc1 ZINC000037233660 1132023314 /nfs/dbraw/zinc/02/33/14/1132023314.db2.gz WCRDHRZHZAZKMW-GOSISDBHSA-N 1 0 298.455 3.830 20 10 CHCDRO c1ccc([C@H]([NH2+]Cc2ccc3c(c2)CCO3)C2CC2)cc1 ZINC000037363403 1132030378 /nfs/dbraw/zinc/03/03/78/1132030378.db2.gz XFWPMRXJRMJSMJ-IBGZPJMESA-N 1 0 279.383 3.862 20 10 CHCDRO Cc1ccc([C@H]2CCC[N@@H+]2Cc2cc(O)ccc2O)cc1 ZINC001141158978 1132031181 /nfs/dbraw/zinc/03/11/81/1132031181.db2.gz UJHHPRQBFKDFDX-QGZVFWFLSA-N 1 0 283.371 3.743 20 10 CHCDRO CC[N@H+](Cc1ccc(C)c(C)c1)Cc1cc(O)ccc1O ZINC001141162359 1132031591 /nfs/dbraw/zinc/03/15/91/1132031591.db2.gz QWMLZWWAUWFGTP-UHFFFAOYSA-N 1 0 285.387 3.737 20 10 CHCDRO Oc1ccc(O)c(C[N@@H+]2CCC[C@@H](c3ccccc3)CC2)c1 ZINC001141161187 1132031652 /nfs/dbraw/zinc/03/16/52/1132031652.db2.gz OFSAMVQHNUQFGZ-MRXNPFEDSA-N 1 0 297.398 3.868 20 10 CHCDRO Oc1ccc(O)c(C[N@@H+]2CC[C@H](C3CCCCC3)C2)c1 ZINC001141161767 1132031903 /nfs/dbraw/zinc/03/19/03/1132031903.db2.gz XGOPWVYQDONKLH-AWEZNQCLSA-N 1 0 275.392 3.500 20 10 CHCDRO CC[C@@H](c1ccccc1)[N@H+](C)Cc1cc(O)ccc1O ZINC001141160948 1132031995 /nfs/dbraw/zinc/03/19/95/1132031995.db2.gz KORAIBGPSOPRRY-INIZCTEOSA-N 1 0 271.360 3.681 20 10 CHCDRO C[C@H]([NH2+][C@@H]1Cc2cccc(F)c2C1)c1ccc(N(C)C)cc1 ZINC001171780538 1132100216 /nfs/dbraw/zinc/10/02/16/1132100216.db2.gz MLVHVJMDICJCLR-XJKSGUPXSA-N 1 0 298.405 3.710 20 10 CHCDRO COc1cc(Cl)cc(C[NH+]2CC(C(C)(C)C)C2)c1O ZINC000839145891 1132184251 /nfs/dbraw/zinc/18/42/51/1132184251.db2.gz UTQCPPUOZYSPFK-UHFFFAOYSA-N 1 0 283.799 3.532 20 10 CHCDRO CC[C@@H](C)OCC[C@@H](C)[N@H+](CC)Cc1ccccc1O ZINC001172356436 1132185446 /nfs/dbraw/zinc/18/54/46/1132185446.db2.gz YKXOLRLMJKCTNS-HUUCEWRRSA-N 1 0 279.424 3.808 20 10 CHCDRO Cc1cc(C)c(C[NH2+][C@@H](C)CCOCC(C)C)c(O)c1 ZINC001172463566 1132243199 /nfs/dbraw/zinc/24/31/99/1132243199.db2.gz QAKJTLNUVHCIGA-HNNXBMFYSA-N 1 0 279.424 3.550 20 10 CHCDRO COCC[C@@H](C)C[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O ZINC000840836237 1132292599 /nfs/dbraw/zinc/29/25/99/1132292599.db2.gz WFBKPPHNFMLGSI-PWSUYJOCSA-N 1 0 285.815 3.677 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1Cc2ccccc2[C@@H]1OC)c1ccccc1O ZINC000840845490 1132293177 /nfs/dbraw/zinc/29/31/77/1132293177.db2.gz ATCSTBKDOZAYIU-SCTDSRPQSA-N 1 0 297.398 3.745 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@H]2CS[C@H](C)C2)c(O)c1 ZINC000840858938 1132296495 /nfs/dbraw/zinc/29/64/95/1132296495.db2.gz DSXNMTCLDIKMOH-FRRDWIJNSA-N 1 0 265.422 3.554 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H]2C[C@H](C)O[C@@H]2C)cc1 ZINC000840874174 1132298449 /nfs/dbraw/zinc/29/84/49/1132298449.db2.gz XUAUEIJAXYWEJK-MPTYRVRUSA-N 1 0 290.451 3.607 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCCC[C@H]1F)c1cc(Cl)ccc1O ZINC000840876149 1132300329 /nfs/dbraw/zinc/30/03/29/1132300329.db2.gz MRKCJJGJKUSSLU-ZWKOPEQDSA-N 1 0 271.763 3.977 20 10 CHCDRO CC[C@H]([NH2+]C1CCC(COC)CC1)c1ccc(C)cc1O ZINC000840875920 1132300766 /nfs/dbraw/zinc/30/07/66/1132300766.db2.gz KXMHZZGOVKZBIQ-DQPZFDDXSA-N 1 0 291.435 3.947 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H](C)C2(OC)CCC2)cc1 ZINC000840884082 1132302595 /nfs/dbraw/zinc/30/25/95/1132302595.db2.gz IRLMOUCZDIZXDN-LSDHHAIUSA-N 1 0 290.451 3.751 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+][C@@H](C)c1ccccn1 ZINC000840895345 1132305591 /nfs/dbraw/zinc/30/55/91/1132305591.db2.gz XFVGRPURPRTPSJ-CVEARBPZSA-N 1 0 297.446 3.738 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+][C@@H](C)c1cccnc1 ZINC000840893528 1132305872 /nfs/dbraw/zinc/30/58/72/1132305872.db2.gz KNMJDJODZZJUAY-CVEARBPZSA-N 1 0 297.446 3.738 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](c1ccccn1)C(C)C ZINC000840934750 1132310366 /nfs/dbraw/zinc/31/03/66/1132310366.db2.gz WWDHLIZYKPNBKU-LJQANCHMSA-N 1 0 297.446 3.943 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+](C)[C@@H](C)c1cccnc1 ZINC000840939942 1132310750 /nfs/dbraw/zinc/31/07/50/1132310750.db2.gz RTUGMKBWMSPIOB-HNNXBMFYSA-N 1 0 283.419 3.649 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]C[C@H]1CCCC1(F)F ZINC000840950101 1132311585 /nfs/dbraw/zinc/31/15/85/1132311585.db2.gz FJPCNWDGPLLMNH-CQSZACIVSA-N 1 0 282.378 3.586 20 10 CHCDRO Cc1cccc(C[NH2+]Cc2cnccc2C(C)(C)C)c1O ZINC000840959451 1132313686 /nfs/dbraw/zinc/31/36/86/1132313686.db2.gz RXUYVVMVJOJSAD-UHFFFAOYSA-N 1 0 284.403 3.683 20 10 CHCDRO CO[C@](C)([C@@H](C)[NH2+]Cc1cc(Cl)cc(C)c1O)C1CC1 ZINC000840961468 1132313985 /nfs/dbraw/zinc/31/39/85/1132313985.db2.gz WPUFTIMJWWWQBD-BDJLRTHQSA-N 1 0 297.826 3.647 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CCC[C@@H]2C[C@@H]21 ZINC001231589091 1132317153 /nfs/dbraw/zinc/31/71/53/1132317153.db2.gz CHRWLWWTUMHIBS-CJNGLKHVSA-N 1 0 253.345 3.530 20 10 CHCDRO C[N@H+](CCc1cccnc1)Cc1c(O)ccc2ccccc21 ZINC001231590404 1132318916 /nfs/dbraw/zinc/31/89/16/1132318916.db2.gz YKYSVHKKPONNRB-UHFFFAOYSA-N 1 0 292.382 3.615 20 10 CHCDRO Cc1cc(O)c(CNc2ccc([C@@H](C)[NH3+])cc2)c(Cl)c1 ZINC000841031612 1132321403 /nfs/dbraw/zinc/32/14/03/1132321403.db2.gz YFSFHTQJIXZIOO-LLVKDONJSA-N 1 0 290.794 3.986 20 10 CHCDRO CC(C)[C@@H](C[NH2+]CCc1ccc(N)cc1)c1ccccc1 ZINC000841039012 1132322723 /nfs/dbraw/zinc/32/27/23/1132322723.db2.gz XEIPCHFLNPBORI-LJQANCHMSA-N 1 0 282.431 3.841 20 10 CHCDRO C[C@@H]1[C@H]([NH2+]CCc2ccc(N)cc2)C[C@H]1c1ccccc1 ZINC000841037127 1132323532 /nfs/dbraw/zinc/32/35/32/1132323532.db2.gz YLUYCNXIGDYYIB-GDIGMMSISA-N 1 0 280.415 3.593 20 10 CHCDRO CO[C@@H]1CCC[C@@H]([NH2+]Cc2cc3ccccc3cc2O)C1 ZINC001172922624 1132363564 /nfs/dbraw/zinc/36/35/64/1132363564.db2.gz IYRVPKZMEBZPGQ-IAGOWNOFSA-N 1 0 285.387 3.593 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCCC[C@@](C)(F)C2)c(O)c1 ZINC001231842999 1132375445 /nfs/dbraw/zinc/37/54/45/1132375445.db2.gz RQWYCFQWUYAPBQ-MRXNPFEDSA-N 1 0 265.372 3.723 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCC[C@@](C)(F)CC2)c(O)c1 ZINC001231842436 1132376483 /nfs/dbraw/zinc/37/64/83/1132376483.db2.gz LXMJKHPRTGZYBT-MRXNPFEDSA-N 1 0 265.372 3.723 20 10 CHCDRO Cc1cc(C)c(C[N@H+](C)Cc2ccsc2)c(O)c1 ZINC001231846175 1132379480 /nfs/dbraw/zinc/37/94/80/1132379480.db2.gz HDLRDEZVUVEYRI-UHFFFAOYSA-N 1 0 261.390 3.703 20 10 CHCDRO CCCOC1CCC([NH2+][C@@H](C)c2ccccc2O)CC1 ZINC001173090508 1132384486 /nfs/dbraw/zinc/38/44/86/1132384486.db2.gz VREDEQRCDWQMSL-NFOMZHRRSA-N 1 0 277.408 3.781 20 10 CHCDRO Cc1cc(O)c(C[NH+]2C[C@@H]3CCCC[C@H]3C2)cc1Cl ZINC001231867991 1132384917 /nfs/dbraw/zinc/38/49/17/1132384917.db2.gz OZVPETLKYDXMCH-STQMWFEESA-N 1 0 279.811 3.976 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)CC2CCC2)cc1Cl ZINC001231870897 1132385436 /nfs/dbraw/zinc/38/54/36/1132385436.db2.gz WDINLGHZUYLTMN-UHFFFAOYSA-N 1 0 253.773 3.586 20 10 CHCDRO Cc1cc(O)c(C[NH+]2CCC3(CC3)CC2)cc1Cl ZINC001231868078 1132385461 /nfs/dbraw/zinc/38/54/61/1132385461.db2.gz QEQRBLUEHSXOFF-UHFFFAOYSA-N 1 0 265.784 3.730 20 10 CHCDRO Cc1cc(O)c(C[NH+]2CC(c3ccccc3)C2)cc1Cl ZINC001231870357 1132385811 /nfs/dbraw/zinc/38/58/11/1132385811.db2.gz VNOHOGYVWFEKSQ-UHFFFAOYSA-N 1 0 287.790 3.953 20 10 CHCDRO Cc1cc(O)c(CN2CCn3cccc3[C@@H]2C)cc1Cl ZINC001231870292 1132385847 /nfs/dbraw/zinc/38/58/47/1132385847.db2.gz SCOZFRWRQSLBME-LBPRGKRZSA-N 1 0 290.794 3.732 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccccc1O)[C@@H]1C[C@H]1c1cccs1 ZINC000841747675 1132388825 /nfs/dbraw/zinc/38/88/25/1132388825.db2.gz RWULLDGBBQDBBN-KWCYVHTRSA-N 1 0 273.401 3.736 20 10 CHCDRO Oc1c(C[N@@H+]2C[C@@H]3CCC[C@@H]3C2)ccc2ccccc21 ZINC001231877985 1132388936 /nfs/dbraw/zinc/38/89/36/1132388936.db2.gz CMYLTBQBYVAFLN-GASCZTMLSA-N 1 0 267.372 3.777 20 10 CHCDRO Oc1c(C[N@@H+]2CC[C@H]3OCCC[C@H]3C2)ccc2ccccc21 ZINC001231878801 1132389582 /nfs/dbraw/zinc/38/95/82/1132389582.db2.gz UTRGFOLCMIPYHF-MAUKXSAKSA-N 1 0 297.398 3.546 20 10 CHCDRO COC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccc2ccccc2c1O ZINC001231883203 1132389992 /nfs/dbraw/zinc/38/99/92/1132389992.db2.gz MLWDTSKPNZXZAC-SJPCQFCGSA-N 1 0 297.398 3.687 20 10 CHCDRO Oc1c(C[N@@H+]2CC[C@H](C(F)(F)F)C2)ccc2ccccc21 ZINC001231882736 1132390482 /nfs/dbraw/zinc/39/04/82/1132390482.db2.gz UAOZWPWEFVDEHQ-ZDUSSCGKSA-N 1 0 295.304 3.930 20 10 CHCDRO C[N@@H+](Cc1ccc2ccccc2c1O)CC1CCC1 ZINC001231881866 1132392267 /nfs/dbraw/zinc/39/22/67/1132392267.db2.gz KIOFIFZTZCZPID-UHFFFAOYSA-N 1 0 255.361 3.777 20 10 CHCDRO CO[C@@H]([C@@H](C)[NH2+][C@H](C)c1ccc(Cl)cc1O)C1CC1 ZINC000841758865 1132394181 /nfs/dbraw/zinc/39/41/81/1132394181.db2.gz VRKUSLJRNXEDKY-FCHSOHFDSA-N 1 0 283.799 3.510 20 10 CHCDRO C[C@@H]([NH2+][C@@H](CO)CC1CCCCC1)c1cc(F)ccc1O ZINC000841761313 1132396930 /nfs/dbraw/zinc/39/69/30/1132396930.db2.gz IGVABUIPPXECBW-IUODEOHRSA-N 1 0 295.398 3.513 20 10 CHCDRO CC[C@@H]1CC[C@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC001173265244 1132432126 /nfs/dbraw/zinc/43/21/26/1132432126.db2.gz RJUBQAXQDOSZEW-WBVHZDCISA-N 1 0 272.436 3.955 20 10 CHCDRO CC[C@H]1CC[C@H]([NH2+]Cc2cc(Br)ccc2O)C1 ZINC001173269551 1132434242 /nfs/dbraw/zinc/43/42/42/1132434242.db2.gz XHPKJESXGIZMAX-GWCFXTLKSA-N 1 0 298.224 3.823 20 10 CHCDRO C[C@H]1CCC[C@H](C)[NH+]1Cc1cc(Cl)c(O)cc1O ZINC001232257682 1132445071 /nfs/dbraw/zinc/44/50/71/1132445071.db2.gz GPMCZIQJLDWSJI-UWVGGRQHSA-N 1 0 269.772 3.514 20 10 CHCDRO CC[C@@H]1CCCC[N@@H+]1Cc1cc(Cl)c(O)cc1O ZINC001232262979 1132445107 /nfs/dbraw/zinc/44/51/07/1132445107.db2.gz YVZQMVUPAJWXFL-LLVKDONJSA-N 1 0 269.772 3.516 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CCCC3(CCC3)C2)cc1Cl ZINC001232271178 1132447065 /nfs/dbraw/zinc/44/70/65/1132447065.db2.gz PMLSIZGPUYTDAA-UHFFFAOYSA-N 1 0 295.810 3.820 20 10 CHCDRO CC[C@@H]1CC[C@@H]([NH2+]Cc2ccc(Br)cc2O)C1 ZINC001173278295 1132453784 /nfs/dbraw/zinc/45/37/84/1132453784.db2.gz YTYWOGIOTCJFQE-ZWNOBZJWSA-N 1 0 298.224 3.823 20 10 CHCDRO C[C@H](C[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F)CC(F)F ZINC000842891143 1132474259 /nfs/dbraw/zinc/47/42/59/1132474259.db2.gz ZUQGLYZQJVCADQ-QXEWZRGKSA-N 1 0 287.325 3.961 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H]2CCS[C@@H]2C)cc1 ZINC000842926926 1132475992 /nfs/dbraw/zinc/47/59/92/1132475992.db2.gz BEWKNZYZNQPNMD-ZENOOKHLSA-N 1 0 278.465 3.687 20 10 CHCDRO C[C@H]([NH2+][C@H]1CO[C@H](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000842928975 1132477403 /nfs/dbraw/zinc/47/74/03/1132477403.db2.gz LGEAHASKXHXWNM-HLLBOEOZSA-N 1 0 288.435 3.505 20 10 CHCDRO CC(C)(C)c1cccc(C[NH+]2CCC(F)CC2)c1O ZINC001143104492 1132502656 /nfs/dbraw/zinc/50/26/56/1132502656.db2.gz TZBYCQWDXRPBAA-UHFFFAOYSA-N 1 0 265.372 3.624 20 10 CHCDRO CC(C)(C)c1cccc(C[N@@H+]2CCCOC(C)(C)C2)c1O ZINC001143111118 1132503971 /nfs/dbraw/zinc/50/39/71/1132503971.db2.gz YEHSNAKRXSIUCL-UHFFFAOYSA-N 1 0 291.435 3.691 20 10 CHCDRO CC(C)(C)c1cccc(C[N@@H+]2C[C@H]3CC[C@@H]2C3)c1O ZINC001143112346 1132504046 /nfs/dbraw/zinc/50/40/46/1132504046.db2.gz RAKRDJWKQWNANA-GXTWGEPZSA-N 1 0 259.393 3.674 20 10 CHCDRO Cc1cc(C[N@H+](C)Cc2ccccc2O)c(F)cc1F ZINC001232787229 1132522114 /nfs/dbraw/zinc/52/21/14/1132522114.db2.gz XCSCHRHEYOKZEO-UHFFFAOYSA-N 1 0 277.314 3.611 20 10 CHCDRO CCCCC1CC[NH+](Cc2ccc(N(C)C)cc2O)CC1 ZINC001232836616 1132529472 /nfs/dbraw/zinc/52/94/72/1132529472.db2.gz RMAAPLNJOFDOJF-UHFFFAOYSA-N 1 0 290.451 3.860 20 10 CHCDRO COC[C@H]1CCCC[N@@H+]1Cc1cc(C(C)(C)C)ccc1O ZINC001233284366 1132594716 /nfs/dbraw/zinc/59/47/16/1132594716.db2.gz RKVMTPOZBNQMRB-MRXNPFEDSA-N 1 0 291.435 3.691 20 10 CHCDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2C[C@@H]3C[C@H]2C[C@H]3F)c1 ZINC001233285410 1132595046 /nfs/dbraw/zinc/59/50/46/1132595046.db2.gz FHSRFJDMKRUVBC-TUKIKUTGSA-N 1 0 277.383 3.622 20 10 CHCDRO CCCO[C@H]1CC[N@H+](Cc2cc(C(C)(C)C)ccc2O)C1 ZINC001233286071 1132595274 /nfs/dbraw/zinc/59/52/74/1132595274.db2.gz DJZQVSDYYUXKIO-INIZCTEOSA-N 1 0 291.435 3.691 20 10 CHCDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2C[C@H]3CC[C@@H]2C3)c1 ZINC001233286164 1132595984 /nfs/dbraw/zinc/59/59/84/1132595984.db2.gz HZEAPDJOUQTOQV-SWLSCSKDSA-N 1 0 259.393 3.674 20 10 CHCDRO C[N@H+](Cc1ccc(C(F)(F)F)cc1O)C1CC(F)(F)C1 ZINC001233451382 1132625615 /nfs/dbraw/zinc/62/56/15/1132625615.db2.gz IQCWRDKGWSIKCU-UHFFFAOYSA-N 1 0 295.251 3.641 20 10 CHCDRO CC[C@@H]1CC[N@H+](Cc2cccc(OC(F)(F)F)c2O)C1 ZINC001233776347 1132677514 /nfs/dbraw/zinc/67/75/14/1132677514.db2.gz QEIZQWIVJPJMGK-SNVBAGLBSA-N 1 0 289.297 3.523 20 10 CHCDRO CC(C)Nc1ccc(Nc2ccc3c(c2)CC[NH2+]CC3)cc1 ZINC001159679165 1132890784 /nfs/dbraw/zinc/89/07/84/1132890784.db2.gz OJJOUIHVPJRINR-UHFFFAOYSA-N 1 0 295.430 3.939 20 10 CHCDRO Cc1cc(Nc2ccccc2Cc2ccc(N)cc2)cc[nH+]1 ZINC001174656465 1132951934 /nfs/dbraw/zinc/95/19/34/1132951934.db2.gz 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ZINC001204240155 1133423949 /nfs/dbraw/zinc/42/39/49/1133423949.db2.gz JNKBRRIRXVUWIZ-UHFFFAOYSA-N 1 0 288.460 3.701 20 10 CHCDRO CCO[C@@H]1CC[N@H+](Cc2ccc(N(C)C)c3ccccc23)C1 ZINC001204239681 1133424656 /nfs/dbraw/zinc/42/46/56/1133424656.db2.gz CEADOVKDTIBZGO-MRXNPFEDSA-N 1 0 298.430 3.517 20 10 CHCDRO C[C@H](c1ccccc1Cl)[N@H+](C)Cc1ccc(O)cc1O ZINC001204277368 1133427587 /nfs/dbraw/zinc/42/75/87/1133427587.db2.gz BPBINDOTWJJDRN-LLVKDONJSA-N 1 0 291.778 3.944 20 10 CHCDRO FC(F)(F)[C@H]1CC[N@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001204321928 1133436437 /nfs/dbraw/zinc/43/64/37/1133436437.db2.gz MAWYZDLJXZWWMO-AWEZNQCLSA-N 1 0 298.352 3.671 20 10 CHCDRO c1ccc2c(c1)CC[N@@H+](Cc1ccc(N3CCCC3)cc1)C2 ZINC001204318947 1133436464 /nfs/dbraw/zinc/43/64/64/1133436464.db2.gz AODCPHLMSPBVJF-UHFFFAOYSA-N 1 0 292.426 3.845 20 10 CHCDRO CCCC[NH+](CCCC)Cc1cc(O)c(O)c(OC)c1 ZINC001204345759 1133438235 /nfs/dbraw/zinc/43/82/35/1133438235.db2.gz WWNGDSOEXIQSLV-UHFFFAOYSA-N 1 0 281.396 3.509 20 10 CHCDRO Cc1cc(C)cc(C[N@@H+]2CCCc3cc(O)c(O)cc3C2)c1 ZINC001204523755 1133457462 /nfs/dbraw/zinc/45/74/62/1133457462.db2.gz FFQGIAXIPUEJFC-UHFFFAOYSA-N 1 0 297.398 3.663 20 10 CHCDRO CC(C)c1ccc(O)c(C[N@@H+]2CCC[C@@H](c3cc[nH]n3)C2)c1 ZINC001204841248 1133491251 /nfs/dbraw/zinc/49/12/51/1133491251.db2.gz RVFOBKSJXUXTME-OAHLLOKOSA-N 1 0 299.418 3.618 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc(F)ccc1O)c1ccc(F)cc1 ZINC001204937768 1133503976 /nfs/dbraw/zinc/50/39/76/1133503976.db2.gz NQJUBCPCVJXNTR-OAHLLOKOSA-N 1 0 277.314 3.911 20 10 CHCDRO CC[N@H+](Cc1ccc(C)c(F)c1)Cc1ccccc1O ZINC001205243612 1133549083 /nfs/dbraw/zinc/54/90/83/1133549083.db2.gz LVVFTDCHEPQGED-UHFFFAOYSA-N 1 0 273.351 3.862 20 10 CHCDRO CC(C)c1ccc(O)c(C[N@@H+]2CCSCC[C@@H]2C)c1 ZINC001205405989 1133574446 /nfs/dbraw/zinc/57/44/46/1133574446.db2.gz PDQUNUAIRXRYBN-ZDUSSCGKSA-N 1 0 279.449 3.843 20 10 CHCDRO CC(C)c1ccc(O)c(C[NH2+]CC[C@H]2CCO[C@@H](C)C2)c1 ZINC001205391147 1133573697 /nfs/dbraw/zinc/57/36/97/1133573697.db2.gz JORVACWHKLZYLG-GJZGRUSLSA-N 1 0 291.435 3.810 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@H]1CCc2ccccc2C1 ZINC001205656341 1133599324 /nfs/dbraw/zinc/59/93/24/1133599324.db2.gz OQPMTFQHKKPPQZ-FQEVSTJZSA-N 1 0 294.442 3.919 20 10 CHCDRO CC1(C)C[C@]1(C[NH2+]Cc1cc(F)ccc1O)c1ccccc1 ZINC001206753905 1133742543 /nfs/dbraw/zinc/74/25/43/1133742543.db2.gz TXTGNLYCTVORIF-IBGZPJMESA-N 1 0 299.389 3.989 20 10 CHCDRO Cc1cncc(C[N@H+](C)Cc2ccc(N3CCCC3)cc2)c1 ZINC001207156866 1133773245 /nfs/dbraw/zinc/77/32/45/1133773245.db2.gz OLPBGSQJPLVXMQ-UHFFFAOYSA-N 1 0 295.430 3.622 20 10 CHCDRO CC1(C)C[C@H]([NH2+]Cc2ccc(Cl)cc2O)CCS1 ZINC001207675691 1133837276 /nfs/dbraw/zinc/83/72/76/1133837276.db2.gz QKJHDZSGIYGALS-GFCCVEGCSA-N 1 0 285.840 3.809 20 10 CHCDRO Oc1cccc2c1C[N@H+](CCCc1ccc(F)cc1)CC2 ZINC001208774422 1133942798 /nfs/dbraw/zinc/94/27/98/1133942798.db2.gz DEDAADBRJRPFEN-UHFFFAOYSA-N 1 0 285.362 3.522 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(C[N@H+]2CC[C@@H]2C)cc1 ZINC001209516908 1134032164 /nfs/dbraw/zinc/03/21/64/1134032164.db2.gz SJUKRONBQQPAEH-ZDUSSCGKSA-N 1 0 254.377 3.688 20 10 CHCDRO c1cc(Nc2ccc3c(c2)OCCN3)cc(C2CCC2)[nH+]1 ZINC001209723392 1134055395 /nfs/dbraw/zinc/05/53/95/1134055395.db2.gz YLRLUJGUSJIYSG-UHFFFAOYSA-N 1 0 281.359 3.897 20 10 CHCDRO Oc1c(F)cccc1Nc1cc[nH+]cc1Oc1ccccc1 ZINC001210195004 1134163506 /nfs/dbraw/zinc/16/35/06/1134163506.db2.gz BKCJEBIJWXKAGX-UHFFFAOYSA-N 1 0 296.301 3.884 20 10 CHCDRO CCOc1cccc(C[NH2+]Cc2csc(C)c2C)c1O ZINC000400012565 1134576992 /nfs/dbraw/zinc/57/69/92/1134576992.db2.gz XXKBLBCPKGUDKU-UHFFFAOYSA-N 1 0 291.416 3.759 20 10 CHCDRO CC[C@H](C[NH2+]Cc1cc(F)ccc1O)CC(F)(F)F ZINC000402557041 1134660097 /nfs/dbraw/zinc/66/00/97/1134660097.db2.gz HSIDYMMNJGWPMH-VIFPVBQESA-N 1 0 279.277 3.600 20 10 CHCDRO C[C@@H]1C[NH2+]C[C@H]1OC1=CC(=O)C=CC1=NNc1ccccc1 ZINC001218034124 1135047202 /nfs/dbraw/zinc/04/72/02/1135047202.db2.gz KQLCJIXNSZKVBE-OYYCORRUSA-N 1 0 297.358 3.794 20 10 CHCDRO C[C@@H]([C@H](Oc1ccc(N)cc1)c1ccccc1)[NH+]1CCCC1 ZINC001218185801 1135065504 /nfs/dbraw/zinc/06/55/04/1135065504.db2.gz COFPRNONMPPBHK-KXBFYZLASA-N 1 0 296.414 3.873 20 10 CHCDRO CC(C)=CCC[C@@H](C)Oc1ccc(N2CC[NH2+]CC2)cc1 ZINC001218316841 1135087481 /nfs/dbraw/zinc/08/74/81/1135087481.db2.gz GEMGKSSHQLLTSG-MRXNPFEDSA-N 1 0 288.435 3.610 20 10 CHCDRO C[C@H]([NH2+]CCOCC1CCCC1)c1ccc(N(C)C)cc1 ZINC000313298818 1135138086 /nfs/dbraw/zinc/13/80/86/1135138086.db2.gz MZOROQLZZYQAOB-HNNXBMFYSA-N 1 0 290.451 3.610 20 10 CHCDRO COCC1(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)CCC1 ZINC000313857910 1135141264 /nfs/dbraw/zinc/14/12/64/1135141264.db2.gz IXFSHKGRWJRASN-KBPBESRZSA-N 1 0 289.419 3.655 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]Cc1ccc(C#N)cc1 ZINC000314693417 1135146998 /nfs/dbraw/zinc/14/69/98/1135146998.db2.gz LVYYUDXWELTYSZ-CJNGLKHVSA-N 1 0 292.382 3.910 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H](C)c2ccc(C#N)cc2)c1O ZINC000315528002 1135156446 /nfs/dbraw/zinc/15/64/46/1135156446.db2.gz VEVLKZUXBGTUBS-ZDUSSCGKSA-N 1 0 296.370 3.513 20 10 CHCDRO C[C@@H]([NH2+]CCc1c[nH]c2ccccc12)c1ccccc1O ZINC000020122490 171002517 /nfs/dbraw/zinc/00/25/17/171002517.db2.gz XRWTUFMFCDAJNB-CYBMUJFWSA-N 1 0 280.371 3.767 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]C2CCCCCC2)c1 ZINC000020122635 171003802 /nfs/dbraw/zinc/00/38/02/171003802.db2.gz ZJICBTPVGGEMBL-GFCCVEGCSA-N 1 0 263.381 3.774 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccccn2)c(O)c1 ZINC000020123898 171005454 /nfs/dbraw/zinc/00/54/54/171005454.db2.gz YMEWWNOZLMKLFL-STQMWFEESA-N 1 0 256.349 3.507 20 10 CHCDRO Cc1ccccc1[C@H](C)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000020126081 171009737 /nfs/dbraw/zinc/00/97/37/171009737.db2.gz ZPVDBLQDYDYMGL-HNNXBMFYSA-N 1 0 268.404 3.912 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cccc(C)c1)c1ccccc1O ZINC000020134230 171021727 /nfs/dbraw/zinc/02/17/27/171021727.db2.gz BPOOYWCNTDZBQE-MRXNPFEDSA-N 1 0 255.361 3.942 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccccc1F ZINC000020146053 171031784 /nfs/dbraw/zinc/03/17/84/171031784.db2.gz ACLWMVQLGIVFGF-CYBMUJFWSA-N 1 0 272.367 3.743 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1O)c1cccc(F)c1 ZINC000020147844 171035215 /nfs/dbraw/zinc/03/52/15/171035215.db2.gz KFKFKPMWWUOILU-NEPJUHHUSA-N 1 0 259.324 3.943 20 10 CHCDRO Cc1cc(C[NH2+][C@H](C)C2CC2)c(C)n1-c1ccccc1 ZINC000035136599 172004045 /nfs/dbraw/zinc/00/40/45/172004045.db2.gz RDJVZAPSOVERSF-CQSZACIVSA-N 1 0 268.404 3.982 20 10 CHCDRO Cc1cccc(C[NH2+][C@H](C)c2cc(C)ccc2O)c1 ZINC000035628842 172308514 /nfs/dbraw/zinc/30/85/14/172308514.db2.gz RTJAFVQLWKWYKM-CQSZACIVSA-N 1 0 255.361 3.860 20 10 CHCDRO c1cc(C[NH2+]CCC2=CCCCC2)cc2c1OCC2 ZINC000037362717 173151693 /nfs/dbraw/zinc/15/16/93/173151693.db2.gz KTUKUMLHBKMMLR-UHFFFAOYSA-N 1 0 257.377 3.602 20 10 CHCDRO CC[C@H]([NH2+]CCc1nc(C)c(C)s1)c1ccccc1O ZINC000156387760 261122107 /nfs/dbraw/zinc/12/21/07/261122107.db2.gz DBTFDBGUTDEJNI-AWEZNQCLSA-N 1 0 290.432 3.749 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1CCCO[C@@H]1C(C)C)c1ccccc1O ZINC000156698824 261129620 /nfs/dbraw/zinc/12/96/20/261129620.db2.gz SPKGIEXBRQVYSD-QGPMSJSTSA-N 1 0 291.435 3.884 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCCC(C)(C)CO)cc1 ZINC000163187153 261308743 /nfs/dbraw/zinc/30/87/43/261308743.db2.gz RROIGDJSPAGBBX-OAHLLOKOSA-N 1 0 292.467 3.592 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+](C)[C@H](C)c2ccccn2)c1O ZINC000182066874 261922410 /nfs/dbraw/zinc/92/24/10/261922410.db2.gz QKPABYQMIQUOFS-GFCCVEGCSA-N 1 0 290.794 3.942 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)c2ccccc2O)c(C)c1 ZINC000183430115 261974380 /nfs/dbraw/zinc/97/43/80/261974380.db2.gz RWKWQCXUAWUNAZ-AWEZNQCLSA-N 1 0 255.361 3.860 20 10 CHCDRO Cc1csc(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)n1 ZINC000184954593 262035001 /nfs/dbraw/zinc/03/50/01/262035001.db2.gz UPQUGASYCIOKPT-VIFPVBQESA-N 1 0 282.796 3.661 20 10 CHCDRO CCOCCCC[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000185070862 262040049 /nfs/dbraw/zinc/04/00/49/262040049.db2.gz MFFYNIDSLKJDEL-NSHDSACASA-N 1 0 271.788 3.513 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(Cl)nc2)c1 ZINC000185074010 262040115 /nfs/dbraw/zinc/04/01/15/262040115.db2.gz ZQNHVCXAGOCDMX-NSHDSACASA-N 1 0 276.767 3.600 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)Cc2ccc(O)cc2)c1 ZINC000185351537 262051501 /nfs/dbraw/zinc/05/15/01/262051501.db2.gz OLWNIBXIKYWFBI-UONOGXRCSA-N 1 0 285.387 3.688 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](CCO)c2ccccc2)c(O)c1 ZINC000185525949 262058688 /nfs/dbraw/zinc/05/86/88/262058688.db2.gz OBQWECCVXJAJCL-DOTOQJQBSA-N 1 0 299.414 3.517 20 10 CHCDRO Cc1ccc2c(c1C)OC[C@H]2[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000297056651 263200337 /nfs/dbraw/zinc/20/03/37/263200337.db2.gz VTHZHXGSVLNAJL-HZPDHXFCSA-N 1 0 295.382 3.720 20 10 CHCDRO Cc1cc([C@@H]2CCC[N@@H+]2Cc2cc(C)c(C)cc2O)no1 ZINC000369991626 267281910 /nfs/dbraw/zinc/28/19/10/267281910.db2.gz TXPNRFLZIUSCMW-INIZCTEOSA-N 1 0 286.375 3.643 20 10 CHCDRO COc1cccc(C[NH2+][C@@H]2C[C@@H](c3ccccc3)[C@H]2C)c1O ZINC000370560411 267327779 /nfs/dbraw/zinc/32/77/79/267327779.db2.gz YODKBIVPKCSAAH-KBRIMQKVSA-N 1 0 297.398 3.683 20 10 CHCDRO C[C@H]([NH2+]Cc1ccn(C)c1)c1ccc(N2CCCCC2)cc1 ZINC000158438572 327629115 /nfs/dbraw/zinc/62/91/15/327629115.db2.gz JKRHOTRGCOYJLD-INIZCTEOSA-N 1 0 297.446 3.866 20 10 CHCDRO COC(C)(C)C[C@@H](C)[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000185564798 327841284 /nfs/dbraw/zinc/84/12/84/327841284.db2.gz BTCXRNYNKLCSOK-OLZOCXBDSA-N 1 0 265.397 3.555 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H](c2ccccn2)C2CCC2)c1 ZINC000527771343 330282037 /nfs/dbraw/zinc/28/20/37/330282037.db2.gz HUOLUVZNBBOQNW-SFHVURJKSA-N 1 0 282.387 3.727 20 10 CHCDRO C[C@@H]([NH2+]CC[C@@H]1CCCOC1)c1cc(Cl)ccc1O ZINC000527925207 330296554 /nfs/dbraw/zinc/29/65/54/330296554.db2.gz IJEZJULSIRSTED-NEPJUHHUSA-N 1 0 283.799 3.513 20 10 CHCDRO COCCC1CC[NH+]([C@H](C)c2cc(Cl)ccc2O)CC1 ZINC000527930919 330297361 /nfs/dbraw/zinc/29/73/61/330297361.db2.gz ACLIKQIIXBGNRD-GFCCVEGCSA-N 1 0 297.826 3.855 20 10 CHCDRO Cc1ncccc1C[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000527986175 330298740 /nfs/dbraw/zinc/29/87/40/330298740.db2.gz JLYWXNKRKOJYHO-NSHDSACASA-N 1 0 276.767 3.600 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ncccc1F)c1cc(Cl)ccc1O ZINC000528034937 330302464 /nfs/dbraw/zinc/30/24/64/330302464.db2.gz BYLNUMHRQSZHIA-ZJUUUORDSA-N 1 0 294.757 3.992 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2ncccc2F)c1 ZINC000528034995 330302482 /nfs/dbraw/zinc/30/24/82/330302482.db2.gz CRIVSWUDKRPZMZ-RYUDHWBXSA-N 1 0 274.339 3.647 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1ncccc1F)c1ccccc1O ZINC000528036238 330302626 /nfs/dbraw/zinc/30/26/26/330302626.db2.gz QBQOZVYZEZLMGA-FZMZJTMJSA-N 1 0 274.339 3.728 20 10 CHCDRO COc1ccc([C@@H]([NH2+][C@@H](C)c2ccccc2O)C2CC2)cn1 ZINC000528041629 330305770 /nfs/dbraw/zinc/30/57/70/330305770.db2.gz BTFQBOVMGILOFG-SGTLLEGYSA-N 1 0 298.386 3.598 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1cncn1C(C)C ZINC000424198916 330326251 /nfs/dbraw/zinc/32/62/51/330326251.db2.gz YNBSHNDXJQFALL-UHFFFAOYSA-N 1 0 296.418 3.554 20 10 CHCDRO COC[C@H](CC(C)C)[NH2+]Cc1c(C)c2ccccc2n1C ZINC000475189086 331617294 /nfs/dbraw/zinc/61/72/94/331617294.db2.gz DOSCQRUJAUYIDT-HNNXBMFYSA-N 1 0 288.435 3.637 20 10 CHCDRO CCOc1cccc(C[NH2+][C@H]2CCC[C@H](SC)C2)c1O ZINC000117395183 517731278 /nfs/dbraw/zinc/73/12/78/517731278.db2.gz VUURVNJGQIIBHQ-KBPBESRZSA-N 1 0 295.448 3.555 20 10 CHCDRO CC(C)n1ncc2c1[C@H]([NH2+][C@H](C)c1ccccc1O)CCC2 ZINC000364882161 520080204 /nfs/dbraw/zinc/08/02/04/520080204.db2.gz KNAYBMFJKVPRCI-CZUORRHYSA-N 1 0 299.418 3.898 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2nc(C)cs2)cc1 ZINC000126210130 520284155 /nfs/dbraw/zinc/28/41/55/520284155.db2.gz ARRAAYYWVCCRQR-CYBMUJFWSA-N 1 0 289.448 3.758 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CCOC(C)(C)C2)cc1 ZINC000119366097 520290134 /nfs/dbraw/zinc/29/01/34/520290134.db2.gz JAVZGDKXQGJMGP-GOEBONIOSA-N 1 0 290.451 3.751 20 10 CHCDRO CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H](C)c1ccc(F)cc1[O-] ZINC000062744834 520630596 /nfs/dbraw/zinc/63/05/96/520630596.db2.gz OWVWYCONVYSTEM-ZIAGYGMSSA-N 1 0 296.430 3.692 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]Cc2scnc2C)cc1 ZINC000071212610 520907216 /nfs/dbraw/zinc/90/72/16/520907216.db2.gz IFDZCLBONOYUJO-UHFFFAOYSA-N 1 0 289.448 3.588 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2ccco2)cc1 ZINC000035136786 520908098 /nfs/dbraw/zinc/90/80/98/520908098.db2.gz MQWFRMNIPFAQKJ-AWEZNQCLSA-N 1 0 272.392 3.977 20 10 CHCDRO CC[N@H+](Cc1cc(F)ccc1O)[C@H](C)c1cccnc1 ZINC000290425149 521291606 /nfs/dbraw/zinc/29/16/06/521291606.db2.gz KZJKJHPXDNBAAR-GFCCVEGCSA-N 1 0 274.339 3.509 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)cc1F ZINC000127462141 522176783 /nfs/dbraw/zinc/17/67/83/522176783.db2.gz CFYYMEHSBAZCSH-QGZVFWFLSA-N 1 0 287.382 3.557 20 10 CHCDRO CCc1nc(C)c(C[NH2+][C@H](CC)c2ccc(C)cc2O)o1 ZINC000291935106 522211262 /nfs/dbraw/zinc/21/12/62/522211262.db2.gz PDSQDCJANNOEEI-CQSZACIVSA-N 1 0 288.391 3.800 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H]2CCCc3sccc32)cc1 ZINC000061325285 522211472 /nfs/dbraw/zinc/21/14/72/522211472.db2.gz WKBSFMUCRIYNQR-INIZCTEOSA-N 1 0 286.444 3.981 20 10 CHCDRO CC[C@H]([NH2+]CC1([C@H](C)CCO)CCC1)c1ccccc1O ZINC000274741699 522572534 /nfs/dbraw/zinc/57/25/34/522572534.db2.gz FKWHEGNLOLHTGY-ZBFHGGJFSA-N 1 0 291.435 3.622 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](O)c1ccsc1)c1ccc(C)cc1O ZINC000279970153 522630396 /nfs/dbraw/zinc/63/03/96/522630396.db2.gz CYPHWHCLYKRUAZ-HOCLYGCPSA-N 1 0 291.416 3.536 20 10 CHCDRO CC[C@@H]([NH2+]CC1(CC)CCOCC1)c1ccc(C)cc1O ZINC000279968234 522818725 /nfs/dbraw/zinc/81/87/25/522818725.db2.gz CTZFCHGNWIOTTG-MRXNPFEDSA-N 1 0 291.435 3.948 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1CSCCS1)c1ccc(C)cc1O ZINC000280082582 522855026 /nfs/dbraw/zinc/85/50/26/522855026.db2.gz LUIDMGJGQHUAHK-TZMCWYRMSA-N 1 0 297.489 3.590 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(C)nc1)c1ccc(C)cc1O ZINC000280138263 522874988 /nfs/dbraw/zinc/87/49/88/522874988.db2.gz PNEXOTLMVOHJOR-MRXNPFEDSA-N 1 0 270.376 3.645 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CCOC2(CCC2)C1)c1ccccc1O ZINC000274961638 522926873 /nfs/dbraw/zinc/92/68/73/522926873.db2.gz WVUXKJBKONNYMS-UKRRQHHQSA-N 1 0 275.392 3.535 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CCOC2(CCC2)C1)c1ccc(C)cc1O ZINC000280274248 522928411 /nfs/dbraw/zinc/92/84/11/522928411.db2.gz YATCFJANFWAJCD-GDBMZVCRSA-N 1 0 289.419 3.843 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CCCSC1)c1ccc(C)cc1O ZINC000280009289 522948373 /nfs/dbraw/zinc/94/83/73/522948373.db2.gz GPCHNJCGRROHCP-GXTWGEPZSA-N 1 0 265.422 3.637 20 10 CHCDRO COCCC1(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)CCC1 ZINC000122990352 523061921 /nfs/dbraw/zinc/06/19/21/523061921.db2.gz NRBOUEWPGLBLGA-HNNXBMFYSA-N 1 0 290.451 3.610 20 10 CHCDRO COCCCC[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000044655476 523177181 /nfs/dbraw/zinc/17/71/81/523177181.db2.gz ZKRHYCUDAIEEMR-ZDUSSCGKSA-N 1 0 273.376 3.623 20 10 CHCDRO C[N@H+](Cc1cccc(C(F)F)c1)Cc1ccccc1O ZINC000279177449 523300434 /nfs/dbraw/zinc/30/04/34/523300434.db2.gz AXDVAQLSYJRFFI-UHFFFAOYSA-N 1 0 277.314 3.962 20 10 CHCDRO C[N@H+](Cc1ccccc1O)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000290223821 523386761 /nfs/dbraw/zinc/38/67/61/523386761.db2.gz SAHPECMILOHKND-BETUJISGSA-N 1 0 287.325 3.945 20 10 CHCDRO COc1ccc(F)cc1[C@H](C)[NH2+]Cc1cc(C)ccc1O ZINC000071407696 524331841 /nfs/dbraw/zinc/33/18/41/524331841.db2.gz VVBXWADCHJXYNM-LBPRGKRZSA-N 1 0 289.350 3.699 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@H]2CCCc3sccc32)c1 ZINC000061359916 524755515 /nfs/dbraw/zinc/75/55/15/524755515.db2.gz GRRVKUXIDVRHMM-AWEZNQCLSA-N 1 0 289.400 3.630 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cccc(Cl)c2)c1 ZINC000053148763 524772888 /nfs/dbraw/zinc/77/28/88/524772888.db2.gz PLQQXCTTZHGRSK-NSHDSACASA-N 1 0 291.778 3.905 20 10 CHCDRO Cc1cc(N2CC=C(c3ccc(Cl)nc3)CC2)cc[nH+]1 ZINC000364367475 525053003 /nfs/dbraw/zinc/05/30/03/525053003.db2.gz XPDTUCMKHCTIFF-UHFFFAOYSA-N 1 0 285.778 3.732 20 10 CHCDRO CSCCC[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000069434185 525484359 /nfs/dbraw/zinc/48/43/59/525484359.db2.gz MGRZXUYJXNSZNG-GFCCVEGCSA-N 1 0 275.417 3.949 20 10 CHCDRO C[C@@H]([NH2+]Cc1cc(-c2ccccc2)ccc1O)[C@@H]1CCOC1 ZINC000266149685 525511693 /nfs/dbraw/zinc/51/16/93/525511693.db2.gz JZRHMFVKZXNGGZ-RHSMWYFYSA-N 1 0 297.398 3.574 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1O)c1ccccc1 ZINC000094616546 525603692 /nfs/dbraw/zinc/60/36/92/525603692.db2.gz CYAKLAOOEDQXMZ-NEPJUHHUSA-N 1 0 259.324 3.943 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCc2c1cccc2O)c1ccc(N(C)C)cc1 ZINC000130333732 525650973 /nfs/dbraw/zinc/65/09/73/525650973.db2.gz YHOIYGFUROTYOK-FZKQIMNGSA-N 1 0 296.414 3.796 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCc2ccc(O)cc2)c(O)c1C ZINC000273301194 525728277 /nfs/dbraw/zinc/72/82/77/525728277.db2.gz BOASVZWVMNMGFZ-CQSZACIVSA-N 1 0 285.387 3.608 20 10 CHCDRO COc1cccc(C[N@H+](C)[C@@H](C)c2ccccc2F)c1O ZINC000129727119 525916363 /nfs/dbraw/zinc/91/63/63/525916363.db2.gz UKKXBQMQSSRHHI-LBPRGKRZSA-N 1 0 289.350 3.733 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000278366488 526364051 /nfs/dbraw/zinc/36/40/51/526364051.db2.gz KCTUURRCRVTJJJ-SECBINFHSA-N 1 0 293.716 3.820 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCCCSC)cc1 ZINC000133607987 1125480392 /nfs/dbraw/zinc/48/03/92/1125480392.db2.gz CHGGTKISGHBZTF-CQSZACIVSA-N 1 0 280.481 3.937 20 10 CHCDRO CCCC[C@@H](C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000050887547 1119302640 /nfs/dbraw/zinc/30/26/40/1119302640.db2.gz QCVJDUMDQVTNIL-OAHLLOKOSA-N 1 0 260.425 3.955 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)o1 ZINC000113314198 1125494635 /nfs/dbraw/zinc/49/46/35/1125494635.db2.gz PYNNFTNXQWYWCS-GFCCVEGCSA-N 1 0 276.355 3.644 20 10 CHCDRO CCCN(C[C@H]1CC=CCC1)c1ccc(C[NH3+])cc1 ZINC000775141142 1122440344 /nfs/dbraw/zinc/44/03/44/1122440344.db2.gz XNDQQPCVAWUWBN-INIZCTEOSA-N 1 0 258.409 3.718 20 10 CHCDRO CC[C@@H]([NH2+]CCCCOC)c1cc(Cl)ccc1O ZINC000775488158 1122616994 /nfs/dbraw/zinc/61/69/94/1122616994.db2.gz MXIVWFNGKPZCIH-CYBMUJFWSA-N 1 0 271.788 3.513 20 10 CHCDRO CC[C@@H](C)N(C)CC[NH2+][C@@H](CC)c1cc(Cl)ccc1O ZINC000775501927 1122628677 /nfs/dbraw/zinc/62/86/77/1122628677.db2.gz URDPIWVHSUYVPP-DOMZBBRYSA-N 1 0 298.858 3.817 20 10 CHCDRO Cc1cc(C[N@H+]2CC[C@@H](C)[C@H](C)C2)ccc1N(C)C ZINC001192261695 1122636627 /nfs/dbraw/zinc/63/66/27/1122636627.db2.gz FYJMTLGRARWPNT-UKRRQHHQSA-N 1 0 260.425 3.539 20 10 CHCDRO CN(C)c1cc(F)c(C[NH2+][C@H]2CCC(C)(C)C2)cc1F ZINC001201490944 1123109533 /nfs/dbraw/zinc/10/95/33/1123109533.db2.gz GCPLSABNGGITGN-LBPRGKRZSA-N 1 0 282.378 3.699 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CC[C@H]2CC2(F)F)cc1 ZINC000857081457 1123585545 /nfs/dbraw/zinc/58/55/45/1123585545.db2.gz PDMPXYRKCBTSBB-JSGCOSHPSA-N 1 0 282.378 3.839 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CC[C@@H]2CC2(F)F)cc1 ZINC000857081456 1123585695 /nfs/dbraw/zinc/58/56/95/1123585695.db2.gz PDMPXYRKCBTSBB-GXTWGEPZSA-N 1 0 282.378 3.839 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1C[C@H](OC)C1)c1cc(Cl)ccc1O ZINC000883272206 1125390048 /nfs/dbraw/zinc/39/00/48/1125390048.db2.gz GUADRYDTXROLDW-MPKXVKKWSA-N 1 0 283.799 3.511 20 10 CHCDRO COc1cccc(C[NH+](CC(C)C)CC(C)C)c1O ZINC000132494077 1125419145 /nfs/dbraw/zinc/41/91/45/1125419145.db2.gz UXCYQFGZDNHTIR-UHFFFAOYSA-N 1 0 265.397 3.515 20 10 CHCDRO C[C@]1(C[NH2+]Cc2c(O)cccc2Cl)CC1(Cl)Cl ZINC000824765851 1131482410 /nfs/dbraw/zinc/48/24/10/1131482410.db2.gz PTFJLWHPWLRIDQ-LLVKDONJSA-N 1 0 294.609 3.719 20 10 CHCDRO CO[C@@H](C[NH2+][C@@H](C)c1ccc(Cl)cc1O)C(C)(C)C ZINC000841756177 1132391952 /nfs/dbraw/zinc/39/19/52/1132391952.db2.gz USXCGUDSGUMFEM-HZMBPMFUSA-N 1 0 285.815 3.757 20 10 CHCDRO Cc1csc(C(C)(C)[NH2+]Cc2ccc(N(C)C)cc2)n1 ZINC000116382083 1125510416 /nfs/dbraw/zinc/51/04/16/1125510416.db2.gz LZWHMMHUQUHJCC-UHFFFAOYSA-N 1 0 289.448 3.542 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCOC(C)(C)C1)c1ccc(N(C)C)cc1 ZINC000119314702 1125531872 /nfs/dbraw/zinc/53/18/72/1125531872.db2.gz BGVVATZJULIKMS-WBVHZDCISA-N 1 0 290.451 3.751 20 10 CHCDRO C[C@H]1CC[C@@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000135166586 1125579887 /nfs/dbraw/zinc/57/98/87/1125579887.db2.gz GASYKDIUNRZAPU-DOTOQJQBSA-N 1 0 272.436 3.955 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cccs1 ZINC000037362888 1125623627 /nfs/dbraw/zinc/62/36/27/1125623627.db2.gz GKQAYSFTGURXQK-NSHDSACASA-N 1 0 259.374 3.534 20 10 CHCDRO CCOc1cccc(C[N@@H+]2[C@H](C)CC[C@@H]2CC)c1O ZINC000136821708 1125647893 /nfs/dbraw/zinc/64/78/93/1125647893.db2.gz QXRZNKQAVXPVON-OCCSQVGLSA-N 1 0 263.381 3.554 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCC(F)(F)C2)c1 ZINC000310976471 1125653758 /nfs/dbraw/zinc/65/37/58/1125653758.db2.gz QHHTVMYVFOLJAG-QWRGUYRKSA-N 1 0 255.308 3.539 20 10 CHCDRO C[C@H]([NH2+]Cc1cc(C2CC2)no1)c1ccc(Cl)cc1O ZINC000886684701 1125709572 /nfs/dbraw/zinc/70/95/72/1125709572.db2.gz QFLWLWIGGHAYPO-VIFPVBQESA-N 1 0 292.766 3.762 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CC2(CCOC)CC2)cc1 ZINC000090537123 1125743058 /nfs/dbraw/zinc/74/30/58/1125743058.db2.gz RUMGKVKMIFKUEY-HNNXBMFYSA-N 1 0 290.451 3.610 20 10 CHCDRO CCSCC[C@@H](C)[NH2+]Cc1cccc(CC)c1O ZINC000691498836 1129977235 /nfs/dbraw/zinc/97/72/35/1129977235.db2.gz DHUUOZBJCPUONG-GFCCVEGCSA-N 1 0 267.438 3.576 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]Cc2cccc(C)c2O)c1 ZINC000158113637 1126746306 /nfs/dbraw/zinc/74/63/06/1126746306.db2.gz QBNIPIAXMNCHOE-CYBMUJFWSA-N 1 0 271.360 3.560 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](c2ccccn2)C2CC2)c1 ZINC000903334464 1126801509 /nfs/dbraw/zinc/80/15/09/1126801509.db2.gz AEWHNEGFDZSWAR-SGTLLEGYSA-N 1 0 298.386 3.598 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]C1(c2cccc(Cl)c2)CC1 ZINC000180778855 1126848079 /nfs/dbraw/zinc/84/80/79/1126848079.db2.gz XOBLQLWWKVCGEX-UHFFFAOYSA-N 1 0 291.753 3.964 20 10 CHCDRO CC(C)([NH3+])c1ccc(NCc2cc(Cl)ccc2O)cc1 ZINC000904470035 1126853137 /nfs/dbraw/zinc/85/31/37/1126853137.db2.gz FMSSLPWQYBMUCQ-UHFFFAOYSA-N 1 0 290.794 3.852 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](C)[C@H](C)c2ccccn2)cc1C ZINC000182067376 1126865568 /nfs/dbraw/zinc/86/55/68/1126865568.db2.gz AWKKSQODNOIXKL-CQSZACIVSA-N 1 0 270.376 3.597 20 10 CHCDRO CC[C@@](C)([NH2+]Cc1cccc(C)c1O)c1nc(C)cs1 ZINC000182226543 1126869115 /nfs/dbraw/zinc/86/91/15/1126869115.db2.gz UHERIJQHGVQSNB-MRXNPFEDSA-N 1 0 290.432 3.881 20 10 CHCDRO Cc1cnc([C@@H](C)C[NH2+][C@@H](C)c2cc(F)ccc2O)s1 ZINC000183198724 1126882474 /nfs/dbraw/zinc/88/24/74/1126882474.db2.gz TUTJPWQMBPHLHA-ONGXEEELSA-N 1 0 294.395 3.751 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCCCC[C@H]1c1ccncc1 ZINC000183292308 1126885237 /nfs/dbraw/zinc/88/52/37/1126885237.db2.gz OZHJUSXATHSIIS-KRWDZBQOSA-N 1 0 282.387 3.905 20 10 CHCDRO COc1ccc(CCC[NH2+][C@@H](C)c2ccccc2O)cc1 ZINC000183435777 1126886485 /nfs/dbraw/zinc/88/64/85/1126886485.db2.gz LJKLBUAEJIOATI-AWEZNQCLSA-N 1 0 285.387 3.684 20 10 CHCDRO COCCC1(C[NH2+][C@H](C)c2ccccc2O)CCCC1 ZINC000183560746 1126888795 /nfs/dbraw/zinc/88/87/95/1126888795.db2.gz LVTGWIRQNNKVAP-CQSZACIVSA-N 1 0 277.408 3.640 20 10 CHCDRO C[C@H](C[C@@H](O)c1cccs1)[NH2+][C@@H](C)c1ccccc1O ZINC000183588014 1126889331 /nfs/dbraw/zinc/88/93/31/1126889331.db2.gz AVXPUUSSKMEEBU-TYNCELHUSA-N 1 0 291.416 3.617 20 10 CHCDRO C[C@H]([NH2+]CC1([C@@H](O)c2ccccc2)CC1)c1ccccc1O ZINC000183627069 1126889686 /nfs/dbraw/zinc/88/96/86/1126889686.db2.gz RAOMHBXYKJKIHI-KSSFIOAISA-N 1 0 297.398 3.557 20 10 CHCDRO C[C@@H]([NH2+]CC1([C@H](O)c2ccccc2)CC1)c1ccccc1O ZINC000183627052 1126890123 /nfs/dbraw/zinc/89/01/23/1126890123.db2.gz RAOMHBXYKJKIHI-RDTXWAMCSA-N 1 0 297.398 3.557 20 10 CHCDRO CCO[C@@H](CC[NH2+][C@@H](C)c1cc(OC)ccc1O)C(C)C ZINC000185625591 1126901235 /nfs/dbraw/zinc/90/12/35/1126901235.db2.gz UNZSPFYEXPPCQQ-GUYCJALGSA-N 1 0 295.423 3.503 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]Cc1cccnc1C ZINC001118808564 1131238494 /nfs/dbraw/zinc/23/84/94/1131238494.db2.gz RZYMONMLTFNMEA-IUODEOHRSA-N 1 0 282.387 3.742 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC[C@@](C)(O)c2ccccc2)c(O)c1 ZINC000187927102 1126917775 /nfs/dbraw/zinc/91/77/75/1126917775.db2.gz MGJOUWPESOIRTI-HNAYVOBHSA-N 1 0 299.414 3.649 20 10 CHCDRO CCOC1CC(CC[NH2+][C@H](C)c2ccc(N(C)C)cc2)C1 ZINC000189258814 1126929790 /nfs/dbraw/zinc/92/97/90/1126929790.db2.gz ZPHQKZZUTUSVML-KSTDHSDQSA-N 1 0 290.451 3.608 20 10 CHCDRO CCc1cnc(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)s1 ZINC000284307307 1126982592 /nfs/dbraw/zinc/98/25/92/1126982592.db2.gz ZALNLEMWUZARDR-LBPRGKRZSA-N 1 0 290.432 3.879 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CC[C@@H]1C)c1cc(Cl)ccc1O ZINC000797126900 1130964010 /nfs/dbraw/zinc/96/40/10/1130964010.db2.gz BTXXVDMZSOTDGK-XDTLVQLUSA-N 1 0 253.773 3.885 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CC[C@@H]1C)c1cc(Cl)ccc1O ZINC000797126898 1130964346 /nfs/dbraw/zinc/96/43/46/1130964346.db2.gz BTXXVDMZSOTDGK-TVYUQYBPSA-N 1 0 253.773 3.885 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCSC1)c1ccc(N2CCCCC2)cc1 ZINC000271422917 1127079438 /nfs/dbraw/zinc/07/94/38/1127079438.db2.gz ASNQFTSPWVRJPX-GDBMZVCRSA-N 1 0 290.476 3.833 20 10 CHCDRO Cn1ccc(C[N@H+](C)Cc2ccc(N3CCCCC3)cc2)c1 ZINC000156479776 1127157913 /nfs/dbraw/zinc/15/79/13/1127157913.db2.gz PBALUUZRBXOEAN-UHFFFAOYSA-N 1 0 297.446 3.647 20 10 CHCDRO Cc1cc([C@H](C)[NH2+]Cc2ccc3c(c2)CCO3)c(C)o1 ZINC000044729992 1127158901 /nfs/dbraw/zinc/15/89/01/1127158901.db2.gz ANKSIFLCQQAFFZ-LBPRGKRZSA-N 1 0 271.360 3.682 20 10 CHCDRO CC[N@H+](CCc1nccs1)Cc1cc(C)cc(C)c1O ZINC000164608371 1127172352 /nfs/dbraw/zinc/17/23/52/1127172352.db2.gz VKIYSNLSJFYMJG-UHFFFAOYSA-N 1 0 290.432 3.530 20 10 CHCDRO CC(C)=CCC[NH2+]Cc1cc(Cl)c(F)cc1[O-] ZINC000816590489 1131108078 /nfs/dbraw/zinc/10/80/78/1131108078.db2.gz BTQGKWLUKXDARG-UHFFFAOYSA-N 1 0 257.736 3.631 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccc(F)cc2)c(O)c1 ZINC000284199147 1127178351 /nfs/dbraw/zinc/17/83/51/1127178351.db2.gz RZQZMGREDIWTEP-CYBMUJFWSA-N 1 0 273.351 3.999 20 10 CHCDRO C[C@H]1CCCCC[N@@H+]1Cc1cc(F)cc(Cl)c1[O-] ZINC001237814543 1131142747 /nfs/dbraw/zinc/14/27/47/1131142747.db2.gz SSGXEBXKZUGAFK-JTQLQIEISA-N 1 0 271.763 3.949 20 10 CHCDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]Cc1ccoc1 ZINC000168737487 1127224612 /nfs/dbraw/zinc/22/46/12/1127224612.db2.gz CBWWQHDNBKVUJE-WCQYABFASA-N 1 0 257.333 3.632 20 10 CHCDRO C[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1cc(F)c(Cl)cc1[O-] ZINC001237937061 1131154021 /nfs/dbraw/zinc/15/40/21/1131154021.db2.gz NKHBIQXXYIQTRT-VHSXEESVSA-N 1 0 271.763 3.805 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2c(F)cncc2F)c1 ZINC000285731454 1127241324 /nfs/dbraw/zinc/24/13/24/1127241324.db2.gz QTYWWSGWYCKREH-WDEREUQCSA-N 1 0 292.329 3.786 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCCSC1)c1ccc(C)cc1O ZINC000286973788 1127277730 /nfs/dbraw/zinc/27/77/30/1127277730.db2.gz IQLGVXJTEMWDSR-HIFRSBDPSA-N 1 0 279.449 3.885 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+]C/C=C\c1ccncc1 ZINC000355123413 1127318407 /nfs/dbraw/zinc/31/84/07/1127318407.db2.gz JXOSDBZTODSWRC-WAYWQWQTSA-N 1 0 291.398 3.685 20 10 CHCDRO COCCC(C)(C)C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000760894219 1127319622 /nfs/dbraw/zinc/31/96/22/1127319622.db2.gz KCVBADBSHFOUQG-YPMHNXCESA-N 1 0 295.398 3.732 20 10 CHCDRO CC[C@@H](CC(F)(F)F)[NH2+][C@H](C)c1cc(OC)ccc1O ZINC000760905146 1127325547 /nfs/dbraw/zinc/32/55/47/1127325547.db2.gz JEVZFUVSZXSWMK-ZJUUUORDSA-N 1 0 291.313 3.782 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H]2c3ccccc3O[C@H]2C)cc1C ZINC000288544454 1127346259 /nfs/dbraw/zinc/34/62/59/1127346259.db2.gz LBBSCHLLNYNZHH-SCLBCKFNSA-N 1 0 283.371 3.621 20 10 CHCDRO Cc1ccc(C2CC([NH2+]Cc3ccccc3O)C2)cc1 ZINC000167498478 1127363768 /nfs/dbraw/zinc/36/37/68/1127363768.db2.gz ROBOTDOYZJAHGO-UHFFFAOYSA-N 1 0 267.372 3.736 20 10 CHCDRO COC[C@H](CC(C)(C)C)[NH2+]Cc1c(O)cccc1Cl ZINC001308449206 1127384358 /nfs/dbraw/zinc/38/43/58/1127384358.db2.gz RJXMEXRXWOLVGM-NSHDSACASA-N 1 0 285.815 3.586 20 10 CHCDRO C[C@@H]([NH2+]Cc1cc(Br)ccc1O)C1CCCC1 ZINC000226767118 1127422986 /nfs/dbraw/zinc/42/29/86/1127422986.db2.gz LBMRESNWGQMCGQ-SNVBAGLBSA-N 1 0 298.224 3.823 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccoc1)c1ccc2ccccc2c1O ZINC000168737666 1127464278 /nfs/dbraw/zinc/46/42/78/1127464278.db2.gz BGCKPCFTPRVPSI-GFCCVEGCSA-N 1 0 267.328 3.989 20 10 CHCDRO CCc1noc(C)c1C[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000293746387 1127517241 /nfs/dbraw/zinc/51/72/41/1127517241.db2.gz PVGQEECRBLXMNV-GFCCVEGCSA-N 1 0 288.391 3.719 20 10 CHCDRO Cc1ccoc1C[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000293785212 1127520355 /nfs/dbraw/zinc/52/03/55/1127520355.db2.gz UCKJTQLOJFWVPT-JTQLQIEISA-N 1 0 265.740 3.798 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CC[C@H](C)C(C)(C)C2)c1O ZINC000761225923 1127550353 /nfs/dbraw/zinc/55/03/53/1127550353.db2.gz MYEGECKUAPJDRX-ZDUSSCGKSA-N 1 0 277.408 3.659 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCc2cc(F)cc(F)c2)c(O)c1 ZINC000060717708 1127564590 /nfs/dbraw/zinc/56/45/90/1127564590.db2.gz FLJIBDQWGJTQMX-GFCCVEGCSA-N 1 0 291.341 3.872 20 10 CHCDRO COc1cc(Cl)cc(C[N@H+](C)[C@H](C)C(C)C)c1O ZINC000228598927 1127569764 /nfs/dbraw/zinc/56/97/64/1127569764.db2.gz AJDQWRFASVJKTE-SNVBAGLBSA-N 1 0 271.788 3.531 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+][C@@H]2CCCC2(C)C)c1O ZINC000228675896 1127585446 /nfs/dbraw/zinc/58/54/46/1127585446.db2.gz FBQSLMDYEVTNHK-CYBMUJFWSA-N 1 0 283.799 3.723 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CCc2ccncc2C)c(O)c1 ZINC000294698882 1127593187 /nfs/dbraw/zinc/59/31/87/1127593187.db2.gz IXZFDGJNLBTVEF-HNNXBMFYSA-N 1 0 284.403 3.606 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+][C@@H]2CCCSC2)c(O)c1 ZINC000294895842 1127607115 /nfs/dbraw/zinc/60/71/15/1127607115.db2.gz VQKBUQUBSZHJEB-CHWSQXEVSA-N 1 0 265.422 3.555 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CCOC(C)(C)C2)c(O)c1 ZINC000294856452 1127604599 /nfs/dbraw/zinc/60/45/99/1127604599.db2.gz SSWYYKSCSQFKSJ-UONOGXRCSA-N 1 0 277.408 3.617 20 10 CHCDRO Cc1cc(C[NH2+][C@H]2CCc3cccc(O)c32)ccc1F ZINC000295886037 1127656626 /nfs/dbraw/zinc/65/66/26/1127656626.db2.gz HXQIDADZADVWBR-HNNXBMFYSA-N 1 0 271.335 3.617 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C2CCC(F)(F)CC2)cc1F ZINC000761336126 1127666565 /nfs/dbraw/zinc/66/65/65/1127666565.db2.gz VNNULXXKUGOKRB-UHFFFAOYSA-N 1 0 286.341 3.559 20 10 CHCDRO Cc1cnc([C@H](C)C[NH2+][C@H]2CCc3cccc(O)c32)s1 ZINC000296275613 1127667011 /nfs/dbraw/zinc/66/70/11/1127667011.db2.gz CKIFILYDWWRDMR-MFKMUULPSA-N 1 0 288.416 3.538 20 10 CHCDRO Cc1ncsc1CC[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000296367562 1127670144 /nfs/dbraw/zinc/67/01/44/1127670144.db2.gz JBUDKZSYBFKSMD-LBPRGKRZSA-N 1 0 290.432 3.667 20 10 CHCDRO CCO[C@H](C[NH2+][C@H]1CCc2cccc(O)c21)c1ccccc1 ZINC000296584083 1127676728 /nfs/dbraw/zinc/67/67/28/1127676728.db2.gz WGSHXXYLUKZNAW-FUHWJXTLSA-N 1 0 297.398 3.747 20 10 CHCDRO Cc1ncsc1CC[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000296640929 1127680379 /nfs/dbraw/zinc/68/03/79/1127680379.db2.gz YARGXENFALQBRD-SECBINFHSA-N 1 0 296.823 3.704 20 10 CHCDRO CSCCCCC[NH2+]Cc1c(O)cccc1Cl ZINC000229517937 1127692733 /nfs/dbraw/zinc/69/27/33/1127692733.db2.gz JBMPBPIILBKMTI-UHFFFAOYSA-N 1 0 273.829 3.669 20 10 CHCDRO CCOc1cccc(C[NH2+]CC2(C)CCCCC2)c1O ZINC000229587536 1127697696 /nfs/dbraw/zinc/69/76/96/1127697696.db2.gz HZKMPYQBHCBUJS-UHFFFAOYSA-N 1 0 277.408 3.851 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@H]1CCc3cc(F)ccc31)CC2 ZINC000297619727 1127701971 /nfs/dbraw/zinc/70/19/71/1127701971.db2.gz IWTMLCBPFSNJGZ-JKSUJKDBSA-N 1 0 283.346 3.796 20 10 CHCDRO CCCC1(C[NH2+]Cc2cc(Cl)cc(OC)c2O)CC1 ZINC000230935229 1127784936 /nfs/dbraw/zinc/78/49/36/1127784936.db2.gz BARPOADTOBLPCO-UHFFFAOYSA-N 1 0 283.799 3.724 20 10 CHCDRO C[C@H]([NH2+]CCc1nccs1)c1ccc2ccccc2c1O ZINC000063133431 1127797928 /nfs/dbraw/zinc/79/79/28/1127797928.db2.gz DMICIVVYILQBJO-LBPRGKRZSA-N 1 0 298.411 3.895 20 10 CHCDRO Cc1ccc2c(c1)[C@H]([NH2+][C@@H](C)c1cc(C)ccc1O)CO2 ZINC000373265108 1127831204 /nfs/dbraw/zinc/83/12/04/1127831204.db2.gz IDFLYKXCPCBUSJ-XJKSGUPXSA-N 1 0 283.371 3.793 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC(C2CC2)C2CC2)c(O)c1 ZINC000088455751 1127938295 /nfs/dbraw/zinc/93/82/95/1127938295.db2.gz BGCXUJPTRLIXNB-LBPRGKRZSA-N 1 0 259.393 3.787 20 10 CHCDRO C[C@@]1(F)CCC[N@H+](Cc2ccc(C(F)(F)F)cc2O)C1 ZINC001233451834 1127967465 /nfs/dbraw/zinc/96/74/65/1127967465.db2.gz AUNPPORSOKOUSR-CYBMUJFWSA-N 1 0 291.288 3.735 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)C1CC(F)(F)C1 ZINC000924648208 1128109268 /nfs/dbraw/zinc/10/92/68/1128109268.db2.gz KUUHICOQFNVNFF-CYBMUJFWSA-N 1 0 294.389 3.810 20 10 CHCDRO C[C@H]1CCC[N@H+](Cc2cc(Br)ccc2O)[C@H]1C ZINC000252151798 1128115603 /nfs/dbraw/zinc/11/56/03/1128115603.db2.gz MPKSUGGPLSTEDZ-QWRGUYRKSA-N 1 0 298.224 3.775 20 10 CHCDRO CCC[C@@H](CCO)C[NH2+][C@@H](CC)c1ccc(N(C)C)cc1 ZINC000152473782 1128127461 /nfs/dbraw/zinc/12/74/61/1128127461.db2.gz TYKWSQWODQCOLV-YJBOKZPZSA-N 1 0 292.467 3.592 20 10 CHCDRO C[C@@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)[C@H]1C ZINC000252178072 1128129157 /nfs/dbraw/zinc/12/91/57/1128129157.db2.gz PKNQACNRWZBPEN-MNOVXSKESA-N 1 0 253.773 3.666 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H]2CCC[C@H]2CCCF)cc1 ZINC000800965092 1128160356 /nfs/dbraw/zinc/16/03/56/1128160356.db2.gz CHLIURNXFYKROB-RDJZCZTQSA-N 1 0 278.415 3.761 20 10 CHCDRO Cc1cc(C)c(C[NH2+][C@@H](C)Cc2cccc(F)c2)c(O)c1 ZINC001168465211 1128169869 /nfs/dbraw/zinc/16/98/69/1128169869.db2.gz POORRGPOSCCRFW-AWEZNQCLSA-N 1 0 287.378 3.869 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc3c(c2)C[C@@H](C)O3)c1 ZINC000926921007 1128202946 /nfs/dbraw/zinc/20/29/46/1128202946.db2.gz UHTQUZNACPOKPS-ZIAGYGMSSA-N 1 0 297.398 3.875 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1C[C@H]1C(F)(F)F)c1ccc(N(C)C)cc1 ZINC000926951184 1128205442 /nfs/dbraw/zinc/20/54/42/1128205442.db2.gz XCKQTVGLBVTXFX-VHRBIJSZSA-N 1 0 286.341 3.602 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1C[C@H]1C(F)(F)F)c1ccc(C)cc1O ZINC000926951447 1128205796 /nfs/dbraw/zinc/20/57/96/1128205796.db2.gz RDDAHRSGSAESTM-UHTWSYAYSA-N 1 0 287.325 3.940 20 10 CHCDRO C[C@@H]([NH2+]C[C@]1(c2ccccc2)CCCO1)c1ccccc1O ZINC000927114175 1128219008 /nfs/dbraw/zinc/21/90/08/1128219008.db2.gz CSSUIOCKCLRWKO-BEFAXECRSA-N 1 0 297.398 3.749 20 10 CHCDRO CCc1onc(C)c1C[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000927133369 1128221230 /nfs/dbraw/zinc/22/12/30/1128221230.db2.gz CITJDOIEFNMLMQ-SECBINFHSA-N 1 0 294.782 3.755 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]CCC2CC(OC(C)(C)C)C2)c1 ZINC000762455045 1128300935 /nfs/dbraw/zinc/30/09/35/1128300935.db2.gz GUSDNEMBIBLVDG-UHFFFAOYSA-N 1 0 291.435 3.774 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCc2ccccc2)c1 ZINC000035628640 1128319922 /nfs/dbraw/zinc/31/99/22/1128319922.db2.gz JCGRAVMKQOIGAP-AWEZNQCLSA-N 1 0 255.361 3.594 20 10 CHCDRO CS[C@@H](C[NH2+]Cc1cc(C)ccc1O)C(C)(C)C ZINC000784626383 1128331279 /nfs/dbraw/zinc/33/12/79/1128331279.db2.gz RXSXJTXRRGIMKP-AWEZNQCLSA-N 1 0 267.438 3.568 20 10 CHCDRO C[N@H+](Cc1ccccc1)Cc1cc2c(cc1O)CCC2 ZINC000915789707 1128338459 /nfs/dbraw/zinc/33/84/59/1128338459.db2.gz GQSDYHWZZCYVGB-UHFFFAOYSA-N 1 0 267.372 3.513 20 10 CHCDRO COc1cc(C[N@@H+]2CCC[C@@H](C)C2)c(O)c(C(C)(C)C)c1 ZINC000915790403 1128338565 /nfs/dbraw/zinc/33/85/65/1128338565.db2.gz ICTVYRPCRYBFBL-CYBMUJFWSA-N 1 0 291.435 3.930 20 10 CHCDRO C[C@H]1CC[N@H+](Cc2c(O)ccc3ccccc32)C[C@@H]1F ZINC000777970820 1128351824 /nfs/dbraw/zinc/35/18/24/1128351824.db2.gz WGQRSYNCWHOPDA-LRDDRELGSA-N 1 0 273.351 3.725 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C[C@H]1F ZINC000777967748 1128352185 /nfs/dbraw/zinc/35/21/85/1128352185.db2.gz ZAMAMLSNMCDXTO-BXUZGUMPSA-N 1 0 295.398 3.575 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](c2ccncc2)C2CC2)cc1C ZINC000934701450 1128467257 /nfs/dbraw/zinc/46/72/57/1128467257.db2.gz POMSHWUSUFJLLF-GOSISDBHSA-N 1 0 282.387 3.640 20 10 CHCDRO Cc1cc(C[NH2+][C@H](c2ccncc2)C2CC2)ccc1N(C)C ZINC000934700339 1128467305 /nfs/dbraw/zinc/46/73/05/1128467305.db2.gz QEEFQSDLDCKYMC-IBGZPJMESA-N 1 0 295.430 3.697 20 10 CHCDRO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)C[C@@H]1CCCCO1 ZINC000917074623 1128473929 /nfs/dbraw/zinc/47/39/29/1128473929.db2.gz DCQLMAABACTDNW-SFHVURJKSA-N 1 0 290.451 3.532 20 10 CHCDRO Cc1cccc(C)c1C[N@H+](C)Cc1ccccc1O ZINC000154987460 1128611104 /nfs/dbraw/zinc/61/11/04/1128611104.db2.gz AYYOKJMJWXCVCC-UHFFFAOYSA-N 1 0 255.361 3.641 20 10 CHCDRO CC[C@@H]([NH2+]CCCNc1ccccc1)c1ccccc1O ZINC000155889405 1128617858 /nfs/dbraw/zinc/61/78/58/1128617858.db2.gz CRKVSNZUPZLVLB-QGZVFWFLSA-N 1 0 284.403 3.935 20 10 CHCDRO CCO[C@@H](CC[NH2+][C@H](CC)c1ccccc1O)C(C)C ZINC000156164613 1128629044 /nfs/dbraw/zinc/62/90/44/1128629044.db2.gz MOOSWOKYJLMMEE-WBVHZDCISA-N 1 0 279.424 3.884 20 10 CHCDRO C[C@@H]1c2ccccc2CC[N@H+]1Cc1cc(F)ccc1O ZINC000779015206 1128680179 /nfs/dbraw/zinc/68/01/79/1128680179.db2.gz SEIDSULDUPEGOU-GFCCVEGCSA-N 1 0 271.335 3.651 20 10 CHCDRO C[C@@H]1[C@@H](c2ccccc2)CC[N@@H+]1Cc1cc(F)ccc1O ZINC000779022678 1128685560 /nfs/dbraw/zinc/68/55/60/1128685560.db2.gz FTTMQSNWRPCOEN-DYVFJYSZSA-N 1 0 285.362 3.909 20 10 CHCDRO C[C@H]([NH2+]Cc1ccccc1O)c1ccc(OC(F)F)cc1 ZINC000134225965 1128706007 /nfs/dbraw/zinc/70/60/07/1128706007.db2.gz VPKIWPRROOPKQO-NSHDSACASA-N 1 0 293.313 3.844 20 10 CHCDRO Cc1ccc(CCC[NH2+]Cc2ccccc2O)c(C)c1 ZINC000779052918 1128709869 /nfs/dbraw/zinc/70/98/69/1128709869.db2.gz VIAJPVYNKBICOQ-UHFFFAOYSA-N 1 0 269.388 3.731 20 10 CHCDRO C[C@H]1C[C@H]1c1ccc(C[NH2+]Cc2cc(F)ccc2O)o1 ZINC000779065327 1128716403 /nfs/dbraw/zinc/71/64/03/1128716403.db2.gz PDUVMHROXBXODX-IINYFYTJSA-N 1 0 275.323 3.538 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+]C[C@@H]2CCC(C)(C)O2)c2c1c(F)ccc2O ZINC000779078455 1128722134 /nfs/dbraw/zinc/72/21/34/1128722134.db2.gz GHNFBFVAPXSAAX-MDZLAQPJSA-N 1 0 293.382 3.627 20 10 CHCDRO CC1CCC(C)([NH2+]Cc2cc(F)ccc2O)CC1 ZINC000779075704 1128719670 /nfs/dbraw/zinc/71/96/70/1128719670.db2.gz YTFVQIWZDBQCNQ-UHFFFAOYSA-N 1 0 251.345 3.590 20 10 CHCDRO CC[C@](C)([NH2+]Cc1cc(F)ccc1O)c1ccccc1 ZINC000779084683 1128725879 /nfs/dbraw/zinc/72/58/79/1128725879.db2.gz JIBVXXWZUFSEEE-KRWDZBQOSA-N 1 0 273.351 3.946 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]C1(Cc2ccccc2)CCC1 ZINC000779090361 1128728595 /nfs/dbraw/zinc/72/85/95/1128728595.db2.gz GWEUHUCSODTRTG-UHFFFAOYSA-N 1 0 285.362 3.786 20 10 CHCDRO CCCCC[N@H+](Cc1cc(OC)c(OC)cc1O)C(C)C ZINC000159858282 1128733523 /nfs/dbraw/zinc/73/35/23/1128733523.db2.gz HOJKHCVWZPIWRC-UHFFFAOYSA-N 1 0 295.423 3.810 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCc2c(F)cccc2F)c1 ZINC000185067590 1117759766 /nfs/dbraw/zinc/75/97/66/1117759766.db2.gz YYCFOQWWYBFZCO-GFCCVEGCSA-N 1 0 291.341 3.872 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc([C@H](C)O)cc2)c1 ZINC000185119608 1117765250 /nfs/dbraw/zinc/76/52/50/1117765250.db2.gz VQCZIFUVEBYVPF-KGLIPLIRSA-N 1 0 285.387 3.605 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C2CC2)C2CCC2)c1 ZINC000325004527 1117778970 /nfs/dbraw/zinc/77/89/70/1117778970.db2.gz BBZOZKAQBKDARH-GTNSWQLSSA-N 1 0 275.392 3.630 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(F)c(F)c1)c1ccccc1O ZINC000049577324 1117782561 /nfs/dbraw/zinc/78/25/61/1117782561.db2.gz JEXDFSQHBZGKIJ-SNVBAGLBSA-N 1 0 263.287 3.521 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCOc3ccccc32)c(O)c1 ZINC000185405142 1117818410 /nfs/dbraw/zinc/81/84/10/1117818410.db2.gz NRMDKDGYETVXCZ-CABCVRRESA-N 1 0 297.398 3.918 20 10 CHCDRO CCc1nc(C[NH2+][C@H](C)c2cc(C)ccc2O)cs1 ZINC000185397078 1117819853 /nfs/dbraw/zinc/81/98/53/1117819853.db2.gz GEBNBUUIQQDDGL-LLVKDONJSA-N 1 0 276.405 3.570 20 10 CHCDRO CC[N@H+](CC[C@@H](C)SC)Cc1ccc(N(C)C)cc1 ZINC001208147662 1117826010 /nfs/dbraw/zinc/82/60/10/1117826010.db2.gz KGWKXERVHNMLAG-CQSZACIVSA-N 1 0 280.481 3.716 20 10 CHCDRO CSC[C@H](C)[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000185495025 1117829495 /nfs/dbraw/zinc/82/94/95/1117829495.db2.gz AEYMVKWRHXRZLZ-NWDGAFQWSA-N 1 0 279.449 3.673 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCCO[C@@H]2C(C)C)c1 ZINC000186093367 1117991264 /nfs/dbraw/zinc/99/12/64/1117991264.db2.gz DJJZFMUCDPPXBW-HDMKZQKVSA-N 1 0 291.435 3.802 20 10 CHCDRO CC(C)SCC[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000806167743 1118025456 /nfs/dbraw/zinc/02/54/56/1118025456.db2.gz IEIJSOHLXYLULJ-JTQLQIEISA-N 1 0 273.829 3.838 20 10 CHCDRO C[C@@H]1CCCCC[N@@H+]1Cc1cc(Cl)ccc1O ZINC000211433305 1118029964 /nfs/dbraw/zinc/02/99/64/1118029964.db2.gz DVQCITIBAWBIHS-LLVKDONJSA-N 1 0 253.773 3.810 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2Cc3ccccc32)c(O)c1 ZINC000037565737 1118031183 /nfs/dbraw/zinc/03/11/83/1118031183.db2.gz QHIHZDGQHPUNMA-ZFWWWQNUSA-N 1 0 267.372 3.691 20 10 CHCDRO COc1ccc(C[N@H+](Cc2cccc(C)c2O)C2CC2)cc1 ZINC000179609900 1128751201 /nfs/dbraw/zinc/75/12/01/1128751201.db2.gz BIEDFHGNNIDEKZ-UHFFFAOYSA-N 1 0 297.398 3.874 20 10 CHCDRO CC(C)CCC[NH2+]Cc1cccc(Br)c1[O-] ZINC000042412579 1118034661 /nfs/dbraw/zinc/03/46/61/1118034661.db2.gz DCKWOWYARATMNB-UHFFFAOYSA-N 1 0 286.213 3.681 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCc3[nH]c4ccccc4c3C2)c1O ZINC000179643049 1128752052 /nfs/dbraw/zinc/75/20/52/1128752052.db2.gz CSBXJIUEUMGZLO-UHFFFAOYSA-N 1 0 292.382 3.740 20 10 CHCDRO CC1(C[NH2+]Cc2cc(-c3ccccc3)ccc2O)CC1 ZINC000748098422 1118056282 /nfs/dbraw/zinc/05/62/82/1118056282.db2.gz CHIXVXYUZAXGPA-UHFFFAOYSA-N 1 0 267.372 3.949 20 10 CHCDRO COc1ccc(O)c(C[N@H+](C)[C@H](C)c2ccc(C)cc2)c1 ZINC000179682260 1128753836 /nfs/dbraw/zinc/75/38/36/1128753836.db2.gz OOUFZBOSMGUTBW-CQSZACIVSA-N 1 0 285.387 3.902 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2CCC[C@H]2c2cccn2C)cc1C ZINC000179706176 1128754964 /nfs/dbraw/zinc/75/49/64/1128754964.db2.gz MCMUNVKZXWWYQB-KRWDZBQOSA-N 1 0 284.403 3.685 20 10 CHCDRO Cc1cc(C[N@H+]2CCO[C@@H](C)[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC000765098291 1118134884 /nfs/dbraw/zinc/13/48/84/1118134884.db2.gz GITHWOWKYGYYHN-KBPBESRZSA-N 1 0 291.435 3.607 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C(C2CC2)C2CC2)cc1 ZINC000765346622 1118145982 /nfs/dbraw/zinc/14/59/82/1118145982.db2.gz DASGYXWJRIGVEJ-ZDUSSCGKSA-N 1 0 272.436 3.982 20 10 CHCDRO CC[C@@H](C)N(C)CC[NH2+][C@H](CC)c1ccc(N(C)C)cc1 ZINC000765657138 1118187683 /nfs/dbraw/zinc/18/76/83/1118187683.db2.gz VVBXLNISASITFZ-CRAIPNDOSA-N 1 0 291.483 3.524 20 10 CHCDRO CC[C@@H](C)N(C)CC[NH2+][C@@H](CC)c1ccc(N(C)C)cc1 ZINC000765657142 1118187893 /nfs/dbraw/zinc/18/78/93/1118187893.db2.gz VVBXLNISASITFZ-QAPCUYQASA-N 1 0 291.483 3.524 20 10 CHCDRO Cc1cc(C)cc(C[NH2+][C@@H](C)c2ccccc2O)c1 ZINC000693131056 1118219383 /nfs/dbraw/zinc/21/93/83/1118219383.db2.gz MEDNRVSMXNKSPT-AWEZNQCLSA-N 1 0 255.361 3.860 20 10 CHCDRO COc1ccc(Cl)cc1C[NH2+][C@@H](C)c1ccccc1O ZINC000179873256 1128763742 /nfs/dbraw/zinc/76/37/42/1128763742.db2.gz FXFBMAJCDQOTBP-NSHDSACASA-N 1 0 291.778 3.905 20 10 CHCDRO C[C@H]([NH2+]CCO[C@H]1CCCC[C@H]1C)c1ccccc1O ZINC000179899031 1128764587 /nfs/dbraw/zinc/76/45/87/1128764587.db2.gz NOAFLZSUMYVRFM-KEYYUXOJSA-N 1 0 277.408 3.638 20 10 CHCDRO CSCCC[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000069432200 1118242731 /nfs/dbraw/zinc/24/27/31/1118242731.db2.gz WBTLDORQAZUMOT-UHFFFAOYSA-N 1 0 278.465 3.520 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@H](C)CCC(C)(C)C)c1 ZINC000385986355 1118255745 /nfs/dbraw/zinc/25/57/45/1118255745.db2.gz ADMDQHSRFZEDHQ-GFCCVEGCSA-N 1 0 265.397 3.705 20 10 CHCDRO Cc1cncc(C[NH2+][C@@H](C)c2cc3c(cc2O)CCCC3)c1 ZINC000186191852 1118310656 /nfs/dbraw/zinc/31/06/56/1118310656.db2.gz HBYDDCCOQNKCGT-AWEZNQCLSA-N 1 0 296.414 3.825 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CC(C)(C)OC1(C)C)c1ccc(N(C)C)cc1 ZINC000779175481 1128774667 /nfs/dbraw/zinc/77/46/67/1128774667.db2.gz IDKXZDQFJBWRET-XJKSGUPXSA-N 1 0 290.451 3.749 20 10 CHCDRO Oc1ccccc1C[N@H+](Cc1ccco1)C1CCCC1 ZINC000092866769 1118496716 /nfs/dbraw/zinc/49/67/16/1118496716.db2.gz NYHMIWWFGKENJQ-UHFFFAOYSA-N 1 0 271.360 3.930 20 10 CHCDRO COc1cccc(C[N@H+](C)Cc2ccc(Cl)cc2)c1O ZINC000160810517 1118546848 /nfs/dbraw/zinc/54/68/48/1118546848.db2.gz NFKBUXWVESEBBU-UHFFFAOYSA-N 1 0 291.778 3.686 20 10 CHCDRO CCCN(Cc1ccc(F)cc1F)c1ccc(C[NH3+])cc1 ZINC000050872145 1118554985 /nfs/dbraw/zinc/55/49/85/1118554985.db2.gz YTCRHJKCNLGHEB-UHFFFAOYSA-N 1 0 290.357 3.840 20 10 CHCDRO COC1(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)CCCC1 ZINC000834813941 1118570744 /nfs/dbraw/zinc/57/07/44/1118570744.db2.gz BBJXGJXMWDYTAF-CQSZACIVSA-N 1 0 277.408 3.619 20 10 CHCDRO CSCC[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000069430842 1118572599 /nfs/dbraw/zinc/57/25/99/1118572599.db2.gz APWLSWGVJWJXSV-LLVKDONJSA-N 1 0 261.390 3.559 20 10 CHCDRO CCCCC[N@H+](C)Cc1c(O)cccc1Br ZINC000707142466 1118648850 /nfs/dbraw/zinc/64/88/50/1118648850.db2.gz IVIWXWCWJGISMH-UHFFFAOYSA-N 1 0 286.213 3.777 20 10 CHCDRO CCC(CC)[N@H+](C)Cc1c(O)cccc1Br ZINC000707142863 1118649054 /nfs/dbraw/zinc/64/90/54/1118649054.db2.gz KGYHCOWZIMLNTM-UHFFFAOYSA-N 1 0 286.213 3.775 20 10 CHCDRO CC(C)[C@@H]1CCC[N@@H+]1Cc1c(O)cccc1Br ZINC000707152894 1118651136 /nfs/dbraw/zinc/65/11/36/1118651136.db2.gz QTVQNQMVRDTYLH-ZDUSSCGKSA-N 1 0 298.224 3.775 20 10 CHCDRO Oc1cc(Cl)ccc1C[N@@H+]1CCC[C@@H]1c1cccnc1 ZINC001140461596 1118719533 /nfs/dbraw/zinc/71/95/33/1118719533.db2.gz NDGMTBCEEUTRIS-OAHLLOKOSA-N 1 0 288.778 3.778 20 10 CHCDRO C[C@H]1CC[N@H+](Cc2ccc(Cl)cc2O)CCC1(F)F ZINC001140461890 1118720458 /nfs/dbraw/zinc/72/04/58/1118720458.db2.gz WZQVLUYPEDOYFO-JTQLQIEISA-N 1 0 289.753 3.913 20 10 CHCDRO Oc1cc(Cl)ccc1C[NH+]1CCC(OC2CCC2)CC1 ZINC001140463216 1118722937 /nfs/dbraw/zinc/72/29/37/1118722937.db2.gz WAKSOFQNLFZHQQ-UHFFFAOYSA-N 1 0 295.810 3.579 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2C[C@H](C)[C@H]2c2ccccc2)c1 ZINC000180653707 1128800345 /nfs/dbraw/zinc/80/03/45/1128800345.db2.gz JLWOCYYTUWMFIG-UGSOOPFHSA-N 1 0 283.371 3.594 20 10 CHCDRO COCc1ccccc1C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000119579982 1118950603 /nfs/dbraw/zinc/95/06/03/1118950603.db2.gz SUFVTLNXZWIYGJ-HNNXBMFYSA-N 1 0 298.430 3.750 20 10 CHCDRO CCC[N@H+](CCOCc1ccccc1)Cc1ccccc1O ZINC001167521889 1118986167 /nfs/dbraw/zinc/98/61/67/1118986167.db2.gz MADOGPHNCHVGRC-UHFFFAOYSA-N 1 0 299.414 3.821 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCc2ccccc2C1)c1ccccc1O ZINC000051630628 1119059529 /nfs/dbraw/zinc/05/95/29/1119059529.db2.gz PDUOEDIFTXLFGN-AEFFLSMTSA-N 1 0 281.399 3.990 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)Cc2ccsc2)c1 ZINC000049154881 1119087056 /nfs/dbraw/zinc/08/70/56/1119087056.db2.gz WSSNLLDDFKOYDP-RYUDHWBXSA-N 1 0 291.416 3.744 20 10 CHCDRO Cc1cc(C)cc(C[NH2+]Cc2ccc(N(C)C)cc2)c1 ZINC000049900227 1119131376 /nfs/dbraw/zinc/13/13/76/1119131376.db2.gz FJVAQYKDPTXFAU-UHFFFAOYSA-N 1 0 268.404 3.659 20 10 CHCDRO C[C@@H]1CCC[C@H]([N@H+](C)Cc2cc(F)ccc2O)C1 ZINC000226562216 1119157321 /nfs/dbraw/zinc/15/73/21/1119157321.db2.gz AWELTMRVDQJAAH-RISCZKNCSA-N 1 0 251.345 3.542 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCc3cc(Cl)ccc3C2)c1 ZINC001140623622 1119295094 /nfs/dbraw/zinc/29/50/94/1119295094.db2.gz YLVRWCOBOYKJST-UHFFFAOYSA-N 1 0 287.790 3.912 20 10 CHCDRO CC(C)C1(C[NH2+]Cc2cc(Br)ccc2O)CC1 ZINC000227833573 1119308754 /nfs/dbraw/zinc/30/87/54/1119308754.db2.gz VQKXNQXOXHJPQC-UHFFFAOYSA-N 1 0 298.224 3.681 20 10 CHCDRO CCCC[C@@H](CCC)[NH2+]Cc1cccc(O)c1O ZINC000226759986 1119323164 /nfs/dbraw/zinc/32/31/64/1119323164.db2.gz YLNTVLASZBGPGF-CYBMUJFWSA-N 1 0 251.370 3.546 20 10 CHCDRO C[C@@H](c1nc2ccccc2o1)[N@H+](C)Cc1ccccc1O ZINC000181171246 1128840933 /nfs/dbraw/zinc/84/09/33/1128840933.db2.gz ZPEUKKCVZVFEMP-LBPRGKRZSA-N 1 0 282.343 3.726 20 10 CHCDRO CSC1(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)CC1 ZINC000228024588 1119388850 /nfs/dbraw/zinc/38/88/50/1119388850.db2.gz ZGHPVUDLJPGZMS-NWDGAFQWSA-N 1 0 277.433 3.734 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)[C@H](C)c1cccc(OC)c1 ZINC000179560979 1119750368 /nfs/dbraw/zinc/75/03/68/1119750368.db2.gz QRKZJINVRVWFFN-CQSZACIVSA-N 1 0 285.387 3.984 20 10 CHCDRO C[C@H](c1ccco1)[N@H+](Cc1ccccc1O)C1CC1 ZINC000179563320 1119751330 /nfs/dbraw/zinc/75/13/30/1119751330.db2.gz FEEXUNUJIQECHP-GFCCVEGCSA-N 1 0 257.333 3.711 20 10 CHCDRO Cc1cccc(C[NH2+]C[C@H]2CCCCC2(F)F)c1O ZINC000295113511 1119858090 /nfs/dbraw/zinc/85/80/90/1119858090.db2.gz LYTJPADURZLMBW-CYBMUJFWSA-N 1 0 269.335 3.616 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)c1ccc(Cl)cc1O)c1cscn1 ZINC000850512209 1119963501 /nfs/dbraw/zinc/96/35/01/1119963501.db2.gz YGEJJQOOLYLYMB-RKDXNWHRSA-N 1 0 282.796 3.914 20 10 CHCDRO COc1ccc(O)c(C[NH2+]C/C(C)=C\c2ccccc2)c1 ZINC000255903469 1119981288 /nfs/dbraw/zinc/98/12/88/1119981288.db2.gz PUDMTTDVHFIVIQ-UVTDQMKNSA-N 1 0 283.371 3.594 20 10 CHCDRO CC[C@H](C)[NH2+][C@H](C)c1cc(Br)cc(C)c1O ZINC000309409035 1119993555 /nfs/dbraw/zinc/99/35/55/1119993555.db2.gz BKIJVLIYXKGCHA-VHSXEESVSA-N 1 0 286.213 3.912 20 10 CHCDRO Cc1ccc(C[C@H](C)[NH2+]Cc2cc(C)ccc2O)s1 ZINC000078003630 1128890905 /nfs/dbraw/zinc/89/09/05/1128890905.db2.gz SRGIHECPVWLVJO-LBPRGKRZSA-N 1 0 275.417 3.791 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCCC(F)(F)C2)c1 ZINC000695123554 1120110063 /nfs/dbraw/zinc/11/00/63/1120110063.db2.gz AQDYMSVPNLJKLS-RYUDHWBXSA-N 1 0 269.335 3.929 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@@H]2CCCCC23CCCC3)c1 ZINC000314210358 1120177359 /nfs/dbraw/zinc/17/73/59/1120177359.db2.gz UWOIWVVBJDZEGV-QGZVFWFLSA-N 1 0 289.419 3.993 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CC2(c3ccccn3)CCC2)c1 ZINC000367608209 1120195605 /nfs/dbraw/zinc/19/56/05/1120195605.db2.gz QTHUOAIIJUQAEM-HNNXBMFYSA-N 1 0 296.414 3.868 20 10 CHCDRO CC(C)(C)OCC[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000308733229 1120196252 /nfs/dbraw/zinc/19/62/52/1120196252.db2.gz KJDWAPXCBUTJRV-UHFFFAOYSA-N 1 0 290.451 3.582 20 10 CHCDRO Clc1cccc2c1C[C@@H]([NH2+]Cc1ccc3c(c1)CCO3)C2 ZINC001168692559 1120268459 /nfs/dbraw/zinc/26/84/59/1120268459.db2.gz QZFMHIDSBMNGIV-HNNXBMFYSA-N 1 0 299.801 3.532 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CC[C@@H]2CCCCO2)cc1 ZINC000180260778 1120269694 /nfs/dbraw/zinc/26/96/94/1120269694.db2.gz YLIAIHBCFGIBRZ-YJBOKZPZSA-N 1 0 290.451 3.753 20 10 CHCDRO Cc1cccc(C[N@H+]2CCCC[C@H]2c2cccn2C)c1O ZINC000180638154 1120280177 /nfs/dbraw/zinc/28/01/77/1120280177.db2.gz JNKFNBXGNGMNRL-KRWDZBQOSA-N 1 0 284.403 3.766 20 10 CHCDRO C[C@@H]([NH2+]CCCCF)c1cc(Br)ccc1O ZINC000309475625 1120303037 /nfs/dbraw/zinc/30/30/37/1120303037.db2.gz RVXILUIXUSCUOP-SECBINFHSA-N 1 0 290.176 3.555 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2c(C)cccc2C)c1 ZINC000182465766 1120320637 /nfs/dbraw/zinc/32/06/37/1120320637.db2.gz PSWNYSHDMLWINM-CQSZACIVSA-N 1 0 285.387 3.868 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCCS1)c1cc2c(cc1O)CCCC2 ZINC000185698154 1120381801 /nfs/dbraw/zinc/38/18/01/1120381801.db2.gz GHBZKINFURWIDN-IUODEOHRSA-N 1 0 291.460 3.817 20 10 CHCDRO CC[N@H+](Cc1ccc2c(c1)OCCN2C)C1CCCCC1 ZINC001141139186 1120391544 /nfs/dbraw/zinc/39/15/44/1120391544.db2.gz MIKIXWANMSHMEV-UHFFFAOYSA-N 1 0 288.435 3.670 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@H](CCF)C1 ZINC000689882078 1120436445 /nfs/dbraw/zinc/43/64/45/1120436445.db2.gz MDZMFWIIDATQAV-LLVKDONJSA-N 1 0 271.763 3.617 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)C[C@H](C)O2)c1ccccc1O ZINC000922328650 1120514115 /nfs/dbraw/zinc/51/41/15/1120514115.db2.gz GRGJYJXEQIIEHO-QWHCGFSZSA-N 1 0 283.371 3.566 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCCO2)c1ccccc1O ZINC000922328656 1120514214 /nfs/dbraw/zinc/51/42/14/1120514214.db2.gz GRGOMRVVXBUDIR-ZDUSSCGKSA-N 1 0 283.371 3.568 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCc2ccccc21)c1cc(F)ccc1O ZINC000756562052 1120522705 /nfs/dbraw/zinc/52/27/05/1120522705.db2.gz FDLFNUPBRMQHTJ-JSGCOSHPSA-N 1 0 285.362 3.912 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCc2ccccc21)c1cc(F)ccc1O ZINC000756562051 1120523045 /nfs/dbraw/zinc/52/30/45/1120523045.db2.gz FDLFNUPBRMQHTJ-GXTWGEPZSA-N 1 0 285.362 3.912 20 10 CHCDRO COc1ccc(C[NH2+]Cc2ccc(C3CC3)cc2)c(O)c1 ZINC000191684510 1120526457 /nfs/dbraw/zinc/52/64/57/1120526457.db2.gz OUQYEIITRWHLRW-UHFFFAOYSA-N 1 0 283.371 3.568 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(F)cc2)c(O)c1 ZINC000020090628 1120583574 /nfs/dbraw/zinc/58/35/74/1120583574.db2.gz PDMSCETXUAJOJV-GFCCVEGCSA-N 1 0 259.324 3.691 20 10 CHCDRO Cc1csc([C@H](C)C[NH2+][C@H](C)c2ccccc2O)n1 ZINC000186569642 1120586501 /nfs/dbraw/zinc/58/65/01/1120586501.db2.gz SAEBBPBEDXZSEW-ZYHUDNBSSA-N 1 0 276.405 3.611 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC[C@H](C(F)(F)F)C2(C)C)c1 ZINC000312743311 1120589143 /nfs/dbraw/zinc/58/91/43/1120589143.db2.gz YDIXIHHPSBGZPO-ZDUSSCGKSA-N 1 0 287.325 3.863 20 10 CHCDRO CCCC[N@H+](Cc1nc(C)cs1)Cc1ccccc1O ZINC000282461858 1120689190 /nfs/dbraw/zinc/68/91/90/1120689190.db2.gz MWIKMKXNCRKOFA-UHFFFAOYSA-N 1 0 290.432 3.959 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@H+](C)Cc2ccccc2)c1 ZINC000125113331 1120709246 /nfs/dbraw/zinc/70/92/46/1120709246.db2.gz WDTJXDFQTUYSCI-UHFFFAOYSA-N 1 0 255.361 3.641 20 10 CHCDRO COc1cccc(C[C@H](C)[NH2+][C@@H](C)c2ccc(C)cc2O)c1 ZINC000756705984 1120744872 /nfs/dbraw/zinc/74/48/72/1120744872.db2.gz FPVDAWWFGKHHHK-GJZGRUSLSA-N 1 0 299.414 3.991 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc3c(c2)COC3)c(O)c1 ZINC000756759433 1120804194 /nfs/dbraw/zinc/80/41/94/1120804194.db2.gz KJGWNDUILIVIDQ-CYBMUJFWSA-N 1 0 283.371 3.582 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]Cc2ccc(C)c(C)n2)cc1 ZINC000313948881 1120822289 /nfs/dbraw/zinc/82/22/89/1120822289.db2.gz PMGQLKWZVATAET-UHFFFAOYSA-N 1 0 297.446 3.834 20 10 CHCDRO C[C@H]([NH2+]CCCSc1nccs1)c1ccoc1 ZINC000178463544 1120841709 /nfs/dbraw/zinc/84/17/09/1120841709.db2.gz JFVYASKVCOIFCI-JTQLQIEISA-N 1 0 268.407 3.569 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]Cc2ccccc2F)cc1 ZINC000020545940 1120894647 /nfs/dbraw/zinc/89/46/47/1120894647.db2.gz OZFBBQZXDKOBHW-UHFFFAOYSA-N 1 0 286.394 3.962 20 10 CHCDRO CC1(C)C[N@H+](Cc2ccccc2O)CC[C@@H]1C(F)(F)F ZINC000191658812 1128950154 /nfs/dbraw/zinc/95/01/54/1128950154.db2.gz WJEIKXSQCOJXBJ-ZDUSSCGKSA-N 1 0 287.325 3.803 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCSC1)c1ccc2ccccc2c1O ZINC000228557391 1120969703 /nfs/dbraw/zinc/96/97/03/1120969703.db2.gz CNILKSJFFKQRKM-OLZOCXBDSA-N 1 0 287.428 3.949 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CCCCC23CCCC3)c(O)c1 ZINC000314940898 1120982215 /nfs/dbraw/zinc/98/22/15/1120982215.db2.gz SDUOUNZGFKFWBD-QGZVFWFLSA-N 1 0 289.419 3.993 20 10 CHCDRO COC[C@@H]([NH2+][C@@H](C)c1ccc2ccccc2c1O)C(C)C ZINC000086683216 1121029864 /nfs/dbraw/zinc/02/98/64/1121029864.db2.gz AUHJOALZCLSJEZ-SUMWQHHRSA-N 1 0 287.403 3.867 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H]2C[C@@H](c3ccccc3)[C@H]2C)c1 ZINC000763518644 1128960459 /nfs/dbraw/zinc/96/04/59/1128960459.db2.gz NJDLVYMZRLOXCN-ZTFGCOKTSA-N 1 0 281.399 3.982 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2C[C@@H](c3ccccc3)[C@H]2C)c(O)c1 ZINC000763517889 1128960499 /nfs/dbraw/zinc/96/04/99/1128960499.db2.gz JUBRULBOYPIDJX-FSPWUOQZSA-N 1 0 297.398 3.683 20 10 CHCDRO CCc1cnccc1[C@@H](C)[NH2+]Cc1cc(Cl)ccc1O ZINC000773425722 1121090689 /nfs/dbraw/zinc/09/06/89/1121090689.db2.gz BMDYHNXHBVIGAY-LLVKDONJSA-N 1 0 290.794 3.854 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cc(C)ccc2C)c1 ZINC000182383947 1128963502 /nfs/dbraw/zinc/96/35/02/1128963502.db2.gz AJRLAHXZTBUBSS-CQSZACIVSA-N 1 0 285.387 3.868 20 10 CHCDRO C[C@H]([NH2+]CCCNc1ccccc1)c1ccc(N(C)C)cc1 ZINC000766072293 1121182867 /nfs/dbraw/zinc/18/28/67/1121182867.db2.gz FGPLOBKPKKXFDP-INIZCTEOSA-N 1 0 297.446 3.905 20 10 CHCDRO CCCC[N@H+](CC)Cc1cc(Cl)cc(OC)c1O ZINC000228562357 1121188438 /nfs/dbraw/zinc/18/84/38/1121188438.db2.gz PWCPTUNHCMTQQY-UHFFFAOYSA-N 1 0 271.788 3.676 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H](C)CCSC)cc1 ZINC000766082867 1121194507 /nfs/dbraw/zinc/19/45/07/1121194507.db2.gz HPYDOBDUKPMWQQ-KGLIPLIRSA-N 1 0 280.481 3.935 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(F)cc2C)c1 ZINC000182413548 1128968946 /nfs/dbraw/zinc/96/89/46/1128968946.db2.gz DBOONZRPVHKRTC-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO FC(F)(F)CC[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000063099241 1121198614 /nfs/dbraw/zinc/19/86/14/1121198614.db2.gz MUPAPTPSUWMMSN-UHFFFAOYSA-N 1 0 286.341 3.719 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](OC)C1CCCC1)c1ccccc1O ZINC000703128689 1121236331 /nfs/dbraw/zinc/23/63/31/1121236331.db2.gz PDWOULSTTKCVPD-NVXWUHKLSA-N 1 0 277.408 3.638 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)CC(F)(F)F)c1 ZINC000231790768 1121244706 /nfs/dbraw/zinc/24/47/06/1121244706.db2.gz HGPXKSMSXYSZBR-VHSXEESVSA-N 1 0 261.287 3.692 20 10 CHCDRO CCCC[N@H+](Cc1cc2c(cc1O)OCO2)[C@H](C)CC ZINC000108105760 1121295856 /nfs/dbraw/zinc/29/58/56/1121295856.db2.gz HSGSNHMSFMTNCS-GFCCVEGCSA-N 1 0 279.380 3.522 20 10 CHCDRO CCc1cc(C[NH2+][C@H](CC)c2ccc(N(C)C)cc2)on1 ZINC000766133931 1121301483 /nfs/dbraw/zinc/30/14/83/1121301483.db2.gz FNWGHVPGRNKICW-QGZVFWFLSA-N 1 0 287.407 3.544 20 10 CHCDRO C[C@@H]([NH2+]CC[C@H]1CCSC1)c1ccc(N(C)C)cc1 ZINC000704775140 1121367466 /nfs/dbraw/zinc/36/74/66/1121367466.db2.gz KJOJWSSDGJHCCY-KGLIPLIRSA-N 1 0 278.465 3.546 20 10 CHCDRO CC[C@H]([NH2+]CC[C@@H]1CCSC1)c1ccccc1O ZINC000704777416 1121367882 /nfs/dbraw/zinc/36/78/82/1121367882.db2.gz TZKPJKZLLYEKMG-OCCSQVGLSA-N 1 0 265.422 3.576 20 10 CHCDRO CC[C@@H](C[NH2+]Cc1cccc(OC)c1O)c1ccccc1 ZINC000236991252 1121370705 /nfs/dbraw/zinc/37/07/05/1121370705.db2.gz KHORHTGVAYGAQJ-AWEZNQCLSA-N 1 0 285.387 3.684 20 10 CHCDRO CCC[C@@H](C[NH2+][C@H](C)c1ccc(N(C)C)cc1)OCC ZINC000707801301 1121462790 /nfs/dbraw/zinc/46/27/90/1121462790.db2.gz OORPKQNYHCGJSL-PBHICJAKSA-N 1 0 278.440 3.608 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCC[C@@H]1C1CCCCC1 ZINC000708485198 1121468686 /nfs/dbraw/zinc/46/86/86/1121468686.db2.gz JDPQWOXHOPUFNO-MRXNPFEDSA-N 1 0 259.393 3.937 20 10 CHCDRO Cc1ccc(CC[NH2+][C@H](C)c2ccc(N(C)C)cc2)o1 ZINC000709765395 1121469612 /nfs/dbraw/zinc/46/96/12/1121469612.db2.gz UGOUMCSWDWRNFB-CQSZACIVSA-N 1 0 272.392 3.547 20 10 CHCDRO CC(C)[C@H]1[N@H+](Cc2ccccc2O)CC12CC=CC2 ZINC000843432060 1121531097 /nfs/dbraw/zinc/53/10/97/1121531097.db2.gz PIZNLDJHCQNOQL-MRXNPFEDSA-N 1 0 257.377 3.569 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2CCc3ccccc32)c1 ZINC000182802808 1128999825 /nfs/dbraw/zinc/99/98/25/1128999825.db2.gz BNAUHLYJISEMCA-HIFRSBDPSA-N 1 0 297.398 3.781 20 10 CHCDRO COc1cc(C)cc(C[NH2+][C@H](c2ccccc2)C2CC2)c1O ZINC000894159933 1121678066 /nfs/dbraw/zinc/67/80/66/1121678066.db2.gz HMRCJGYZPOBSCD-GOSISDBHSA-N 1 0 297.398 3.950 20 10 CHCDRO COc1cc(C)cc(C[NH2+]Cc2ccc(Cl)s2)c1O ZINC000894163219 1121683803 /nfs/dbraw/zinc/68/38/03/1121683803.db2.gz NMQPTHVZMHWLDG-UHFFFAOYSA-N 1 0 297.807 3.714 20 10 CHCDRO CCC[NH2+]Cc1ccc2c(c1)CCN2Cc1ccccc1 ZINC001177092477 1121711774 /nfs/dbraw/zinc/71/17/74/1121711774.db2.gz GECFXVQFVRMCBT-UHFFFAOYSA-N 1 0 280.415 3.749 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CCC(C)(C)C)c(Cl)c1 ZINC001177231214 1121719546 /nfs/dbraw/zinc/71/95/46/1121719546.db2.gz GGXHGKRERQJBIW-UHFFFAOYSA-N 1 0 255.789 3.880 20 10 CHCDRO CCCOc1ccc(C[NH2+]C[C@@H]2CC2(C)C)cc1C ZINC001177800228 1121752272 /nfs/dbraw/zinc/75/22/72/1121752272.db2.gz VXVVBYWVJNLEAJ-HNNXBMFYSA-N 1 0 261.409 3.920 20 10 CHCDRO CCOCc1cc(C[NH2+]C2(C)CCCC2)ccc1OC ZINC000728063357 1121760054 /nfs/dbraw/zinc/76/00/54/1121760054.db2.gz MBKHXJGQWJCYFA-UHFFFAOYSA-N 1 0 277.408 3.654 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2cc3c(cc2O)CCC3)s1 ZINC000728048619 1121760537 /nfs/dbraw/zinc/76/05/37/1121760537.db2.gz XLYXZDJYUDIIBA-UHFFFAOYSA-N 1 0 287.428 3.883 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(C)cc(OC)c1O)c1ccccc1 ZINC000894208398 1121767974 /nfs/dbraw/zinc/76/79/74/1121767974.db2.gz HSWXLJSTNBBGBQ-INIZCTEOSA-N 1 0 285.387 3.950 20 10 CHCDRO C/C(=C\c1ccccc1)C[NH2+]Cc1ccc(N(C)C)cc1 ZINC000237086917 1121770367 /nfs/dbraw/zinc/77/03/67/1121770367.db2.gz VWOBMVMDCTZBRJ-DTQAZKPQSA-N 1 0 280.415 3.946 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)CC(C)(C)OC)c1ccc(N(C)C)cc1 ZINC000766189612 1121779767 /nfs/dbraw/zinc/77/97/67/1121779767.db2.gz GHQWOBUKZVYRPM-WMLDXEAASA-N 1 0 292.467 3.997 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2ccc(N(C)C)cc2C)c(C)c1 ZINC000237091244 1121779856 /nfs/dbraw/zinc/77/98/56/1121779856.db2.gz PTEUXANJLUQOAX-UHFFFAOYSA-N 1 0 282.431 3.968 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2ccc[nH]2)cc1F ZINC001178398550 1121783472 /nfs/dbraw/zinc/78/34/72/1121783472.db2.gz RPNNTTCAMNOZAN-ZDUSSCGKSA-N 1 0 289.398 3.851 20 10 CHCDRO Cc1cscc1C[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC001178615197 1121800428 /nfs/dbraw/zinc/80/04/28/1121800428.db2.gz SZFIWGQCSIEJJQ-PLNGDYQASA-N 1 0 286.444 3.926 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CCCC(F)F ZINC001119542176 1121800431 /nfs/dbraw/zinc/80/04/31/1121800431.db2.gz XQDOWZRNBUZDPF-MNOVXSKESA-N 1 0 269.335 3.884 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C[C@@H]2C[C@H]2C(C)C)cc1 ZINC001178728100 1121814810 /nfs/dbraw/zinc/81/48/10/1121814810.db2.gz YEXCWCGEWCCDET-WMZOPIPTSA-N 1 0 274.452 3.915 20 10 CHCDRO c1ccc2c(c1)CC[C@H]2CC[NH2+]Cc1ccc2c(c1)CCO2 ZINC001178828294 1121822197 /nfs/dbraw/zinc/82/21/97/1121822197.db2.gz YHELLIIIULJCAT-KRWDZBQOSA-N 1 0 293.410 3.831 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H]2C[C@@H](OC(C)C)C2)cc1 ZINC001178916406 1121828608 /nfs/dbraw/zinc/82/86/08/1121828608.db2.gz FWWNYQQLDCEJOB-MAEOIBBWSA-N 1 0 290.451 3.578 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C[C@H]2C[C@H]2c2ccccc2)cc1 ZINC000237125636 1121833923 /nfs/dbraw/zinc/83/39/23/1121833923.db2.gz JBQYKFMSQGDDFA-MJGOQNOKSA-N 1 0 280.415 3.646 20 10 CHCDRO CC[C@H](Cc1ccc(F)cc1)[NH2+]Cc1ccc2c(c1)CCO2 ZINC001179129365 1121852377 /nfs/dbraw/zinc/85/23/77/1121852377.db2.gz OSKVUSACOGVTLQ-GOSISDBHSA-N 1 0 299.389 3.872 20 10 CHCDRO CN(C)c1cc(F)c(C[NH2+]CCCC2CCC2)cc1F ZINC001179183088 1121854837 /nfs/dbraw/zinc/85/48/37/1121854837.db2.gz BOHJNDJWPRJNHD-UHFFFAOYSA-N 1 0 282.378 3.701 20 10 CHCDRO C[C@@H](CC1CCC1)[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC001179285143 1121865897 /nfs/dbraw/zinc/86/58/97/1121865897.db2.gz GWRAJPMUDBNKQQ-NSHDSACASA-N 1 0 282.378 3.699 20 10 CHCDRO CCN(C)c1ccc(C[NH2+][C@@H](COC)c2ccccc2)cc1 ZINC000773810509 1121865992 /nfs/dbraw/zinc/86/59/92/1121865992.db2.gz IRQOFZQQWRLYAR-IBGZPJMESA-N 1 0 298.430 3.620 20 10 CHCDRO CCN(C)c1ccc(C[NH2+][C@H](COC)c2ccccc2)cc1 ZINC000773810512 1121866520 /nfs/dbraw/zinc/86/65/20/1121866520.db2.gz IRQOFZQQWRLYAR-LJQANCHMSA-N 1 0 298.430 3.620 20 10 CHCDRO C[C@H]1C[C@H]([NH2+]Cc2ccc3c(c2)CCO3)c2ccccc21 ZINC000731451113 1121869102 /nfs/dbraw/zinc/86/91/02/1121869102.db2.gz QVAOMCIZSSBAMG-UGSOOPFHSA-N 1 0 279.383 3.960 20 10 CHCDRO CCC[C@H](C)CC[NH2+]Cc1c(O)cccc1Cl ZINC001179468950 1121881872 /nfs/dbraw/zinc/88/18/72/1121881872.db2.gz VCPBBFHLMRNJLX-NSHDSACASA-N 1 0 255.789 3.962 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@@H]2CCCC(C)(C)O2)c(Cl)c1 ZINC001179740363 1121904926 /nfs/dbraw/zinc/90/49/26/1121904926.db2.gz MLPQHNUJCIRWBS-LBPRGKRZSA-N 1 0 297.826 3.791 20 10 CHCDRO CCc1cccc(C[N@H+](C)Cc2ccccc2)c1O ZINC001179845202 1121916469 /nfs/dbraw/zinc/91/64/69/1121916469.db2.gz MUIZVWKWOHWCOL-UHFFFAOYSA-N 1 0 255.361 3.587 20 10 CHCDRO CCC[N@@H+](Cc1ccccc1O)C[C@@H](OC)[C@@H](C)CC ZINC001180194736 1121964616 /nfs/dbraw/zinc/96/46/16/1121964616.db2.gz MAEQHOWKZHSHKO-WMLDXEAASA-N 1 0 279.424 3.665 20 10 CHCDRO CC[C@@H](C)C[N@H+](C)Cc1c([O-])ccc(Cl)c1F ZINC001180262002 1121970035 /nfs/dbraw/zinc/97/00/35/1121970035.db2.gz HCTJODSXRJZLOH-SECBINFHSA-N 1 0 259.752 3.663 20 10 CHCDRO C[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(N(C)C)c(F)c2)C1 ZINC000733323967 1121976771 /nfs/dbraw/zinc/97/67/71/1121976771.db2.gz BDBCWFFPHJTDDH-TZMCWYRMSA-N 1 0 264.388 3.560 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C2CC(c3ccccc3F)C2)c1 ZINC000733328373 1121978101 /nfs/dbraw/zinc/97/81/01/1121978101.db2.gz SHUDYEWTOJMDRS-UHFFFAOYSA-N 1 0 285.362 3.876 20 10 CHCDRO COc1cccc(C[NH2+]CC2CCC(C(C)C)CC2)c1O ZINC001181489428 1122058285 /nfs/dbraw/zinc/05/82/85/1122058285.db2.gz YTYOKQGQRXKBOL-UHFFFAOYSA-N 1 0 291.435 3.953 20 10 CHCDRO COc1cc(C)c(C[NH2+]C[C@@H]2CCCC2(C)C)c(O)c1 ZINC001181972903 1122103894 /nfs/dbraw/zinc/10/38/94/1122103894.db2.gz VRZZLMWDRGWQJR-ZDUSSCGKSA-N 1 0 277.408 3.625 20 10 CHCDRO CCOC1(C)CC[NH+](Cc2cc(C(C)C)ccc2O)CC1 ZINC001182072547 1122109274 /nfs/dbraw/zinc/10/92/74/1122109274.db2.gz QNWPFYVYWZCAGA-UHFFFAOYSA-N 1 0 291.435 3.907 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CC[C@@H](C)C3(CCC3)C2)c1O ZINC000779604353 1129032205 /nfs/dbraw/zinc/03/22/05/1129032205.db2.gz JTSQGFWSNQUBND-CQSZACIVSA-N 1 0 289.419 3.803 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)OCO2)c1ccccc1O ZINC000192750302 1129033561 /nfs/dbraw/zinc/03/35/61/1129033561.db2.gz CECMRCFHFWYCPS-SWLSCSKDSA-N 1 0 299.370 3.923 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+][C@H]1CCC12CCC2 ZINC001182424423 1122152421 /nfs/dbraw/zinc/15/24/21/1122152421.db2.gz UGAYYQFZCUZQFF-QAPCUYQASA-N 1 0 286.463 3.914 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+][C@@H]1CCC12CCC2 ZINC001182424421 1122152453 /nfs/dbraw/zinc/15/24/53/1122152453.db2.gz UGAYYQFZCUZQFF-CRAIPNDOSA-N 1 0 286.463 3.914 20 10 CHCDRO CC1CC(C[NH2+]Cc2ccc3ccccc3c2O)C1 ZINC001183035686 1122200809 /nfs/dbraw/zinc/20/08/09/1122200809.db2.gz IUMQUONOLVTBEP-UHFFFAOYSA-N 1 0 255.361 3.681 20 10 CHCDRO Cc1nc(CC[NH2+][C@@H](C)c2ccc(C)c(C)c2O)cs1 ZINC000273298341 1122226244 /nfs/dbraw/zinc/22/62/44/1122226244.db2.gz APXBISRNYGUTMK-LBPRGKRZSA-N 1 0 290.432 3.667 20 10 CHCDRO Cc1ccc([C@H](O)C[NH2+][C@H](C)c2ccc(C)c(C)c2O)cc1 ZINC000273299384 1122226583 /nfs/dbraw/zinc/22/65/83/1122226583.db2.gz AZPYTQZFDCMSLD-CRAIPNDOSA-N 1 0 299.414 3.702 20 10 CHCDRO Cc1csc([C@H](C)C[NH2+]Cc2c(O)cccc2Cl)n1 ZINC000273341143 1122229027 /nfs/dbraw/zinc/22/90/27/1122229027.db2.gz AJBITWQWJLLRIB-SECBINFHSA-N 1 0 296.823 3.704 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc([C@H](C)O)cc2)c(O)c1C ZINC000273383901 1122230299 /nfs/dbraw/zinc/23/02/99/1122230299.db2.gz IWODSZLTXMLLIU-GJZGRUSLSA-N 1 0 299.414 3.913 20 10 CHCDRO COCC[C@@H]([NH2+][C@H](C)c1ccc(C)cc1O)c1ccco1 ZINC000273431094 1122232921 /nfs/dbraw/zinc/23/29/21/1122232921.db2.gz LCGWRLHBSMHXTF-UKRRQHHQSA-N 1 0 289.375 3.722 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCO[C@@H](CC(C)C)C2)c(O)c1 ZINC000273451667 1122233826 /nfs/dbraw/zinc/23/38/26/1122233826.db2.gz GCMYUMHOZRULDP-XHSDSOJGSA-N 1 0 291.435 3.945 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCOC2(CCC2)C1)c1cc(Cl)ccc1O ZINC000273491819 1122236253 /nfs/dbraw/zinc/23/62/53/1122236253.db2.gz OKIKZCKABGZJPX-AAEUAGOBSA-N 1 0 295.810 3.798 20 10 CHCDRO Cc1ccn2cc(C[NH2+][C@H](C)c3ccc(C)cc3O)nc2c1 ZINC000273550395 1122238911 /nfs/dbraw/zinc/23/89/11/1122238911.db2.gz FTFXIPHWOJWOFN-CQSZACIVSA-N 1 0 295.386 3.508 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](O)c2ccccc2C)c(O)c1C ZINC000273568854 1122239245 /nfs/dbraw/zinc/23/92/45/1122239245.db2.gz KHKNZQHLWBAMSI-CRAIPNDOSA-N 1 0 299.414 3.702 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2cccc(N(C)C)c2)c(O)c1C ZINC000273607954 1122240345 /nfs/dbraw/zinc/24/03/45/1122240345.db2.gz UWGQYDZAPAZJDI-HNNXBMFYSA-N 1 0 298.430 3.926 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2cccc(O)c2)c(O)c1C ZINC000273603131 1122240463 /nfs/dbraw/zinc/24/04/63/1122240463.db2.gz SKESMNIZULGEEW-CYBMUJFWSA-N 1 0 271.360 3.565 20 10 CHCDRO CCCCCC[C@H](C)[NH2+]Cc1c([O-])cccc1F ZINC001183919231 1122248054 /nfs/dbraw/zinc/24/80/54/1122248054.db2.gz HMCPRUNWOACNCQ-LBPRGKRZSA-N 1 0 253.361 3.980 20 10 CHCDRO CCc1cccc(C[NH2+]C[C@@H]2CCCC3(CCC3)O2)c1O ZINC001184076214 1122252461 /nfs/dbraw/zinc/25/24/61/1122252461.db2.gz FGJURHCYFWBYJB-INIZCTEOSA-N 1 0 289.419 3.536 20 10 CHCDRO C[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000071205984 1129045693 /nfs/dbraw/zinc/04/56/93/1129045693.db2.gz JOMHWVSPUWTPTI-CRAIPNDOSA-N 1 0 272.436 3.955 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)c2ccccc2O)cc1F ZINC000183393000 1129051664 /nfs/dbraw/zinc/05/16/64/1129051664.db2.gz ZBTUWQJDOIFAOG-GFCCVEGCSA-N 1 0 259.324 3.691 20 10 CHCDRO C[C@H]([NH2+]C/C=C/c1ccccc1)c1ccccc1O ZINC000183510825 1129060231 /nfs/dbraw/zinc/06/02/31/1129060231.db2.gz WDVPTBKWXMSDLB-RNVIBTMRSA-N 1 0 253.345 3.756 20 10 CHCDRO CC[C@@H]1C[C@@H](C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)CCO1 ZINC000775366104 1122529185 /nfs/dbraw/zinc/52/91/85/1122529185.db2.gz ZXDOUGKMLGPWFX-RLFYNMQTSA-N 1 0 290.451 3.608 20 10 CHCDRO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)C[Si](C)(C)C ZINC001190436273 1122538208 /nfs/dbraw/zinc/53/82/08/1122538208.db2.gz COMNNOOQTQJFGE-UHFFFAOYSA-N 1 0 278.516 3.840 20 10 CHCDRO CC[C@@H]([NH2+]CCOc1ccc(F)cc1)c1ccccc1O ZINC000775415632 1122557722 /nfs/dbraw/zinc/55/77/22/1122557722.db2.gz UAYOITSAZFHWOZ-MRXNPFEDSA-N 1 0 289.350 3.651 20 10 CHCDRO CCN(C)c1ccc(C[N@H+]2[C@H](C)CCC[C@@H]2C)cc1 ZINC001191315773 1122593117 /nfs/dbraw/zinc/59/31/17/1122593117.db2.gz BWWLQDDVLALGRB-GASCZTMLSA-N 1 0 260.425 3.906 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccco1)c1cc(Cl)ccc1O ZINC000775483073 1122615120 /nfs/dbraw/zinc/61/51/20/1122615120.db2.gz JQUYAYIEONBTCK-CYBMUJFWSA-N 1 0 265.740 3.880 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCCN1CC)c1cc(Cl)ccc1O ZINC000775482815 1122615341 /nfs/dbraw/zinc/61/53/41/1122615341.db2.gz CCIOFTJAYDIHGF-ZFWWWQNUSA-N 1 0 296.842 3.571 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1C[C@@H]1C)c1cc(Cl)ccc1O ZINC000775488560 1122620149 /nfs/dbraw/zinc/62/01/49/1122620149.db2.gz IZBFUZIMWYLEGE-CWSCBRNRSA-N 1 0 253.773 3.742 20 10 CHCDRO CC[C@@H]([NH2+]CCCCCOC)c1cc(Cl)ccc1O ZINC000775497139 1122626837 /nfs/dbraw/zinc/62/68/37/1122626837.db2.gz NBYVFDOEZJYOGG-CQSZACIVSA-N 1 0 285.815 3.903 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)CN(CC)CC)c1cc(Cl)ccc1O ZINC000775498053 1122626876 /nfs/dbraw/zinc/62/68/76/1122626876.db2.gz GNGOBCVSVMHQGO-IUODEOHRSA-N 1 0 298.858 3.817 20 10 CHCDRO CC[C@H](C)N(C)CC[NH2+][C@@H](CC)c1cc(Cl)ccc1O ZINC000775501948 1122628878 /nfs/dbraw/zinc/62/88/78/1122628878.db2.gz URDPIWVHSUYVPP-WFASDCNBSA-N 1 0 298.858 3.817 20 10 CHCDRO CC[C@H]([NH2+]CCN1CCCC[C@@H]1CC)c1ccccc1O ZINC000775504090 1122630917 /nfs/dbraw/zinc/63/09/17/1122630917.db2.gz SCHKSXLEZPJRMR-RDJZCZTQSA-N 1 0 290.451 3.697 20 10 CHCDRO CC[C@@H](C)[C@@](C)(O)C[NH2+][C@@H](CC)c1cc(Cl)ccc1O ZINC000775503609 1122631609 /nfs/dbraw/zinc/63/16/09/1122631609.db2.gz KSEDVZKPZXCNHT-WPGHFRTFSA-N 1 0 299.842 3.883 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(F)cn1)c1cc(Cl)ccc1O ZINC000775513403 1122632095 /nfs/dbraw/zinc/63/20/95/1122632095.db2.gz IDPVAQQODGDXKY-AWEZNQCLSA-N 1 0 294.757 3.821 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)C1CCOCC1)c1cc(Cl)ccc1O ZINC000775514392 1122635794 /nfs/dbraw/zinc/63/57/94/1122635794.db2.gz USSYYNJNVLJBQC-NHYWBVRUSA-N 1 0 297.826 3.901 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1cnccc1C)c1ccccc1O ZINC000775519610 1122638350 /nfs/dbraw/zinc/63/83/50/1122638350.db2.gz MSLSCFBDWBCPQP-XJKSGUPXSA-N 1 0 270.376 3.898 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1cn[nH]c1)c1cc(Cl)ccc1O ZINC000775522933 1122639741 /nfs/dbraw/zinc/63/97/41/1122639741.db2.gz BYHGELQOQKIYFD-TVQRCGJNSA-N 1 0 279.771 3.571 20 10 CHCDRO CC[C@@H]([NH2+]CCC[C@@H](O)CC)c1cc(Cl)ccc1O ZINC000775524924 1122641746 /nfs/dbraw/zinc/64/17/46/1122641746.db2.gz CTXHIXYCCDHGLL-GXTWGEPZSA-N 1 0 285.815 3.637 20 10 CHCDRO CCOc1ccccc1CC[NH2+][C@H](C)c1ccccc1O ZINC000183596328 1129068661 /nfs/dbraw/zinc/06/86/61/1129068661.db2.gz POFSTYJROUGINE-CQSZACIVSA-N 1 0 285.387 3.684 20 10 CHCDRO Cc1cc(C[N@H+]2CC[C@H](C)C(C)(C)C2)ccc1N(C)C ZINC001193210176 1122681154 /nfs/dbraw/zinc/68/11/54/1122681154.db2.gz KTKOIHIUQMEDGE-HNNXBMFYSA-N 1 0 274.452 3.929 20 10 CHCDRO Cc1nc(C)c(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)s1 ZINC000294642315 1122733971 /nfs/dbraw/zinc/73/39/71/1122733971.db2.gz GICGCCOJARQVIZ-GFCCVEGCSA-N 1 0 290.432 3.933 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2nc(C)cs2)c1 ZINC000080273394 1129079980 /nfs/dbraw/zinc/07/99/80/1129079980.db2.gz IIBXYNQPVZSJSB-QWRGUYRKSA-N 1 0 292.404 3.578 20 10 CHCDRO Cc1csc([C@@H](C)[NH2+][C@H](C)c2ccc(N(C)C)cc2)n1 ZINC000080272826 1129079586 /nfs/dbraw/zinc/07/95/86/1129079586.db2.gz DDHUNIYPNQKNLI-CHWSQXEVSA-N 1 0 289.448 3.929 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)c(C)c1)[C@@H]1CC1(C)C ZINC001195280419 1122859810 /nfs/dbraw/zinc/85/98/10/1122859810.db2.gz STTLZWWPFQRBIC-JKSUJKDBSA-N 1 0 274.452 3.975 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCSC[C@H]2c2ccccc2)c1O ZINC000775650343 1122865669 /nfs/dbraw/zinc/86/56/69/1122865669.db2.gz YNRSZSYUDPHYCR-KRWDZBQOSA-N 1 0 299.439 3.991 20 10 CHCDRO Cc1cccc(C[N@@H+](Cc2ccccn2)C(C)C)c1O ZINC000775658405 1122868707 /nfs/dbraw/zinc/86/87/07/1122868707.db2.gz OBJCVRLKABKPDF-UHFFFAOYSA-N 1 0 270.376 3.506 20 10 CHCDRO COc1ccc(O)c(C[N@H+](C)CCCCc2ccccc2)c1 ZINC000775655863 1122870221 /nfs/dbraw/zinc/87/02/21/1122870221.db2.gz LUAIKHGKEDOQJJ-UHFFFAOYSA-N 1 0 299.414 3.856 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CC[C@H](c3ccccc3C)C2)c1 ZINC000775670889 1122888208 /nfs/dbraw/zinc/88/82/08/1122888208.db2.gz SKKWMBYEJDXAFE-HNNXBMFYSA-N 1 0 297.398 3.699 20 10 CHCDRO Cc1cccc(C[N@@H+](C)C[C@@H](C)c2ccccc2)c1O ZINC000775678193 1122900898 /nfs/dbraw/zinc/90/08/98/1122900898.db2.gz BESDXDMUBUYFSA-OAHLLOKOSA-N 1 0 269.388 3.936 20 10 CHCDRO COc1ccc(O)c(C[N@H+](C)C[C@@H](C)c2ccccc2)c1 ZINC000775679263 1122900932 /nfs/dbraw/zinc/90/09/32/1122900932.db2.gz SWEPNDKEWFYQNW-CQSZACIVSA-N 1 0 285.387 3.636 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CCC[C@@]3(CC=CCC3)C2)c1 ZINC000775698160 1122912238 /nfs/dbraw/zinc/91/22/38/1122912238.db2.gz KGVBQQCOKPGHFN-SFHVURJKSA-N 1 0 287.403 3.723 20 10 CHCDRO C[C@@H]1c2sccc2CC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC001197432372 1122956694 /nfs/dbraw/zinc/95/66/94/1122956694.db2.gz ULQSXQWRZBCEJO-CYBMUJFWSA-N 1 0 286.444 3.933 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]CCSCc2ccccc2)c1 ZINC000775780024 1122964734 /nfs/dbraw/zinc/96/47/34/1122964734.db2.gz AZUCKJOYAZUTNU-UHFFFAOYSA-N 1 0 287.428 3.724 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2Cc3ccccc3C3(CC3)C2)c1 ZINC000776014985 1123036119 /nfs/dbraw/zinc/03/61/19/1123036119.db2.gz SYMWJTFJCBEVLB-UHFFFAOYSA-N 1 0 279.383 3.748 20 10 CHCDRO Cc1ccc(F)cc1C[NH2+]Cc1ccc2c(c1)CCCN2C ZINC001199821989 1123043874 /nfs/dbraw/zinc/04/38/74/1123043874.db2.gz DTHVAPFCSDPVJS-UHFFFAOYSA-N 1 0 298.405 3.806 20 10 CHCDRO CN(C)c1ccc(C[NH2+]Cc2cscc2Cl)cc1F ZINC000776115476 1123061300 /nfs/dbraw/zinc/06/13/00/1123061300.db2.gz XSEHKVFFPIDCCQ-UHFFFAOYSA-N 1 0 298.814 3.896 20 10 CHCDRO C[N@H+](Cc1c(O)ccc2ccccc21)C1CCCC1 ZINC000105993657 1123096156 /nfs/dbraw/zinc/09/61/56/1123096156.db2.gz VWELODQCARVCRY-UHFFFAOYSA-N 1 0 255.361 3.920 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H]2CC[C@@H]3CCC[C@H]3C2)c1O ZINC000776174880 1123101628 /nfs/dbraw/zinc/10/16/28/1123101628.db2.gz IMUAJWNGRJYPNX-OFQRWUPVSA-N 1 0 259.393 3.759 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]CCOC1CCCCCC1 ZINC000776175090 1123102421 /nfs/dbraw/zinc/10/24/21/1123102421.db2.gz HBGKVAGOEVHUIY-UHFFFAOYSA-N 1 0 297.826 3.875 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@@]2(C)CCCc3ccccc32)c1 ZINC000776175322 1123102628 /nfs/dbraw/zinc/10/26/28/1123102628.db2.gz LBONQPXOBTXIAO-IBGZPJMESA-N 1 0 297.398 3.742 20 10 CHCDRO CC1(C)CC[NH+](Cc2cc3c(cc2O)CCC3)CC1 ZINC000726965033 1123122458 /nfs/dbraw/zinc/12/24/58/1123122458.db2.gz QEIDXBKHAARGRH-UHFFFAOYSA-N 1 0 259.393 3.503 20 10 CHCDRO CCCC(O)(CCC)C[NH2+]Cc1cc(Cl)cc(C)c1O ZINC000776208384 1123148713 /nfs/dbraw/zinc/14/87/13/1123148713.db2.gz BOJWFKXHGYNAOM-UHFFFAOYSA-N 1 0 299.842 3.775 20 10 CHCDRO CCCCC[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001201735029 1123149271 /nfs/dbraw/zinc/14/92/71/1123149271.db2.gz MUJACETUIUJBIX-UHFFFAOYSA-N 1 0 260.425 3.909 20 10 CHCDRO OCCCCCC[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000776257103 1123189340 /nfs/dbraw/zinc/18/93/40/1123189340.db2.gz IAZSBXPTHMYZFW-UHFFFAOYSA-N 1 0 299.414 3.702 20 10 CHCDRO COC[C@H]1CCCC[N@H+](Cc2cc(Cl)c(C)cc2O)C1 ZINC000825536687 1123221656 /nfs/dbraw/zinc/22/16/56/1123221656.db2.gz LHYYMPVRSDDNLB-ZDUSSCGKSA-N 1 0 297.826 3.603 20 10 CHCDRO C[C@@H]([NH2+]CCc1cccnc1)c1ccc2ccccc2c1O ZINC000193709813 1129107197 /nfs/dbraw/zinc/10/71/97/1129107197.db2.gz QHAHMBGKBWVZDZ-CQSZACIVSA-N 1 0 292.382 3.834 20 10 CHCDRO CC[C@@](C)([NH2+]Cc1ccccc1O)c1ccccc1 ZINC000107717662 1123226909 /nfs/dbraw/zinc/22/69/09/1123226909.db2.gz SWILGYAQKJJWRK-QGZVFWFLSA-N 1 0 255.361 3.807 20 10 CHCDRO COc1cccc(C[NH2+][C@H]2CCC(C)(C)C[C@H]2C)c1O ZINC000237237561 1123237868 /nfs/dbraw/zinc/23/78/68/1123237868.db2.gz KGUVDIXXZDKDQG-OCCSQVGLSA-N 1 0 277.408 3.705 20 10 CHCDRO CCOc1ccc(C[NH2+]Cc2ccc3c(c2)CCO3)c(C)c1 ZINC000850111862 1123243321 /nfs/dbraw/zinc/24/33/21/1123243321.db2.gz PATJGKYULXCPHS-UHFFFAOYSA-N 1 0 297.398 3.618 20 10 CHCDRO CC1(C)C[C@@H]([NH2+]Cc2cc(-c3ccccc3)ccc2O)CO1 ZINC000850341267 1123253993 /nfs/dbraw/zinc/25/39/93/1123253993.db2.gz DZCRVFWSPZCVDQ-QGZVFWFLSA-N 1 0 297.398 3.716 20 10 CHCDRO COc1ccc(C[NH2+]CCC2(CSC)CC2)cc1C ZINC000850356126 1123255527 /nfs/dbraw/zinc/25/55/27/1123255527.db2.gz OYQUBPFJIKWZPY-UHFFFAOYSA-N 1 0 279.449 3.627 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H]2Cc3ccccc3[C@@H]2C)c1O ZINC000850363596 1123257171 /nfs/dbraw/zinc/25/71/71/1123257171.db2.gz BSTWLHKUOGWXRI-SUMWQHHRSA-N 1 0 297.398 3.609 20 10 CHCDRO COc1ccc(C[NH2+]CC[C@@]2(C)CC2(F)F)cc1C ZINC000850380995 1123261325 /nfs/dbraw/zinc/26/13/25/1123261325.db2.gz SLRGESLGMWJZLY-AWEZNQCLSA-N 1 0 269.335 3.529 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)C1CCC(F)CC1 ZINC000850395193 1123261579 /nfs/dbraw/zinc/26/15/79/1123261579.db2.gz DZBFYNXEUJXLTC-YGONEPDPSA-N 1 0 277.383 3.628 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@@H]2C(C)(C)C2(F)F)c(Cl)c1 ZINC000850394523 1123261923 /nfs/dbraw/zinc/26/19/23/1123261923.db2.gz VMNQOIVCYYSYDI-GFCCVEGCSA-N 1 0 289.753 3.735 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C2CCC3(CC3(F)F)CC2)cc1 ZINC000850391373 1123261952 /nfs/dbraw/zinc/26/19/52/1123261952.db2.gz NYEGXFARZZTEIA-UHFFFAOYSA-N 1 0 294.389 3.810 20 10 CHCDRO COc1cc(C[NH2+][C@H]2[C@@H]3CCC[C@@H]32)c(O)c(C(C)(C)C)c1 ZINC000850392089 1123262172 /nfs/dbraw/zinc/26/21/72/1123262172.db2.gz GOCFFQRCLOPTHF-FOLVSLTJSA-N 1 0 289.419 3.586 20 10 CHCDRO COc1ccc(C[NH2+]Cc2cccc(OC)c2C)cc1C ZINC000850416268 1123264734 /nfs/dbraw/zinc/26/47/34/1123264734.db2.gz FANLENRWLXDJSX-UHFFFAOYSA-N 1 0 285.387 3.610 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCN1C(C)(C)C)c1ccc(Cl)cc1O ZINC000850481925 1123273130 /nfs/dbraw/zinc/27/31/30/1123273130.db2.gz OQJJSJLLFSBDFI-YPMHNXCESA-N 1 0 296.842 3.569 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCN1C(C)(C)C)c1ccc(C)cc1O ZINC000850483549 1123274551 /nfs/dbraw/zinc/27/45/51/1123274551.db2.gz ZTXFDMOUZGJNTM-ZBFHGGJFSA-N 1 0 290.451 3.614 20 10 CHCDRO CCC(O)(CC)C(C)(C)C[NH2+][C@@H](C)c1ccccc1O ZINC000850500812 1123275536 /nfs/dbraw/zinc/27/55/36/1123275536.db2.gz GMEPVXMCGDKDRY-ZDUSSCGKSA-N 1 0 279.424 3.620 20 10 CHCDRO CC[C@@H]([NH2+]CCc1cnccc1C)c1ccc(C)cc1O ZINC000850505837 1123275943 /nfs/dbraw/zinc/27/59/43/1123275943.db2.gz ZIGRAWJXSFZWHJ-QGZVFWFLSA-N 1 0 284.403 3.687 20 10 CHCDRO CSCC1(CC[NH2+][C@H](C)c2ccc(C)cc2O)CC1 ZINC000850506329 1123276189 /nfs/dbraw/zinc/27/61/89/1123276189.db2.gz ISVNDLIXOHZCPR-CYBMUJFWSA-N 1 0 279.449 3.885 20 10 CHCDRO C[C@H]([NH2+][C@@H]1C=CCC1)c1cc2c(cc1O)CCCC2 ZINC000850507981 1123276900 /nfs/dbraw/zinc/27/69/00/1123276900.db2.gz HEPJOZDISPVNGB-SWLSCSKDSA-N 1 0 257.377 3.640 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]CCC2(CSC)CC2)c1 ZINC000850507092 1123276908 /nfs/dbraw/zinc/27/69/08/1123276908.db2.gz MNSGBJKSOARXHE-GFCCVEGCSA-N 1 0 295.448 3.585 20 10 CHCDRO CSCC1(CC[NH2+][C@H](C)c2cc(C)ccc2O)CC1 ZINC000850508612 1123277362 /nfs/dbraw/zinc/27/73/62/1123277362.db2.gz UVLAJKQIYNWILI-CYBMUJFWSA-N 1 0 279.449 3.885 20 10 CHCDRO C[C@H]([NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F)c1cscn1 ZINC000850511486 1123278046 /nfs/dbraw/zinc/27/80/46/1123278046.db2.gz GELYEKZPUOCOAT-YWVKMMECSA-N 1 0 292.379 3.887 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2COC3(CCC3)C2)c1O ZINC000850523804 1123279698 /nfs/dbraw/zinc/27/96/98/1123279698.db2.gz POSWUSCFRWMVEB-WCQYABFASA-N 1 0 295.810 3.716 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+]CCCOC(C)(C)C)c2c1c(F)ccc2O ZINC000850527228 1123282343 /nfs/dbraw/zinc/28/23/43/1123282343.db2.gz VNKCWFZHJCHVBN-YPMHNXCESA-N 1 0 295.398 3.874 20 10 CHCDRO COCc1csc(C[NH2+][C@H](C)c2cc(F)ccc2O)c1 ZINC000850531688 1123284830 /nfs/dbraw/zinc/28/48/30/1123284830.db2.gz FWXCBFLZPOBYNE-SNVBAGLBSA-N 1 0 295.379 3.590 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccoc1)c1cc2c(cc1O)CCCC2 ZINC000850532414 1123286140 /nfs/dbraw/zinc/28/61/40/1123286140.db2.gz UPTSDZPHOWVSEV-CYBMUJFWSA-N 1 0 285.387 3.757 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCC[C@@H](C)O1)c1cc(Cl)ccc1O ZINC000850535311 1123286756 /nfs/dbraw/zinc/28/67/56/1123286756.db2.gz UWDPDLVNEVRBLC-NQBHXWOUSA-N 1 0 283.799 3.654 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CCCC2CCC2)c1O ZINC000850535812 1123287447 /nfs/dbraw/zinc/28/74/47/1123287447.db2.gz BYBYZGLWLJOBPF-LBPRGKRZSA-N 1 0 263.381 3.632 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCc3ccc(O)cc32)c(O)c1 ZINC000850543310 1123289242 /nfs/dbraw/zinc/28/92/42/1123289242.db2.gz HPEUNDOTHRSVMN-SJKOYZFVSA-N 1 0 283.371 3.744 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1C(C)(C)C1(F)F)c1ccccc1O ZINC000850553633 1123289904 /nfs/dbraw/zinc/28/99/04/1123289904.db2.gz ZTLVEOLXQCCNEM-AAEUAGOBSA-N 1 0 269.335 3.724 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H]2C(C)(C)C2(F)F)c(O)c1 ZINC000850552826 1123289986 /nfs/dbraw/zinc/28/99/86/1123289986.db2.gz QBTWUZDTDQGWNK-WCQYABFASA-N 1 0 283.362 3.951 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)C2CCC(F)CC2)c1 ZINC000850554380 1123290821 /nfs/dbraw/zinc/29/08/21/1123290821.db2.gz JHDARAQTTOUJGP-KBHBFKLGSA-N 1 0 295.398 3.968 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@H](C)C2CCC(F)CC2)c1O ZINC000850553726 1123291239 /nfs/dbraw/zinc/29/12/39/1123291239.db2.gz BPXPUNWMRHNXKW-IWMBGFJWSA-N 1 0 295.398 3.968 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]C2(CC(C)C)CC2)c1O ZINC000850566583 1123293376 /nfs/dbraw/zinc/29/33/76/1123293376.db2.gz OAWSFKYWXVCTSD-LBPRGKRZSA-N 1 0 263.381 3.630 20 10 CHCDRO C[C@@H]([NH2+]CCCc1ccco1)c1cc(Cl)ccc1O ZINC000850569402 1123294079 /nfs/dbraw/zinc/29/40/79/1123294079.db2.gz CSQSKLQOMSZKII-LLVKDONJSA-N 1 0 279.767 3.922 20 10 CHCDRO CC[C@H]([NH2+]CCCc1ccco1)c1ccc(C)cc1O ZINC000850570283 1123294464 /nfs/dbraw/zinc/29/44/64/1123294464.db2.gz TYHFSFAJRLKMIA-INIZCTEOSA-N 1 0 273.376 3.967 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)c1ccc2ccccc2c1O)c1nccn1C ZINC000850572942 1123295255 /nfs/dbraw/zinc/29/52/55/1123295255.db2.gz QTBFZWFSMINOIX-STQMWFEESA-N 1 0 295.386 3.691 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC[C@H](c3ccccn3)C2)cc1 ZINC000852083359 1123395787 /nfs/dbraw/zinc/39/57/87/1123395787.db2.gz DRDSXBFBCBRQCI-KRWDZBQOSA-N 1 0 295.430 3.527 20 10 CHCDRO CC(C)(C[NH2+][C@@H]1CCc2cccc(O)c21)CC(F)(F)F ZINC000853240139 1123428942 /nfs/dbraw/zinc/42/89/42/1123428942.db2.gz GRFCJIQNXLSOAH-LLVKDONJSA-N 1 0 287.325 3.948 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]C[C@H]2C[C@@H]2c2ccccc2)c1 ZINC000111397782 1123442922 /nfs/dbraw/zinc/44/29/22/1123442922.db2.gz FGPSCUJNLCNBEX-CRAIPNDOSA-N 1 0 297.398 3.684 20 10 CHCDRO COc1cc(C[N@@H+]2CC[C@H]3C[C@H]3C2)c(O)c(C(C)(C)C)c1 ZINC000853581674 1123443736 /nfs/dbraw/zinc/44/37/36/1123443736.db2.gz WXKUMFXQRUFFGC-STQMWFEESA-N 1 0 289.419 3.540 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCOC2CCCCC2)c1 ZINC000111635948 1123457470 /nfs/dbraw/zinc/45/74/70/1123457470.db2.gz OBAXNUAINUNMGI-CQSZACIVSA-N 1 0 277.408 3.701 20 10 CHCDRO Cc1cccc(C[NH2+]CCC2CC(OC(C)(C)C)C2)c1O ZINC000763640018 1129124852 /nfs/dbraw/zinc/12/48/52/1129124852.db2.gz ASIKAQDZWZSYJY-UHFFFAOYSA-N 1 0 291.435 3.774 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C(C)(C)[C@@H](O)c2ccccc2)cc1C ZINC000895659102 1123502338 /nfs/dbraw/zinc/50/23/38/1123502338.db2.gz SAVSVWWBRLRVSU-SFHVURJKSA-N 1 0 299.414 3.611 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCO[C@H](C)C1)c1ccc2ccccc2c1O ZINC000273534636 1129126539 /nfs/dbraw/zinc/12/65/39/1129126539.db2.gz XECQLVUGNYPRIW-IPYPFGDCSA-N 1 0 285.387 3.764 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C[C@H]2C[C@@H]2c2ccccc2)c1 ZINC000113341231 1123521417 /nfs/dbraw/zinc/52/14/17/1123521417.db2.gz PJBMICLWAHVKGR-NVXWUHKLSA-N 1 0 267.372 3.594 20 10 CHCDRO COc1cccc(C[NH2+]Cc2c(C)oc3ccccc32)c1O ZINC000183913273 1129127561 /nfs/dbraw/zinc/12/75/61/1129127561.db2.gz BQMRVGDCXSOHKA-UHFFFAOYSA-N 1 0 297.354 3.745 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)C1(C)CC1)c1ccc(N(C)C)cc1 ZINC000776884133 1123559977 /nfs/dbraw/zinc/55/99/77/1123559977.db2.gz ZKIMEWUKEFFRPN-XJKSGUPXSA-N 1 0 260.425 3.982 20 10 CHCDRO CC[C@H]([NH2+]CCOC(C)(C)C)c1ccc(N(C)C)cc1 ZINC000776889958 1123563995 /nfs/dbraw/zinc/56/39/95/1123563995.db2.gz NXINAEISHCYATH-INIZCTEOSA-N 1 0 278.440 3.608 20 10 CHCDRO Cc1cc(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)ccn1 ZINC000856721763 1123565745 /nfs/dbraw/zinc/56/57/45/1123565745.db2.gz NMZUDRXALRQHCN-UHFFFAOYSA-N 1 0 295.430 3.621 20 10 CHCDRO CCCc1ccc(C[NH2+]Cc2ccccc2O)s1 ZINC000856769285 1123567345 /nfs/dbraw/zinc/56/73/45/1123567345.db2.gz XDWJWZNIVIMCKS-UHFFFAOYSA-N 1 0 261.390 3.696 20 10 CHCDRO CC[C@H]([NH2+]CC[C@@H]1CC1(F)F)c1ccc(C)cc1O ZINC000857080646 1123585121 /nfs/dbraw/zinc/58/51/21/1123585121.db2.gz JZBDXYIHDCYYFO-YPMHNXCESA-N 1 0 269.335 3.787 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1ccc(F)c(F)c1 ZINC000115629082 1123620054 /nfs/dbraw/zinc/62/00/54/1123620054.db2.gz GEBQUICCUQJWIR-UHFFFAOYSA-N 1 0 290.357 3.629 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)c2ccc(F)cc2C)c(O)c1 ZINC000896796497 1123627538 /nfs/dbraw/zinc/62/75/38/1123627538.db2.gz DDWCUBZEPNZNCH-CYBMUJFWSA-N 1 0 273.351 3.999 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2C)c(O)c1 ZINC000896802600 1123628276 /nfs/dbraw/zinc/62/82/76/1123628276.db2.gz DDWCUBZEPNZNCH-ZDUSSCGKSA-N 1 0 273.351 3.999 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CCC[C@H](C)CC2)c1O ZINC000228631217 1123634232 /nfs/dbraw/zinc/63/42/32/1123634232.db2.gz HLIBFECXFGVBKI-NSHDSACASA-N 1 0 283.799 3.676 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H]2CCC[C@@H](c3cccnc3)C2)c1 ZINC000858238524 1123639206 /nfs/dbraw/zinc/63/92/06/1123639206.db2.gz AFADRUKCRSNHRV-QAPCUYQASA-N 1 0 296.414 3.912 20 10 CHCDRO C[C@H](C[NH2+]Cc1cc(Cl)ccc1O)c1ccccc1 ZINC000020551999 1123648134 /nfs/dbraw/zinc/64/81/34/1123648134.db2.gz VWRLTNOVDQSWPU-GFCCVEGCSA-N 1 0 275.779 3.939 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CC[C@H]2CC=CCC2)c1O ZINC000858515213 1123659533 /nfs/dbraw/zinc/65/95/33/1123659533.db2.gz FKJWJAATZPCPTA-KGLIPLIRSA-N 1 0 275.392 3.798 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccns2)c(O)c1C ZINC000858575588 1123664013 /nfs/dbraw/zinc/66/40/13/1123664013.db2.gz BLRDDKNFWXWEAS-NWDGAFQWSA-N 1 0 276.405 3.877 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CCc2ccsc2C1 ZINC000127062318 1123690506 /nfs/dbraw/zinc/69/05/06/1123690506.db2.gz UAKQHKZGKWIGLO-UHFFFAOYSA-N 1 0 279.792 3.665 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(O)ccc1Cl)c1ccccc1O ZINC000859233312 1123691969 /nfs/dbraw/zinc/69/19/69/1123691969.db2.gz QZQHVWRWNJSFPQ-HNNXBMFYSA-N 1 0 291.778 3.992 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CC[C@H]3CC[C@@H](C2)S3)cc1 ZINC000859545914 1123700685 /nfs/dbraw/zinc/70/06/85/1123700685.db2.gz YPXJOOVJXUVNQW-SJORKVTESA-N 1 0 290.476 3.613 20 10 CHCDRO CCCN(Cc1ccncc1Cl)c1ccc(C[NH3+])cc1 ZINC000862347585 1123801176 /nfs/dbraw/zinc/80/11/76/1123801176.db2.gz HMLPAENQGGAGBT-UHFFFAOYSA-N 1 0 289.810 3.610 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H](C)C1CC(F)(F)C1 ZINC000862348009 1123801833 /nfs/dbraw/zinc/80/18/33/1123801833.db2.gz XTKIZJVKQNFELM-LBPRGKRZSA-N 1 0 282.378 3.796 20 10 CHCDRO CC[C@H](Cc1cccs1)[NH2+]Cc1cc(C)ccc1O ZINC000862476129 1123813478 /nfs/dbraw/zinc/81/34/78/1123813478.db2.gz JVUVQMKJNLQEAX-CQSZACIVSA-N 1 0 275.417 3.873 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH+]2CC(Cc3ccco3)C2)cc1 ZINC000862487158 1123814252 /nfs/dbraw/zinc/81/42/52/1123814252.db2.gz NNCPCZFUAIJKCA-HYXAFXHYSA-N 1 0 296.414 3.533 20 10 CHCDRO CCc1ccc(C[NH2+]Cc2c(C)c3ccccc3n2C)o1 ZINC000475196058 1123821301 /nfs/dbraw/zinc/82/13/01/1123821301.db2.gz YMJLAYIVRWSDMC-UHFFFAOYSA-N 1 0 282.387 3.932 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](C)CCOC)c1cc(Cl)ccc1O ZINC000840836224 1123838165 /nfs/dbraw/zinc/83/81/65/1123838165.db2.gz VWEFAKUCUYVICX-RISCZKNCSA-N 1 0 285.815 3.759 20 10 CHCDRO C[C@@H]1C[NH+](Cc2cc3c(cc2O)CCC3)C[C@@H](C)C1(F)F ZINC000863274976 1123857110 /nfs/dbraw/zinc/85/71/10/1123857110.db2.gz OVERCQVXNHPGDK-VXGBXAGGSA-N 1 0 295.373 3.604 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CS[C@@H](C)C1)c1cccc(Cl)c1[O-] ZINC000840860980 1123861689 /nfs/dbraw/zinc/86/16/89/1123861689.db2.gz YKMOSTLBSYJRFO-CWSCBRNRSA-N 1 0 285.840 3.980 20 10 CHCDRO CO[C@@]1(C)CCC[N@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000794653801 1123924885 /nfs/dbraw/zinc/92/48/85/1123924885.db2.gz FSIISGPUAJZOLR-SFHVURJKSA-N 1 0 291.435 3.825 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CC3(CCC3)C[C@H]2C)c(O)c1 ZINC000763645533 1129154052 /nfs/dbraw/zinc/15/40/52/1129154052.db2.gz HQHWAQLPKPULPW-CYBMUJFWSA-N 1 0 275.392 3.555 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccccc1)c1ccc(C)cc1O ZINC000794791560 1123949183 /nfs/dbraw/zinc/94/91/83/1123949183.db2.gz AUDGTSJDKLONPK-QGZVFWFLSA-N 1 0 269.388 3.984 20 10 CHCDRO CC[C@@H]([NH2+]CC1(N(C)C)CCCC1)c1ccc(C)cc1O ZINC000794794829 1123949982 /nfs/dbraw/zinc/94/99/82/1123949982.db2.gz RBDJQURLMNVTCN-MRXNPFEDSA-N 1 0 290.451 3.616 20 10 CHCDRO CC[C@H]([NH2+]CCCOCC(C)C)c1ccc(C)cc1O ZINC000794793554 1123950748 /nfs/dbraw/zinc/95/07/48/1123950748.db2.gz PAOWLDLICYGFIG-INIZCTEOSA-N 1 0 279.424 3.804 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](O)c1ccc(C)cc1)c1ccc(C)cc1O ZINC000794802491 1123950820 /nfs/dbraw/zinc/95/08/20/1123950820.db2.gz NNWGJFXGCOJDBK-IEBWSBKVSA-N 1 0 299.414 3.783 20 10 CHCDRO CC[C@H]([NH2+]Cc1ncc(C)s1)c1ccc(C)cc1O ZINC000794802640 1123952562 /nfs/dbraw/zinc/95/25/62/1123952562.db2.gz OMLIFLRDZKYMHG-ZDUSSCGKSA-N 1 0 276.405 3.706 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](O)CC(C)(C)C)c1ccc(C)cc1O ZINC000794805589 1123953731 /nfs/dbraw/zinc/95/37/31/1123953731.db2.gz XTEHFXKUPWJUST-UKRRQHHQSA-N 1 0 279.424 3.538 20 10 CHCDRO CC[C@H]([NH2+]CC1(CCO)CCCC1)c1ccc(C)cc1O ZINC000794806258 1123955334 /nfs/dbraw/zinc/95/53/34/1123955334.db2.gz ZMVCAISYMRUXCI-INIZCTEOSA-N 1 0 291.435 3.684 20 10 CHCDRO CC[C@@H]([NH2+]CC1(CCO)CCCC1)c1ccc(C)cc1O ZINC000794806259 1123955503 /nfs/dbraw/zinc/95/55/03/1123955503.db2.gz ZMVCAISYMRUXCI-MRXNPFEDSA-N 1 0 291.435 3.684 20 10 CHCDRO CC[C@H]([NH2+][C@@H](CC)[C@@H]1CCCO1)c1ccc(C)cc1O ZINC000794815945 1123959202 /nfs/dbraw/zinc/95/92/02/1123959202.db2.gz MKUUQGDJCSAAKM-ZOBUZTSGSA-N 1 0 277.408 3.699 20 10 CHCDRO CC[C@@H]([NH2+]CC1(C2CC2)CC1)c1ccc(C)cc1O ZINC000794817831 1123960970 /nfs/dbraw/zinc/96/09/70/1123960970.db2.gz RMTUYVWPKWNCNT-OAHLLOKOSA-N 1 0 259.393 3.932 20 10 CHCDRO C[C@@H]([NH2+]CCCc1ccccc1F)c1ccccc1O ZINC000794840485 1123988716 /nfs/dbraw/zinc/98/87/16/1123988716.db2.gz IXYGMEVHIYHNRX-CYBMUJFWSA-N 1 0 273.351 3.815 20 10 CHCDRO Cc1cccc(C[N@H+]2C[C@H](C)[C@@H]3CCCC[C@H]32)c1O ZINC000783593269 1123998378 /nfs/dbraw/zinc/99/83/78/1123998378.db2.gz OVPWXOLRKLXXNO-CWRNSKLLSA-N 1 0 259.393 3.711 20 10 CHCDRO CCOc1ccc(C[NH2+]Cc2csc(C)c2C)c(O)c1 ZINC000865679984 1124004716 /nfs/dbraw/zinc/00/47/16/1124004716.db2.gz MNMUZHJOCSLJLH-UHFFFAOYSA-N 1 0 291.416 3.759 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]CC2([C@@H]3CCCCO3)CCC2)c1 ZINC000865725856 1124007754 /nfs/dbraw/zinc/00/77/54/1124007754.db2.gz FDLDXYGFYAKCQN-KRWDZBQOSA-N 1 0 289.419 3.530 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2c(O)cc(C)cc2Cl)o1 ZINC000865723974 1124007857 /nfs/dbraw/zinc/00/78/57/1124007857.db2.gz YITBCPQJIJXHNT-UHFFFAOYSA-N 1 0 265.740 3.545 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H](CF)c2ccc(F)cc2)c1 ZINC000865823074 1124017679 /nfs/dbraw/zinc/01/76/79/1124017679.db2.gz RGTHMEVZNLNUEQ-OAHLLOKOSA-N 1 0 277.314 3.640 20 10 CHCDRO C[C@H]([NH2+]CC[C@@H]1CCSC1)c1cc(Cl)ccc1O ZINC000866403497 1124063820 /nfs/dbraw/zinc/06/38/20/1124063820.db2.gz QOIZZLQBUPBFNZ-WDEREUQCSA-N 1 0 285.840 3.839 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccnc(F)c1)c1cc(Cl)ccc1O ZINC000866472562 1124069004 /nfs/dbraw/zinc/06/90/04/1124069004.db2.gz BDYDOCYDHLGPCC-CYBMUJFWSA-N 1 0 294.757 3.821 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]Cc2cccc(F)c2F)c1O ZINC000866476782 1124069789 /nfs/dbraw/zinc/06/97/89/1124069789.db2.gz SCFKKEHPIURSGL-SNVBAGLBSA-N 1 0 293.313 3.530 20 10 CHCDRO COC(C)(C)CC[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000866504170 1124073824 /nfs/dbraw/zinc/07/38/24/1124073824.db2.gz AETUDMDJWXUIJJ-JTQLQIEISA-N 1 0 271.788 3.511 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H](C2CCC2)[C@@H]2CCOC2)c(O)c1 ZINC000866513008 1124076031 /nfs/dbraw/zinc/07/60/31/1124076031.db2.gz RADDFZCHHPJQLN-JCKWVBRZSA-N 1 0 289.419 3.556 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C2CCC2)[C@@H]2CCOC2)c1 ZINC000866511182 1124076131 /nfs/dbraw/zinc/07/61/31/1124076131.db2.gz BHJJYLGSFSQFAR-JOQOYGCGSA-N 1 0 289.419 3.556 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1c2ccccc2CN1C)c1ccccc1O ZINC000866562721 1124082651 /nfs/dbraw/zinc/08/26/51/1124082651.db2.gz GNWZXAPBGPWMEB-MSOLQXFVSA-N 1 0 296.414 3.620 20 10 CHCDRO CC[C@@H]([NH2+]C1([C@@H]2CCCCO2)CCC1)c1ccccc1O ZINC000866622790 1124091610 /nfs/dbraw/zinc/09/16/10/1124091610.db2.gz JBUFCHGMBOALLB-WBVHZDCISA-N 1 0 289.419 3.925 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]CCCC(F)F ZINC001119542169 1131258167 /nfs/dbraw/zinc/25/81/67/1131258167.db2.gz XQDOWZRNBUZDPF-GHMZBOCLSA-N 1 0 269.335 3.884 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C[C@@H]2CCCS2)cc1 ZINC000122044621 1124461880 /nfs/dbraw/zinc/46/18/80/1124461880.db2.gz OWYWSEFPMSPKSJ-INIZCTEOSA-N 1 0 278.465 3.518 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)c1ccco1 ZINC000122758315 1124529119 /nfs/dbraw/zinc/52/91/19/1124529119.db2.gz CNVNMLJILBYMMV-ZDUSSCGKSA-N 1 0 258.365 3.505 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)[C@H]1CCCOC1 ZINC000872064429 1124672608 /nfs/dbraw/zinc/67/26/08/1124672608.db2.gz YSEIVTVGMZYWET-ZVZYQTTQSA-N 1 0 290.451 3.608 20 10 CHCDRO COCC(C)(C)CC[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000872104740 1124682383 /nfs/dbraw/zinc/68/23/83/1124682383.db2.gz OIHQXTYCWIXSBO-AAEUAGOBSA-N 1 0 295.398 3.732 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CC[C@H]2CNc3ccccc32)c1 ZINC000873237912 1124754298 /nfs/dbraw/zinc/75/42/98/1124754298.db2.gz VMLDOBULAXWCNN-GJZGRUSLSA-N 1 0 296.414 3.951 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CC[C@H]2CNc3ccccc32)c1 ZINC000873237911 1124754987 /nfs/dbraw/zinc/75/49/87/1124754987.db2.gz VMLDOBULAXWCNN-CABCVRRESA-N 1 0 296.414 3.951 20 10 CHCDRO CCOc1cccc(C[NH2+]C2CCCCCCC2)c1O ZINC000019910008 1124768376 /nfs/dbraw/zinc/76/83/76/1124768376.db2.gz UACCYLXREKOSFX-UHFFFAOYSA-N 1 0 277.408 3.993 20 10 CHCDRO COc1cccc(C[NH2+]C2CCCCCCC2)c1O ZINC000019910010 1124768446 /nfs/dbraw/zinc/76/84/46/1124768446.db2.gz NQDHNBPAXXFYMD-UHFFFAOYSA-N 1 0 263.381 3.603 20 10 CHCDRO COc1ccc(CC[NH2+][C@H](C)c2ccc(C)cc2O)cc1 ZINC000020088165 1124804740 /nfs/dbraw/zinc/80/47/40/1124804740.db2.gz PBCYGEVDMBCNOZ-CQSZACIVSA-N 1 0 285.387 3.603 20 10 CHCDRO COc1ccccc1[C@H](C)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000020096564 1124805391 /nfs/dbraw/zinc/80/53/91/1124805391.db2.gz VCKVIHDKARVCJD-AWEZNQCLSA-N 1 0 284.403 3.612 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H]1CCCSCC1 ZINC000825710641 1124814000 /nfs/dbraw/zinc/81/40/00/1124814000.db2.gz WDYHNAZJPDNEMN-OAHLLOKOSA-N 1 0 278.465 3.647 20 10 CHCDRO COc1cccc(C[N@@H+]2CCC[C@@H]2Cc2ccccc2)c1O ZINC000124974027 1124829032 /nfs/dbraw/zinc/82/90/32/1124829032.db2.gz JBWLLZJLGZPBRF-QGZVFWFLSA-N 1 0 297.398 3.608 20 10 CHCDRO Oc1cccc(Cl)c1C[NH+]1C[C@@H]2CCCC[C@H]2C1 ZINC000310780064 1124910264 /nfs/dbraw/zinc/91/02/64/1124910264.db2.gz FIHOWEZFWVXIMA-RYUDHWBXSA-N 1 0 265.784 3.668 20 10 CHCDRO CCOCc1ccc(C[NH2+]Cc2c(C)cccc2O)cc1 ZINC000876926818 1124989612 /nfs/dbraw/zinc/98/96/12/1124989612.db2.gz HDCPRAVZGPYDGI-UHFFFAOYSA-N 1 0 285.387 3.527 20 10 CHCDRO Cc1ccc(C[NH2+]C(C)(C)c2ccccc2)c(O)c1 ZINC000876972860 1124992876 /nfs/dbraw/zinc/99/28/76/1124992876.db2.gz QFCNSGZTYIOYOB-UHFFFAOYSA-N 1 0 255.361 3.726 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]Cc2ccc(C)cc2O)c1 ZINC000876952183 1124992923 /nfs/dbraw/zinc/99/29/23/1124992923.db2.gz YGJFCSVAYSVHPN-ZDUSSCGKSA-N 1 0 271.360 3.560 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]Cc1ccccc1OC(C)C ZINC000876956969 1124993210 /nfs/dbraw/zinc/99/32/10/1124993210.db2.gz PNNYIAZFLFTVQI-UHFFFAOYSA-N 1 0 285.387 3.778 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]Cc2ccc(C)cc2O)c1 ZINC000876952162 1124993642 /nfs/dbraw/zinc/99/36/42/1124993642.db2.gz YGJFCSVAYSVHPN-CYBMUJFWSA-N 1 0 271.360 3.560 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](c2ncccc2C)C(C)C)c(O)c1 ZINC000877043587 1125002498 /nfs/dbraw/zinc/00/24/98/1125002498.db2.gz KIFZEDOMDGOBEM-KRWDZBQOSA-N 1 0 284.403 3.891 20 10 CHCDRO Cc1ccc(C[NH2+][C@H]2COc3c2cccc3Cl)c(O)c1 ZINC000877094214 1125008824 /nfs/dbraw/zinc/00/88/24/1125008824.db2.gz IDNWORCVNLDCTJ-AWEZNQCLSA-N 1 0 289.762 3.577 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC(F)(F)[C@@H](C)C2)cc1Cl ZINC000825943686 1125017617 /nfs/dbraw/zinc/01/76/17/1125017617.db2.gz ICNAORPGZAGYCI-JTQLQIEISA-N 1 0 289.753 3.831 20 10 CHCDRO CCO[C@@H](C[NH2+]Cc1c(C)cccc1O)c1ccccc1 ZINC000877481564 1125032883 /nfs/dbraw/zinc/03/28/83/1125032883.db2.gz KZILGSSFMNPHPY-SFHVURJKSA-N 1 0 285.387 3.568 20 10 CHCDRO Cc1ccc(C[NH2+]C[C@H]2CSc3ccccc32)c(O)c1 ZINC000877556900 1125045562 /nfs/dbraw/zinc/04/55/62/1125045562.db2.gz CCMXUOHVSOYMAN-AWEZNQCLSA-N 1 0 285.412 3.680 20 10 CHCDRO Cc1ccc(C[NH2+]C2CCC(C(F)F)CC2)c(O)c1 ZINC000877585749 1125048365 /nfs/dbraw/zinc/04/83/65/1125048365.db2.gz VSICMFPUUFHCFM-UHFFFAOYSA-N 1 0 269.335 3.614 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]Cc1cnccc1C(C)(C)C ZINC000877587892 1125050638 /nfs/dbraw/zinc/05/06/38/1125050638.db2.gz JFLGLCFOHJJARS-UHFFFAOYSA-N 1 0 284.403 3.683 20 10 CHCDRO Cc1ccc(C[NH2+]C2CCC(OC(C)(C)C)CC2)c(O)c1 ZINC000877682565 1125062972 /nfs/dbraw/zinc/06/29/72/1125062972.db2.gz PDZTUWNISPKSED-UHFFFAOYSA-N 1 0 291.435 3.917 20 10 CHCDRO CCc1nc(C)c(C[NH2+]Cc2cc(Cl)c(C)cc2O)o1 ZINC000825992148 1125063118 /nfs/dbraw/zinc/06/31/18/1125063118.db2.gz SAYTYOXMIRHJAH-UHFFFAOYSA-N 1 0 294.782 3.503 20 10 CHCDRO Cc1cccc(C[NH2+]C[C@@H]2CC=CC[C@H]2C(F)(F)F)c1O ZINC000877728824 1125069222 /nfs/dbraw/zinc/06/92/22/1125069222.db2.gz JUQGPIUEXXMQLQ-GXTWGEPZSA-N 1 0 299.336 3.935 20 10 CHCDRO Cc1cccc(C[NH2+][C@H](C)c2ccccc2O)c1F ZINC000877755632 1125073224 /nfs/dbraw/zinc/07/32/24/1125073224.db2.gz IUXAZDWOONFFMC-GFCCVEGCSA-N 1 0 259.324 3.691 20 10 CHCDRO CO[C@H](c1ccccc1)[C@H](C)[NH2+][C@H](C)c1ccccc1O ZINC000877757631 1125074378 /nfs/dbraw/zinc/07/43/78/1125074378.db2.gz PBHIDNUGCHXHRW-GLJUWKHASA-N 1 0 285.387 3.819 20 10 CHCDRO CCOc1cccc(F)c1C[NH2+][C@H](C)c1ccccc1O ZINC000877757814 1125074580 /nfs/dbraw/zinc/07/45/80/1125074580.db2.gz WBTZNIWNBFBLME-GFCCVEGCSA-N 1 0 289.350 3.781 20 10 CHCDRO CCn1nc(C[NH2+][C@@H](C)c2ccccc2O)c2ccccc21 ZINC000877757342 1125075082 /nfs/dbraw/zinc/07/50/82/1125075082.db2.gz RDSKURFHDFKSHH-ZDUSSCGKSA-N 1 0 295.386 3.613 20 10 CHCDRO Cc1conc1CN(C)Cc1ccc(N2CCCCC2)cc1 ZINC000877922728 1125102483 /nfs/dbraw/zinc/10/24/83/1125102483.db2.gz UDFAOXFVWAJYTA-UHFFFAOYSA-N 1 0 299.418 3.605 20 10 CHCDRO C[N@@H+](Cc1ccccc1O)C[C@H]1CC[C@H](c2ccccc2)O1 ZINC000878242895 1125133894 /nfs/dbraw/zinc/13/38/94/1125133894.db2.gz WSHAYIXOLUHZTA-IEBWSBKVSA-N 1 0 297.398 3.744 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCC2(CCC2)O1)c1ccc(N(C)C)cc1 ZINC000878454717 1125155087 /nfs/dbraw/zinc/15/50/87/1125155087.db2.gz GXNYHDJGWSKWLX-YOEHRIQHSA-N 1 0 288.435 3.505 20 10 CHCDRO COCC[C@@H]([NH2+][C@H](C)c1ccccc1O)c1ccccc1 ZINC000879649007 1125222308 /nfs/dbraw/zinc/22/23/08/1125222308.db2.gz GYXBGOUWGRBJGA-RHSMWYFYSA-N 1 0 285.387 3.821 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(C(F)(F)F)cn1)c1ccccc1O ZINC000879649413 1125222631 /nfs/dbraw/zinc/22/26/31/1125222631.db2.gz RGQJWNTZYHFHRO-SNVBAGLBSA-N 1 0 296.292 3.657 20 10 CHCDRO CCCCOCCC[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000128020913 1125235207 /nfs/dbraw/zinc/23/52/07/1125235207.db2.gz VQAGFLCTJMKGOU-OAHLLOKOSA-N 1 0 278.440 3.610 20 10 CHCDRO COc1ccc(O)c(C[N@H+](CC(C)C)C2CCCC2)c1 ZINC000211653088 1125314860 /nfs/dbraw/zinc/31/48/60/1125314860.db2.gz MBXKEAPNNMIGHD-UHFFFAOYSA-N 1 0 277.408 3.801 20 10 CHCDRO CC[C@H](C)[NH2+][C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 ZINC000130082345 1125356353 /nfs/dbraw/zinc/35/63/53/1125356353.db2.gz NVJUVSPSEQLDGU-STQMWFEESA-N 1 0 298.377 3.645 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]CC[C@H]1CCCC1(F)F)CC2 ZINC000883274702 1125390556 /nfs/dbraw/zinc/39/05/56/1125390556.db2.gz RYQUPEPIWQVJBW-CHWSQXEVSA-N 1 0 281.346 3.795 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1cc(Cl)ccc1O)[C@@H]1CCCOC1 ZINC000883353586 1125400199 /nfs/dbraw/zinc/40/01/99/1125400199.db2.gz XXEWIPKXASMTEJ-JMSVASOKSA-N 1 0 297.826 3.901 20 10 CHCDRO COc1ccc(O)c(C[N@H+](C)[C@H]2CCc3ccccc32)c1 ZINC000131994401 1125412626 /nfs/dbraw/zinc/41/26/26/1125412626.db2.gz SLXRACAULUNPFG-KRWDZBQOSA-N 1 0 283.371 3.520 20 10 CHCDRO C[C@@H]([NH2+]CCCSc1nccs1)c1cncc(F)c1 ZINC000132272930 1125416956 /nfs/dbraw/zinc/41/69/56/1125416956.db2.gz JLOIWODPGGMDSX-SNVBAGLBSA-N 1 0 297.424 3.510 20 10 CHCDRO C[C@H]([NH2+]CC(C1CC1)C1CC1)c1ccc(N(C)C)cc1 ZINC000088455418 1129205792 /nfs/dbraw/zinc/20/57/92/1129205792.db2.gz KTGZDEOSWCHGPM-ZDUSSCGKSA-N 1 0 272.436 3.839 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCc2cccc(O)c21)c1cccc([N+](=O)[O-])c1 ZINC000295992124 1129220741 /nfs/dbraw/zinc/22/07/41/1129220741.db2.gz NUFDGPWWIFAWPO-NHYWBVRUSA-N 1 0 298.342 3.639 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1cc2c(cc1O)CCCC2)C1CC1 ZINC000184892711 1129261083 /nfs/dbraw/zinc/26/10/83/1129261083.db2.gz LOIBZBJOPYUAPR-NEPJUHHUSA-N 1 0 259.393 3.720 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cc(F)cc(F)c2)c1 ZINC000184931838 1129264418 /nfs/dbraw/zinc/26/44/18/1129264418.db2.gz PIFQKOXAWTZVSQ-JTQLQIEISA-N 1 0 293.313 3.530 20 10 CHCDRO CCCC[N@H+](Cc1ccc(F)cn1)Cc1ccccc1O ZINC000282571515 1129272910 /nfs/dbraw/zinc/27/29/10/1129272910.db2.gz ZQDAQGOMFHPKNP-UHFFFAOYSA-N 1 0 288.366 3.729 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](C)CC(C)(C)OC)cc1 ZINC000766191219 1129280716 /nfs/dbraw/zinc/28/07/16/1129280716.db2.gz LKRZQCCFBDJITF-LSDHHAIUSA-N 1 0 292.467 3.997 20 10 CHCDRO C[C@H](F)CC[NH2+][C@@H](C)c1ccc(Br)cc1O ZINC000378855574 1129283858 /nfs/dbraw/zinc/28/38/58/1129283858.db2.gz JZCXVPQEEZEZFO-IUCAKERBSA-N 1 0 290.176 3.553 20 10 CHCDRO C[C@@H]([NH2+]CC[C@H](C)F)c1ccc(Br)cc1O ZINC000378855573 1129284022 /nfs/dbraw/zinc/28/40/22/1129284022.db2.gz JZCXVPQEEZEZFO-DTWKUNHWSA-N 1 0 290.176 3.553 20 10 CHCDRO C[C@]1([NH2+]Cc2ccccc2O)CCCc2ccccc21 ZINC000734844132 1129323870 /nfs/dbraw/zinc/32/38/70/1129323870.db2.gz VGMDIYRRHUMVLX-SFHVURJKSA-N 1 0 267.372 3.734 20 10 CHCDRO C[C@H]([NH2+]CC1(C2CC2)CC1)c1ccc(N(C)C)cc1 ZINC000090772899 1129329231 /nfs/dbraw/zinc/32/92/31/1129329231.db2.gz PMYPZISNSRCIRF-ZDUSSCGKSA-N 1 0 258.409 3.593 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]CC1Cc2ccccc2C1 ZINC000735323516 1129339270 /nfs/dbraw/zinc/33/92/70/1129339270.db2.gz BEJGSINYAXVAOP-UHFFFAOYSA-N 1 0 287.790 3.550 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C[C@@H]2CCc3ccccc3C2)cc1 ZINC000735324643 1129339570 /nfs/dbraw/zinc/33/95/70/1129339570.db2.gz XWBKBKVNZMAVCO-QGZVFWFLSA-N 1 0 294.442 3.647 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)[C@H]2CCCCO2)cc1 ZINC000379300140 1129358915 /nfs/dbraw/zinc/35/89/15/1129358915.db2.gz OYLSWCPZNPUGMR-MAUKXSAKSA-N 1 0 290.451 3.580 20 10 CHCDRO CCc1ccc(CC[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC000736358392 1129372984 /nfs/dbraw/zinc/37/29/84/1129372984.db2.gz XYSSNLPSXQOWBO-UHFFFAOYSA-N 1 0 281.399 3.516 20 10 CHCDRO C[N@H+](Cc1ccc(F)c(Cl)c1)Cc1ccccc1O ZINC000091956663 1129375613 /nfs/dbraw/zinc/37/56/13/1129375613.db2.gz NWUPDNRRUCJKHT-UHFFFAOYSA-N 1 0 279.742 3.817 20 10 CHCDRO CC(C)COC1CC[NH+](Cc2cc(Cl)ccc2O)CC1 ZINC000092223144 1129383705 /nfs/dbraw/zinc/38/37/05/1129383705.db2.gz AVYVCVRCDYGQQV-UHFFFAOYSA-N 1 0 297.826 3.683 20 10 CHCDRO Cc1noc(C)c1[C@H](C)[NH2+][C@H](C)c1cc(C)ccc1O ZINC000092326648 1129386508 /nfs/dbraw/zinc/38/65/08/1129386508.db2.gz CRDKNGBUGSOJKP-MNOVXSKESA-N 1 0 274.364 3.717 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CCC[C@H]3CCC[C@@H]32)c1 ZINC000092485803 1129395527 /nfs/dbraw/zinc/39/55/27/1129395527.db2.gz SAQDSZMRMKUTLL-CJNGLKHVSA-N 1 0 275.392 3.555 20 10 CHCDRO CC[C@H](C)[C@H](C)[N@H+](Cc1cccc(OC)c1O)C1CC1 ZINC000093132212 1129418068 /nfs/dbraw/zinc/41/80/68/1129418068.db2.gz DDCVSRMFIRZMLL-STQMWFEESA-N 1 0 277.408 3.800 20 10 CHCDRO CCO[C@@H]1C[C@H]([NH2+][C@H](C)c2cc(C)ccc2O)C12CCC2 ZINC000248498178 1129420257 /nfs/dbraw/zinc/42/02/57/1129420257.db2.gz MEUYGPXPIFYTHH-XOKHGSTOSA-N 1 0 289.419 3.699 20 10 CHCDRO C[C@@H](c1cccc(O)c1)[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC000093315174 1129421315 /nfs/dbraw/zinc/42/13/15/1129421315.db2.gz UAPRILXXCJYTEN-AWEZNQCLSA-N 1 0 284.403 3.651 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](C)[C@H](CCO)c2ccccc2)cc1C ZINC000093442495 1129424023 /nfs/dbraw/zinc/42/40/23/1129424023.db2.gz PQIHTQRLYRWRTI-GOSISDBHSA-N 1 0 299.414 3.565 20 10 CHCDRO CCS[C@@H]1CC[C@H]([N@H+](C)Cc2cc(C)ccc2O)C1 ZINC000093868897 1129428721 /nfs/dbraw/zinc/42/87/21/1129428721.db2.gz PTYRMXCXPXMXPZ-LSDHHAIUSA-N 1 0 279.449 3.807 20 10 CHCDRO C[C@H]([NH2+]Cc1cccc(F)c1)c1cc(F)ccc1O ZINC000094617031 1129448093 /nfs/dbraw/zinc/44/80/93/1129448093.db2.gz NLMJWHPUGQZXLO-JTQLQIEISA-N 1 0 263.287 3.521 20 10 CHCDRO Cc1ccccc1CC[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000094618518 1129448164 /nfs/dbraw/zinc/44/81/64/1129448164.db2.gz FNKCFQDSZSJKMA-ZDUSSCGKSA-N 1 0 273.351 3.733 20 10 CHCDRO C[C@@H]([NH2+]CC(C1CC1)C1CC1)c1cc(F)ccc1O ZINC000094618421 1129448217 /nfs/dbraw/zinc/44/82/17/1129448217.db2.gz RTGKDVAEYOEOTN-SNVBAGLBSA-N 1 0 263.356 3.618 20 10 CHCDRO C[C@H](CCc1ccco1)[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000094616934 1129448602 /nfs/dbraw/zinc/44/86/02/1129448602.db2.gz LAPWQKLJMSSDPI-NEPJUHHUSA-N 1 0 277.339 3.796 20 10 CHCDRO C[C@@H]1CCC[C@@H](C)[N@H+](Cc2c(O)ccc3ccncc32)C1 ZINC000742154178 1129468406 /nfs/dbraw/zinc/46/84/06/1129468406.db2.gz FBUNGRJJXAUDBA-ZIAGYGMSSA-N 1 0 284.403 3.951 20 10 CHCDRO CC1(C)[C@@H]2C[N@@H+](Cc3c(O)ccc4ccccc43)C[C@@H]21 ZINC000742166382 1129468480 /nfs/dbraw/zinc/46/84/80/1129468480.db2.gz MLERNMQTJMCHAZ-IYBDPMFKSA-N 1 0 267.372 3.633 20 10 CHCDRO Cc1ccc(CC[C@H](C)[NH2+]Cc2cc(C)ccc2O)o1 ZINC000742380957 1129473275 /nfs/dbraw/zinc/47/32/75/1129473275.db2.gz UCFSDUYNAMALIB-ZDUSSCGKSA-N 1 0 273.376 3.713 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H]2CC[C@H]3CCC[C@H]3C2)c1O ZINC000742378688 1129476182 /nfs/dbraw/zinc/47/61/82/1129476182.db2.gz JQTRQKDNIMSYPK-IJEWVQPXSA-N 1 0 289.419 3.849 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H]2CCC[C@H](C)[C@H]2C)c1O ZINC000250514063 1129483534 /nfs/dbraw/zinc/48/35/34/1129483534.db2.gz LXQPTJZOKURNCP-GZBFAFLISA-N 1 0 277.408 3.705 20 10 CHCDRO Cc1ccc(C)c(OCC[N@@H+](C)Cc2ccccc2O)c1 ZINC000303429789 1129542494 /nfs/dbraw/zinc/54/24/94/1129542494.db2.gz BRDBMEMCANMELU-UHFFFAOYSA-N 1 0 285.387 3.520 20 10 CHCDRO COc1ccc(N2CC[C@@H](C[NH2+]CCC(C)(C)C)C2)cc1 ZINC000822494190 1131381801 /nfs/dbraw/zinc/38/18/01/1131381801.db2.gz IUPFJJQNJVVKGO-HNNXBMFYSA-N 1 0 290.451 3.547 20 10 CHCDRO CC[C@H]1C[C@@H](C)C[N@@H+]1Cc1cc2c(cc1O)CCC2 ZINC000744444605 1129577884 /nfs/dbraw/zinc/57/78/84/1129577884.db2.gz XQCDMCCTQKBEOF-WBMJQRKESA-N 1 0 259.393 3.501 20 10 CHCDRO CC(C)O[C@@H]1C[C@H]([NH2+][C@@H](C)c2cc(F)ccc2O)C1(C)C ZINC000766330174 1129604614 /nfs/dbraw/zinc/60/46/14/1129604614.db2.gz BQHTZCYBIHBTJN-KNXALSJPSA-N 1 0 295.398 3.774 20 10 CHCDRO CC[C@@H]([NH2+]CCC(F)(F)F)c1ccc(N(C)C)cc1 ZINC000766526512 1129681569 /nfs/dbraw/zinc/68/15/69/1129681569.db2.gz DJLOEONBUGGXBS-CYBMUJFWSA-N 1 0 274.330 3.746 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)C[C@@H]1CCOC1)c1ccc(N(C)C)cc1 ZINC000766582275 1129697123 /nfs/dbraw/zinc/69/71/23/1129697123.db2.gz QDMJPPSLFUFFND-MPGHIAIKSA-N 1 0 290.451 3.608 20 10 CHCDRO COc1cc(Cl)cc(C[NH+]2C[C@@H]3CCCC[C@H]3C2)c1O ZINC000380325622 1129739753 /nfs/dbraw/zinc/73/97/53/1129739753.db2.gz PMUZFXYLQIISTB-RYUDHWBXSA-N 1 0 295.810 3.676 20 10 CHCDRO C[C@@H]([NH2+]C[C@@]1(C)CC1(Cl)Cl)c1ccccc1O ZINC000828655691 1131394755 /nfs/dbraw/zinc/39/47/55/1131394755.db2.gz GJTYXPGTSYWAQQ-BXKDBHETSA-N 1 0 274.191 3.627 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)[C@@H](O)c2ccc(C)cc2)cc1C ZINC000796490654 1129755403 /nfs/dbraw/zinc/75/54/03/1129755403.db2.gz WHXMTMDYGJUIJS-DNVCBOLYSA-N 1 0 299.414 3.524 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)[C@@H](O)c2ccc(C)cc2)cc1C ZINC000796490657 1129755583 /nfs/dbraw/zinc/75/55/83/1129755583.db2.gz WHXMTMDYGJUIJS-HNAYVOBHSA-N 1 0 299.414 3.524 20 10 CHCDRO COc1cccc(O)c1C[NH2+]Cc1c(C)oc2ccccc21 ZINC000767194986 1129780824 /nfs/dbraw/zinc/78/08/24/1129780824.db2.gz TWMWGNJHQCWING-UHFFFAOYSA-N 1 0 297.354 3.745 20 10 CHCDRO CCc1cccc(C[NH2+]C2CCC(CSC)CC2)c1O ZINC000691435935 1129781152 /nfs/dbraw/zinc/78/11/52/1129781152.db2.gz PUYAGXKRTCVDMN-UHFFFAOYSA-N 1 0 293.476 3.966 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2c(O)ccc3ccccc32)[C@@H]1C ZINC000380743037 1129832099 /nfs/dbraw/zinc/83/20/99/1129832099.db2.gz ULFUALDIZOPRGY-CHWSQXEVSA-N 1 0 255.361 3.776 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CCCC[C@H]2CC)c1 ZINC000768137501 1129834947 /nfs/dbraw/zinc/83/49/47/1129834947.db2.gz DIAAGRAIYDZEGR-CQSZACIVSA-N 1 0 263.381 3.555 20 10 CHCDRO CC[N@H+](Cc1ccsc1)Cc1ccc(N(C)C)cc1 ZINC000768131905 1129835112 /nfs/dbraw/zinc/83/51/12/1129835112.db2.gz BBFLZEIPYHEXFA-UHFFFAOYSA-N 1 0 274.433 3.836 20 10 CHCDRO CO[C@H](C[NH2+]Cc1c(O)cccc1Cl)c1ccccc1 ZINC000113326356 1129836624 /nfs/dbraw/zinc/83/66/24/1129836624.db2.gz UTKWIDAFXNJHAB-MRXNPFEDSA-N 1 0 291.778 3.523 20 10 CHCDRO C[N@H+](Cc1ccc(F)cc1)Cc1c(O)cccc1Cl ZINC000768174278 1129839268 /nfs/dbraw/zinc/83/92/68/1129839268.db2.gz INJHLFGRMRYNDI-UHFFFAOYSA-N 1 0 279.742 3.817 20 10 CHCDRO COc1cccc(C[N@H+](C2CC2)C2CCC(C)CC2)c1O ZINC000768251942 1129847066 /nfs/dbraw/zinc/84/70/66/1129847066.db2.gz BSOZAJUCQRKYAI-UHFFFAOYSA-N 1 0 289.419 3.944 20 10 CHCDRO COc1ccc(C[N@H+](C)Cc2cc(C)cc(C)c2O)cc1 ZINC000119299824 1129847649 /nfs/dbraw/zinc/84/76/49/1129847649.db2.gz MGOMCQFQENDROF-UHFFFAOYSA-N 1 0 285.387 3.650 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CCc2cccc(C)n2)c(O)c1 ZINC000285178823 1129848408 /nfs/dbraw/zinc/84/84/08/1129848408.db2.gz NENTYUXPJFZRGO-OAHLLOKOSA-N 1 0 284.403 3.606 20 10 CHCDRO CCCC[N@H+](Cc1cc(OCC)ccc1O)C1CC1 ZINC000768292206 1129850026 /nfs/dbraw/zinc/85/00/26/1129850026.db2.gz XLTOYKZJQSOZRV-UHFFFAOYSA-N 1 0 263.381 3.555 20 10 CHCDRO COc1cc(C[N@@H+]2CC[C@@H](c3ccccc3)C2)c(O)cc1C ZINC000768439234 1129856132 /nfs/dbraw/zinc/85/61/32/1129856132.db2.gz DQBZZNGQCSZGKE-MRXNPFEDSA-N 1 0 297.398 3.699 20 10 CHCDRO COCC[C@@H]1CCCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC000768539740 1129860976 /nfs/dbraw/zinc/86/09/76/1129860976.db2.gz BROZZSDMSNSYMK-ZDUSSCGKSA-N 1 0 297.826 3.684 20 10 CHCDRO C[C@H](C1CC1)[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000768531813 1129861454 /nfs/dbraw/zinc/86/14/54/1129861454.db2.gz CXSNFAYXVOQSJN-CYBMUJFWSA-N 1 0 258.409 3.516 20 10 CHCDRO Cc1nc([C@@H](C)[NH2+]CCCSc2nccs2)cs1 ZINC000772864540 1131403348 /nfs/dbraw/zinc/40/33/48/1131403348.db2.gz LJZQCLLOXGTABK-SECBINFHSA-N 1 0 299.490 3.741 20 10 CHCDRO C[C@]12C[C@H]1CCC[C@@H]2[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000800476153 1129876054 /nfs/dbraw/zinc/87/60/54/1129876054.db2.gz IKDZYHRJJKWZEI-NEWSRXKRSA-N 1 0 284.447 3.955 20 10 CHCDRO Cc1ccc2c(NCc3ccc(O)c(O)c3)cc[nH+]c2c1 ZINC001169997056 1129877370 /nfs/dbraw/zinc/87/73/70/1129877370.db2.gz NKGFMMIPXBACNH-UHFFFAOYSA-N 1 0 280.327 3.567 20 10 CHCDRO CC(C)CCn1cccc1C[N@H+](C)Cc1ccccc1O ZINC000768873717 1129877645 /nfs/dbraw/zinc/87/76/45/1129877645.db2.gz VMOAJPQZHIMLOH-UHFFFAOYSA-N 1 0 286.419 3.872 20 10 CHCDRO Cc1cc(C)c(C[N@H+](C)Cc2ccccc2O)cc1C ZINC000768870984 1129878651 /nfs/dbraw/zinc/87/86/51/1129878651.db2.gz GJGRNURYHILKRM-UHFFFAOYSA-N 1 0 269.388 3.949 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+](Cc2ccccn2)C(C)C)c1 ZINC000768926915 1129880923 /nfs/dbraw/zinc/88/09/23/1129880923.db2.gz SNGILGHAQMHWHU-UHFFFAOYSA-N 1 0 270.376 3.506 20 10 CHCDRO C[C@H]([NH2+]CCc1cccc2[nH]ccc21)c1ccccc1O ZINC000800500544 1129881735 /nfs/dbraw/zinc/88/17/35/1129881735.db2.gz FBFSLIYQWCVPJS-ZDUSSCGKSA-N 1 0 280.371 3.767 20 10 CHCDRO C[N@H+](Cc1cc2c(cc1O)OCO2)C1CCCCCCC1 ZINC000769223719 1129895984 /nfs/dbraw/zinc/89/59/84/1129895984.db2.gz QIRMYQKYBRPUKF-UHFFFAOYSA-N 1 0 291.391 3.666 20 10 CHCDRO CN(C)c1ccc(C[NH2+]CC(C)(C)C(F)(F)F)cc1F ZINC000800888670 1129896204 /nfs/dbraw/zinc/89/62/04/1129896204.db2.gz CHHXXHMJGNBBDU-UHFFFAOYSA-N 1 0 292.320 3.570 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CCC[C@H]2C(C)(C)C)c(O)c1 ZINC000769308959 1129901025 /nfs/dbraw/zinc/90/10/25/1129901025.db2.gz DRAICISRPKBUEG-INIZCTEOSA-N 1 0 277.408 3.801 20 10 CHCDRO CCOc1cccc(C[N@@H+]2[C@H](C)C[C@H]3CCCC[C@H]32)c1O ZINC000769404050 1129906677 /nfs/dbraw/zinc/90/66/77/1129906677.db2.gz IGOVIEDRAPVRBZ-IIAWOOMASA-N 1 0 289.419 3.944 20 10 CHCDRO C[C@H]1OCC[N@H+](Cc2cc(-c3ccccc3)ccc2O)[C@@H]1C ZINC000769422002 1129907333 /nfs/dbraw/zinc/90/73/33/1129907333.db2.gz DZBTYNLANJJTIA-HUUCEWRRSA-N 1 0 297.398 3.668 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCc3cccc(F)c3[C@@H]2C)c1 ZINC000769426663 1129907985 /nfs/dbraw/zinc/90/79/85/1129907985.db2.gz VTLKCQHWOGSPOW-ZDUSSCGKSA-N 1 0 285.362 3.959 20 10 CHCDRO CCOc1cccc(C[N@@H+]2Cc3ccccc3C[C@H]2C)c1O ZINC000769483369 1129909655 /nfs/dbraw/zinc/90/96/55/1129909655.db2.gz PIGCHVSEFJJWSK-CQSZACIVSA-N 1 0 297.398 3.738 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)C2CCC2)cc1F ZINC000769447531 1129911278 /nfs/dbraw/zinc/91/12/78/1129911278.db2.gz WZNNAMPZSDTYJP-UHFFFAOYSA-N 1 0 264.388 3.656 20 10 CHCDRO CC(C)[N@H+](Cc1cc(Br)ccc1O)C1CCC1 ZINC000769471593 1129912839 /nfs/dbraw/zinc/91/28/39/1129912839.db2.gz WEFFNZDDQXHIMT-UHFFFAOYSA-N 1 0 298.224 3.918 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)CCc2cccs2)cc1F ZINC000769500296 1129914188 /nfs/dbraw/zinc/91/41/88/1129914188.db2.gz USPBPNTZMFQBNM-UHFFFAOYSA-N 1 0 292.423 3.628 20 10 CHCDRO COc1cccc(O)c1C[N@@H+]1CC[C@@H](c2ccccc2)[C@@H]1C ZINC000769498648 1129914258 /nfs/dbraw/zinc/91/42/58/1129914258.db2.gz NTUSHKQWBQQRHK-GOEBONIOSA-N 1 0 297.398 3.779 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CC[C@H]2Cc2ccccc2)c1 ZINC000769505691 1129914726 /nfs/dbraw/zinc/91/47/26/1129914726.db2.gz HMZIWMPEPWRLOW-KRWDZBQOSA-N 1 0 297.398 3.608 20 10 CHCDRO COc1cccc(O)c1C[N@@H+]1CCC[C@@H]1CCC(C)C ZINC000769538152 1129916196 /nfs/dbraw/zinc/91/61/96/1129916196.db2.gz TYBCWLBAQLQHTD-CQSZACIVSA-N 1 0 277.408 3.801 20 10 CHCDRO COc1cccc(O)c1C[N@@H+]1CCC[C@H]1CCC(C)C ZINC000769538151 1129916604 /nfs/dbraw/zinc/91/66/04/1129916604.db2.gz TYBCWLBAQLQHTD-AWEZNQCLSA-N 1 0 277.408 3.801 20 10 CHCDRO CCSCC[C@@H](C)[N@H+](C)Cc1cc(C)c(C)cc1O ZINC000769547225 1129917080 /nfs/dbraw/zinc/91/70/80/1129917080.db2.gz BPXAKRCGERJBKD-CQSZACIVSA-N 1 0 281.465 3.973 20 10 CHCDRO CCCC[N@H+](Cc1csc(C)n1)Cc1ccccc1O ZINC000801597775 1129931533 /nfs/dbraw/zinc/93/15/33/1129931533.db2.gz OKNYGDZPRNQBRQ-UHFFFAOYSA-N 1 0 290.432 3.959 20 10 CHCDRO CCc1cccc(C[NH2+]C(C)(C)c2ccccc2)c1O ZINC000691480670 1129945207 /nfs/dbraw/zinc/94/52/07/1129945207.db2.gz KAFGPRSIPCZXAK-UHFFFAOYSA-N 1 0 269.388 3.980 20 10 CHCDRO COc1ccc(C[C@@H](C)C[N@H+](C)Cc2ccccc2O)cc1 ZINC000770505244 1129947921 /nfs/dbraw/zinc/94/79/21/1129947921.db2.gz KZHDLDSSFRLPOZ-OAHLLOKOSA-N 1 0 299.414 3.711 20 10 CHCDRO C[N@H+](Cc1cc2ccccc2[nH]1)Cc1ccccc1O ZINC000770506109 1129948407 /nfs/dbraw/zinc/94/84/07/1129948407.db2.gz SKEOHMFYFUKVHH-UHFFFAOYSA-N 1 0 266.344 3.506 20 10 CHCDRO Cc1ccc(C[C@@H]2CCC[N@@H+]2Cc2ccccc2O)cc1 ZINC000770509479 1129948745 /nfs/dbraw/zinc/94/87/45/1129948745.db2.gz AESDQDZTFVJWJS-SFHVURJKSA-N 1 0 281.399 3.908 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCCC2(CCCCC2)C1 ZINC000770509480 1129948775 /nfs/dbraw/zinc/94/87/75/1129948775.db2.gz AIVHNIIWIMJLSJ-UHFFFAOYSA-N 1 0 259.393 3.939 20 10 CHCDRO Cc1ccncc1[C@H](C)[NH2+]Cc1cc(Cl)ccc1O ZINC000770747708 1129958425 /nfs/dbraw/zinc/95/84/25/1129958425.db2.gz CKCYFHJXLPFIFF-NSHDSACASA-N 1 0 276.767 3.600 20 10 CHCDRO CCCC[N@H+](CCCC(=O)CC)Cc1ccccc1O ZINC000829516067 1131423026 /nfs/dbraw/zinc/42/30/26/1131423026.db2.gz OOMFLJCYHTZVIZ-UHFFFAOYSA-N 1 0 277.408 3.754 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)Cc2cccc3cc[nH]c32)cc1 ZINC000771935140 1129996983 /nfs/dbraw/zinc/99/69/83/1129996983.db2.gz KDEWRRMIVZBOEK-UHFFFAOYSA-N 1 0 293.414 3.866 20 10 CHCDRO Cc1cc(O)c(C[NH2+]Cc2cccc3cc[nH]c32)cc1C ZINC000786160810 1130080950 /nfs/dbraw/zinc/08/09/50/1130080950.db2.gz LOQUKWUVNVRTEB-UHFFFAOYSA-N 1 0 280.371 3.780 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2cnn(CC3CCC3)c2)c(O)c1 ZINC000903239390 1130134126 /nfs/dbraw/zinc/13/41/26/1130134126.db2.gz DFJXYNLEMXOBLL-CQSZACIVSA-N 1 0 299.418 3.548 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CC[C@H](C3CC3)O2)c(O)c1C ZINC000903250691 1130137057 /nfs/dbraw/zinc/13/70/57/1130137057.db2.gz CHDQPUMPHWUBFQ-JLJPHGGASA-N 1 0 289.419 3.617 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2cncs2)c(O)c1C ZINC000903309947 1130151092 /nfs/dbraw/zinc/15/10/92/1130151092.db2.gz HNIHGTNVKLSOBR-RYUDHWBXSA-N 1 0 276.405 3.877 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](c1ncccn1)C1CC1)c1ccc(C)cc1O ZINC000903321657 1130154326 /nfs/dbraw/zinc/15/43/26/1130154326.db2.gz BVTZBPPWDQHXRP-NVXWUHKLSA-N 1 0 297.402 3.683 20 10 CHCDRO C[C@@H]([NH2+][C@H](c1ccccn1)C1CC1)c1cc(F)ccc1O ZINC000903335406 1130160504 /nfs/dbraw/zinc/16/05/04/1130160504.db2.gz OTKCLGUPCIYOIV-DIFFPNOSSA-N 1 0 286.350 3.728 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]CC[C@H]1CCC(F)(F)C1)CC2 ZINC000903339764 1130162682 /nfs/dbraw/zinc/16/26/82/1130162682.db2.gz CWZILQKZPLDUNX-YPMHNXCESA-N 1 0 281.346 3.795 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCOC12CCCC2)c1ccc(N(C)C)cc1 ZINC000903382432 1130168514 /nfs/dbraw/zinc/16/85/14/1130168514.db2.gz GYIFUYFQKWKVBJ-RHSMWYFYSA-N 1 0 288.435 3.505 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1cnn(CC2CCC2)c1)c1ccccc1O ZINC000903403630 1130171102 /nfs/dbraw/zinc/17/11/02/1130171102.db2.gz DJDDPKZESQFBKW-UONOGXRCSA-N 1 0 299.418 3.801 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H](c2ccncc2)C2CC2)c1 ZINC000903426598 1130175068 /nfs/dbraw/zinc/17/50/68/1130175068.db2.gz BFGLPWIPXSUZPR-ACJLOTCBSA-N 1 0 282.387 3.898 20 10 CHCDRO C[C@H]([NH2+][C@H]1COC[C@@H]1C1CC1)c1ccc2ccccc2c1O ZINC000903438836 1130176888 /nfs/dbraw/zinc/17/68/88/1130176888.db2.gz XPEDSEDGSCOSGK-RZAIGCCYSA-N 1 0 297.398 3.621 20 10 CHCDRO CN(C)c1cc(F)c(C[N@@H+]2CCCC(C)(C)C2)cc1F ZINC001462095128 1130191463 /nfs/dbraw/zinc/19/14/63/1130191463.db2.gz RJPCYABWVKMDNF-UHFFFAOYSA-N 1 0 282.378 3.653 20 10 CHCDRO CCC(O)(CC)CC[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000788779589 1130211427 /nfs/dbraw/zinc/21/14/27/1130211427.db2.gz XIFIHYRTSVVIFG-AWEZNQCLSA-N 1 0 279.424 3.601 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H]2CCC23CCCC3)cc1F ZINC000788989925 1130223001 /nfs/dbraw/zinc/22/30/01/1130223001.db2.gz YCQOOVDPXKVQNH-INIZCTEOSA-N 1 0 276.399 3.704 20 10 CHCDRO C[C@H](CC[N@H+](C)Cc1ccccc1O)OCc1ccccc1 ZINC000789348823 1130242829 /nfs/dbraw/zinc/24/28/29/1130242829.db2.gz REVBUVQUWVBABC-MRXNPFEDSA-N 1 0 299.414 3.819 20 10 CHCDRO Cc1cccc(C[NH2+][C@H](C(C)C)[C@@H](O)c2ccccc2)c1O ZINC000789779938 1130276493 /nfs/dbraw/zinc/27/64/93/1130276493.db2.gz RYLXDUQUQUBRTC-MJGOQNOKSA-N 1 0 299.414 3.548 20 10 CHCDRO Cc1cccc(C[NH2+][C@H](C(C)C)[C@H](O)c2ccccc2)c1O ZINC000789779937 1130276642 /nfs/dbraw/zinc/27/66/42/1130276642.db2.gz RYLXDUQUQUBRTC-IEBWSBKVSA-N 1 0 299.414 3.548 20 10 CHCDRO Cc1ccc(O)c(C[NH+]2CCC(c3ccco3)CC2)c1 ZINC000826877131 1130304709 /nfs/dbraw/zinc/30/47/09/1130304709.db2.gz ALOTUQLOMBDSQW-UHFFFAOYSA-N 1 0 271.360 3.673 20 10 CHCDRO CCC1([NH2+]Cc2c([O-])ccc(Cl)c2F)CCC1 ZINC000790974438 1130344040 /nfs/dbraw/zinc/34/40/40/1130344040.db2.gz VQHHXRMEMBUPBB-UHFFFAOYSA-N 1 0 257.736 3.607 20 10 CHCDRO Cn1ccc2ccc(-c3cncc(C[NH+]4CCCC4)c3)cc21 ZINC001240576063 1130368882 /nfs/dbraw/zinc/36/88/82/1130368882.db2.gz LWGQWGIUNFBNHE-UHFFFAOYSA-N 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CC[C@H](C)[C@@H](C)Oc1ccc(N2CC[NH+](CC)CC2)cc1 ZINC001234658210 1130669343 /nfs/dbraw/zinc/66/93/43/1130669343.db2.gz XOQPXDNRAUHMBL-JKSUJKDBSA-N 1 0 290.451 3.642 20 10 CHCDRO Oc1ccc(-c2ccccc2)cc1C[N@@H+]1CCCSCC1 ZINC000780892206 1130694641 /nfs/dbraw/zinc/69/46/41/1130694641.db2.gz CNLTZVOFSRZNDC-UHFFFAOYSA-N 1 0 299.439 3.998 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CCCCF)cc1 ZINC000812737348 1130710292 /nfs/dbraw/zinc/71/02/92/1130710292.db2.gz URZXHSRUDFAWNV-ZDUSSCGKSA-N 1 0 252.377 3.543 20 10 CHCDRO CCc1cccc(C[N@H+](CC)Cc2ccc(N(C)C)cc2)n1 ZINC001235268164 1130731140 /nfs/dbraw/zinc/73/11/40/1130731140.db2.gz VFHJIGVPJBUYIS-UHFFFAOYSA-N 1 0 297.446 3.732 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)c1cncc(F)c1)c1ccc(N(C)C)cc1 ZINC000781920964 1130748157 /nfs/dbraw/zinc/74/81/57/1130748157.db2.gz CENQSVDCSQERJN-STQMWFEESA-N 1 0 287.382 3.699 20 10 CHCDRO CC(C)[C@H]1C[N@H+](Cc2ccc(C(C)(C)C)cc2O)CCO1 ZINC001235677079 1130766111 /nfs/dbraw/zinc/76/61/11/1130766111.db2.gz 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1130832596 /nfs/dbraw/zinc/83/25/96/1130832596.db2.gz MNPIGHDDIWBXAY-SMDDNHRTSA-N 1 0 271.385 3.890 20 10 CHCDRO C[C@H]([NH2+][C@@H]1COc2ccc(Cl)cc21)c1ccccc1O ZINC000783518827 1130833632 /nfs/dbraw/zinc/83/36/32/1130833632.db2.gz PBJKIDLPSJJQCH-IINYFYTJSA-N 1 0 289.762 3.830 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)C(C)(C)COC)cc1F ZINC000814178318 1130835675 /nfs/dbraw/zinc/83/56/75/1130835675.db2.gz LOFXPMZIJMLDGR-UHFFFAOYSA-N 1 0 296.430 3.529 20 10 CHCDRO CCOc1cccc(C[N@@H+]2C[C@H](C)[C@@H]3CCCC[C@@H]32)c1O ZINC000783593520 1130841405 /nfs/dbraw/zinc/84/14/05/1130841405.db2.gz VMVGAXRORYYONF-BPUTZDHNSA-N 1 0 289.419 3.801 20 10 CHCDRO CCOc1cccc(C[N@@H+]2C[C@H](C)[C@@H]3CCCC[C@H]32)c1O ZINC000783593521 1130841710 /nfs/dbraw/zinc/84/17/10/1130841710.db2.gz VMVGAXRORYYONF-CWRNSKLLSA-N 1 0 289.419 3.801 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@H+](C)C[C@H]2CC=CCC2)c1 ZINC000784015876 1130868670 /nfs/dbraw/zinc/86/86/70/1130868670.db2.gz RXZXPGUKHQOTQZ-HNNXBMFYSA-N 1 0 259.393 3.797 20 10 CHCDRO 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CCc1ccc(C[N@H+](C)Cc2ccc(C)cc2)c(O)c1 ZINC001236790339 1131007367 /nfs/dbraw/zinc/00/73/67/1131007367.db2.gz WDLQICBCYXVVAN-UHFFFAOYSA-N 1 0 269.388 3.895 20 10 CHCDRO CCc1ccc(C[N@@H+]2CCC[C@H]2c2ccccn2)c(O)c1 ZINC001236790838 1131007427 /nfs/dbraw/zinc/00/74/27/1131007427.db2.gz YJITVLGDBYTUPO-KRWDZBQOSA-N 1 0 282.387 3.687 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CCCCC[C@H]2C)c(Cl)c1 ZINC001236797720 1131008248 /nfs/dbraw/zinc/00/82/48/1131008248.db2.gz AIXCYRHFTRZFFB-LLVKDONJSA-N 1 0 283.799 3.819 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H](O)C2CCCCC2)c(O)c1 ZINC000815575482 1131008394 /nfs/dbraw/zinc/00/83/94/1131008394.db2.gz SRYUWYNOONARMM-WMLDXEAASA-N 1 0 291.435 3.601 20 10 CHCDRO CC1CC([N@H+](C)Cc2cc(Cl)c(Cl)cc2[O-])C1 ZINC001236794998 1131008841 /nfs/dbraw/zinc/00/88/41/1131008841.db2.gz ZGKUPCQBNHUKOU-UHFFFAOYSA-N 1 0 274.191 3.929 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+][C@H]2CC23CCCC3)c(O)c1 ZINC000815620706 1131009947 /nfs/dbraw/zinc/00/99/47/1131009947.db2.gz 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CC[C@H]1C[N@H+](Cc2ccc(N(CC)CC)cc2)CCCO1 ZINC000798964657 1131066784 /nfs/dbraw/zinc/06/67/84/1131066784.db2.gz OPRDJPSXWZIDHQ-SFHVURJKSA-N 1 0 290.451 3.534 20 10 CHCDRO C[C@H]1c2cccn2CC[N@H+]1Cc1ccc2ccccc2c1O ZINC000816481362 1131096878 /nfs/dbraw/zinc/09/68/78/1131096878.db2.gz RZLGZXWHDJQJLN-AWEZNQCLSA-N 1 0 292.382 3.924 20 10 CHCDRO C[C@H]1CCC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816480622 1131098353 /nfs/dbraw/zinc/09/83/53/1131098353.db2.gz RZOHVBXZKQNBGQ-ZDUSSCGKSA-N 1 0 255.361 3.777 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2ccc3ccccc3c2O)CC(C)(C)O1 ZINC000816496354 1131100999 /nfs/dbraw/zinc/10/09/99/1131100999.db2.gz GPXVXTFAQCPXIY-CYBMUJFWSA-N 1 0 285.387 3.545 20 10 CHCDRO C[N@H+](CCc1nccs1)Cc1ccc2ccccc2c1O ZINC000816519700 1131101309 /nfs/dbraw/zinc/10/13/09/1131101309.db2.gz RRZRQBQAUKMGDV-UHFFFAOYSA-N 1 0 298.411 3.676 20 10 CHCDRO CSCC[C@H](C)[N@H+](C)Cc1cc(Cl)c(F)cc1[O-] ZINC000816514244 1131103114 /nfs/dbraw/zinc/10/31/14/1131103114.db2.gz QYXFWYPGSAECJT-VIFPVBQESA-N 1 0 291.819 3.758 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+]1CCC(F)(F)C(C)(C)C1 ZINC001237485778 1131103377 /nfs/dbraw/zinc/10/33/77/1131103377.db2.gz SJRIWKQRMKXIRT-UHFFFAOYSA-N 1 0 269.335 3.568 20 10 CHCDRO COc1ccccc1C[C@@H](C)[N@H+](C)Cc1c(C)cccc1O ZINC001237492115 1131104243 /nfs/dbraw/zinc/10/42/43/1131104243.db2.gz OJMUWRSLEHTHIP-OAHLLOKOSA-N 1 0 299.414 3.772 20 10 CHCDRO Cc1ccc([C@H]2CCC[N@@H+]2Cc2c(C)cccc2O)cn1 ZINC001237492551 1131104399 /nfs/dbraw/zinc/10/43/99/1131104399.db2.gz SFSCDCJUVIFVRQ-QGZVFWFLSA-N 1 0 282.387 3.741 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+](CC(=O)c1ccccc1)C(C)C ZINC001237488118 1131104893 /nfs/dbraw/zinc/10/48/93/1131104893.db2.gz RHMNZQJBBYFFBR-UHFFFAOYSA-N 1 0 297.398 3.794 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2ccc3ccccc3c2O)cn1 ZINC000816536231 1131105270 /nfs/dbraw/zinc/10/52/70/1131105270.db2.gz PELZTTRXNRPDHL-UHFFFAOYSA-N 1 0 278.355 3.539 20 10 CHCDRO CO[C@H]1CCCC[C@@H]1[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000799728888 1131106149 /nfs/dbraw/zinc/10/61/49/1131106149.db2.gz GFOPLWHWELVLNN-DGFSRKRXSA-N 1 0 283.799 3.654 20 10 CHCDRO CC(C)[C@H](C)C[NH2+]Cc1ccc2ccccc2c1O ZINC000816552255 1131107097 /nfs/dbraw/zinc/10/70/97/1131107097.db2.gz GLLWNPRJJSERBX-CYBMUJFWSA-N 1 0 257.377 3.927 20 10 CHCDRO Oc1c(C[NH2+]Cc2ccsc2)ccc2ccccc21 ZINC000816528354 1131108514 /nfs/dbraw/zinc/10/85/14/1131108514.db2.gz YKEHIOIATKDRKN-UHFFFAOYSA-N 1 0 269.369 3.897 20 10 CHCDRO CS[C@H]1CC[C@@H]([NH2+]Cc2ccc3ccccc3c2O)C1 ZINC000816554770 1131109962 /nfs/dbraw/zinc/10/99/62/1131109962.db2.gz IRVDMRNTNSRQAC-CABCVRRESA-N 1 0 287.428 3.919 20 10 CHCDRO CO[C@@H](C[NH2+]Cc1ccc2ccccc2c1O)C(C)(C)C ZINC000816553798 1131110277 /nfs/dbraw/zinc/11/02/77/1131110277.db2.gz HHEFMPSFGLVRID-INIZCTEOSA-N 1 0 287.403 3.696 20 10 CHCDRO Cc1cnccc1CC[NH2+]Cc1ccc2ccccc2c1O ZINC000816558917 1131111805 /nfs/dbraw/zinc/11/18/05/1131111805.db2.gz QKBLQOSLAZHCFY-UHFFFAOYSA-N 1 0 292.382 3.581 20 10 CHCDRO Oc1c(C[NH2+][C@H]2CCO[C@@H](C3CC3)C2)ccc2ccccc21 ZINC000816570129 1131113271 /nfs/dbraw/zinc/11/32/71/1131113271.db2.gz JSWFFEBIFZIVDJ-FUHWJXTLSA-N 1 0 297.398 3.593 20 10 CHCDRO CC[C@@H]1C[N@H+](Cc2ccc3ccccc3c2O)CCCO1 ZINC000816599233 1131114424 /nfs/dbraw/zinc/11/44/24/1131114424.db2.gz GUXLHACVYUOXPE-MRXNPFEDSA-N 1 0 285.387 3.546 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CCC[C@@H](c3ccccc3)C2)c1 ZINC000816619567 1131115274 /nfs/dbraw/zinc/11/52/74/1131115274.db2.gz MKTCYSHNHIMOQU-MRXNPFEDSA-N 1 0 297.398 3.780 20 10 CHCDRO CCCC[N@H+](CCCO)Cc1ccc2ccccc2c1O ZINC000816611129 1131116103 /nfs/dbraw/zinc/11/61/03/1131116103.db2.gz INCRHIWWYBBASE-UHFFFAOYSA-N 1 0 287.403 3.530 20 10 CHCDRO CCC[C@@H]1CCCC[N@@H+]1Cc1cc(OC)cc(OC)c1O ZINC001237675201 1131126347 /nfs/dbraw/zinc/12/63/47/1131126347.db2.gz BNTCXBUJMSRHNR-CQSZACIVSA-N 1 0 293.407 3.564 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCCC2(C)C)cc1Br ZINC001237677352 1131126812 /nfs/dbraw/zinc/12/68/12/1131126812.db2.gz MKKSQQMTJDRZNJ-UHFFFAOYSA-N 1 0 298.224 3.838 20 10 CHCDRO Cc1cc(Cl)cc(C[NH+]2CC3(C2)CCCC3)c1O ZINC001237681310 1131126868 /nfs/dbraw/zinc/12/68/68/1131126868.db2.gz MZDAOXMTONBSAI-UHFFFAOYSA-N 1 0 265.784 3.730 20 10 CHCDRO CC[N@H+](Cc1cc(Br)c(C)cc1O)C(C)C ZINC001237677854 1131126949 /nfs/dbraw/zinc/12/69/49/1131126949.db2.gz QLOJEKJNNOBBFW-UHFFFAOYSA-N 1 0 286.213 3.693 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](C)CC(C)C)cc1Br ZINC001237678259 1131127480 /nfs/dbraw/zinc/12/74/80/1131127480.db2.gz XFMUOWPEUHTDRV-UHFFFAOYSA-N 1 0 286.213 3.551 20 10 CHCDRO [O-]c1c(Cl)cc(F)cc1C[N@@H+]1CCC12CCCC2 ZINC001237807496 1131142586 /nfs/dbraw/zinc/14/25/86/1131142586.db2.gz KKTNOHKISLEHJQ-UHFFFAOYSA-N 1 0 269.747 3.703 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2cc(F)cc(Cl)c2[O-])C2(CC2)C1 ZINC001237807221 1131142714 /nfs/dbraw/zinc/14/27/14/1131142714.db2.gz ZICLBXMEPGYRPJ-VIFPVBQESA-N 1 0 269.747 3.559 20 10 CHCDRO CCCN(Cc1ccc(N2CCCC2)cc1)CC(F)F ZINC001116443421 1131146843 /nfs/dbraw/zinc/14/68/43/1131146843.db2.gz UHVFUJLEBAPLLT-UHFFFAOYSA-N 1 0 282.378 3.764 20 10 CHCDRO Cc1cc(F)cc(C[N@@H+]2CCC[C@@](C)(F)CC2)c1O ZINC001238058202 1131164861 /nfs/dbraw/zinc/16/48/61/1131164861.db2.gz PHDSAZZHLTUDGB-OAHLLOKOSA-N 1 0 269.335 3.554 20 10 CHCDRO Cc1cc(F)cc(C[N@@H+](C)C2CCCCC2)c1O ZINC001238055734 1131165300 /nfs/dbraw/zinc/16/53/00/1131165300.db2.gz CRYWVIRKRIGGIY-UHFFFAOYSA-N 1 0 251.345 3.604 20 10 CHCDRO Cc1cc(F)cc(C[N@@H+]2CCc3ccc(F)cc3C2)c1O ZINC001238070813 1131167770 /nfs/dbraw/zinc/16/77/70/1131167770.db2.gz PMBZCRRDEYZDOO-UHFFFAOYSA-N 1 0 289.325 3.537 20 10 CHCDRO CO[C@H]1CCCC[C@@H]1[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001116925144 1131170340 /nfs/dbraw/zinc/17/03/40/1131170340.db2.gz MIFZBAZGBKFMTC-HOSILWTGSA-N 1 0 289.419 3.796 20 10 CHCDRO CC[C@@H]1C[C@@H]([NH2+][C@@H](C)c2ccc(C)c(C)c2O)CCO1 ZINC000817587634 1131174321 /nfs/dbraw/zinc/17/43/21/1131174321.db2.gz ZRKRSYBMMVGTEF-SOUVJXGZSA-N 1 0 277.408 3.617 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CCO[C@H](CC)C1)c1ccc(N(C)C)cc1 ZINC000817585734 1131174434 /nfs/dbraw/zinc/17/44/34/1131174434.db2.gz HKLDCWFRRUNCGM-KBAYOESNSA-N 1 0 290.451 3.751 20 10 CHCDRO Cc1cc(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)cc(C)n1 ZINC000817590110 1131175284 /nfs/dbraw/zinc/17/52/84/1131175284.db2.gz SZZFSMKRNOGJIP-HNNXBMFYSA-N 1 0 284.403 3.872 20 10 CHCDRO CC[C@H]([NH2+]CC1([NH3+])CCCCC1)c1cccc(Cl)c1[O-] ZINC000817938602 1131188180 /nfs/dbraw/zinc/18/81/80/1131188180.db2.gz OFWGSEAZXOXIJD-AWEZNQCLSA-N 1 0 296.842 3.748 20 10 CHCDRO C[C@H](CCC(C)(C)C)[NH2+]C[C@H](N)c1ccc(N(C)C)cc1 ZINC000817943899 1131188268 /nfs/dbraw/zinc/18/82/68/1131188268.db2.gz WMASLHBETVJXLO-PBHICJAKSA-N 1 0 291.483 3.557 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCc2ccc(N)cc2)c(C)c1 ZINC000817955500 1131190433 /nfs/dbraw/zinc/19/04/33/1131190433.db2.gz CKPINISSSIUVFI-OAHLLOKOSA-N 1 0 268.404 3.779 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccc(N)cc1)[C@H]1CCCC[C@H]1C ZINC000817957820 1131191254 /nfs/dbraw/zinc/19/12/54/1131191254.db2.gz PIEYGWXOWVJBPK-CPUCHLNUSA-N 1 0 260.425 3.616 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccc(N)cc1)c1ccc(C)cc1O ZINC000817958856 1131191380 /nfs/dbraw/zinc/19/13/80/1131191380.db2.gz ZXGZDQFQGFTMAI-KRWDZBQOSA-N 1 0 284.403 3.566 20 10 CHCDRO CC1(C)Cc2occc2[C@@H]([NH2+]CCc2ccc(N)cc2)C1 ZINC000817956455 1131191496 /nfs/dbraw/zinc/19/14/96/1131191496.db2.gz ZKWJXSHEEJPXDQ-INIZCTEOSA-N 1 0 284.403 3.708 20 10 CHCDRO COc1cc(C)c([C@H](C)[NH2+]CCc2ccc(N)cc2)cc1C ZINC000817958177 1131191681 /nfs/dbraw/zinc/19/16/81/1131191681.db2.gz SRLDBNSCRPRDDU-HNNXBMFYSA-N 1 0 298.430 3.788 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C)[C@H](O)C(C)C ZINC001117945673 1131205721 /nfs/dbraw/zinc/20/57/21/1131205721.db2.gz VRQDSGARLKINCJ-KYZVSKTDSA-N 1 0 291.435 3.634 20 10 CHCDRO CCC(CC)C[NH2+]C[C@H]1CCN(c2ccc(OC)cc2)C1 ZINC000818219404 1131206058 /nfs/dbraw/zinc/20/60/58/1131206058.db2.gz FCRCPEOQBZGEGA-MRXNPFEDSA-N 1 0 290.451 3.547 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CC12CC2)c1cc(Cl)ccc1O ZINC000818356923 1131211452 /nfs/dbraw/zinc/21/14/52/1131211452.db2.gz SPXYNVMWOQKRDY-AAEUAGOBSA-N 1 0 251.757 3.639 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CC[C@@H](c3cccnc3)C2)cc1 ZINC000829522484 1131423071 /nfs/dbraw/zinc/42/30/71/1131423071.db2.gz JOSBONHCGNKALK-GOSISDBHSA-N 1 0 295.430 3.527 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H](C)Cc1ccoc1 ZINC000824291750 1131461418 /nfs/dbraw/zinc/46/14/18/1131461418.db2.gz HAEBETQXFAGOQS-AWEZNQCLSA-N 1 0 272.392 3.586 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](Cc1ccccc1)OC)c1ccccc1O ZINC000824590755 1131476735 /nfs/dbraw/zinc/47/67/35/1131476735.db2.gz PJDMMTMOMWCRHD-AEFFLSMTSA-N 1 0 299.414 3.691 20 10 CHCDRO C[C@@H](CCCCO)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000824653452 1131478361 /nfs/dbraw/zinc/47/83/61/1131478361.db2.gz BJEIBVGHLWKWET-HNNXBMFYSA-N 1 0 299.414 3.700 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@]2(C)CC2(Cl)Cl)cc1C ZINC000824765918 1131482385 /nfs/dbraw/zinc/48/23/85/1131482385.db2.gz RHSASBWWLRMOLA-ZDUSSCGKSA-N 1 0 288.218 3.683 20 10 CHCDRO Cc1c(C[N@H+](C)Cc2cncs2)c2ccccc2n1C ZINC001138259975 1131483186 /nfs/dbraw/zinc/48/31/86/1131483186.db2.gz UAICVDIIYSQWSB-UHFFFAOYSA-N 1 0 285.416 3.575 20 10 CHCDRO Cc1c(C[NH+]2CCC(C(F)F)CC2)c2ccccc2n1C ZINC001138258334 1131483316 /nfs/dbraw/zinc/48/33/16/1131483316.db2.gz QLSRCISBVVAYFK-UHFFFAOYSA-N 1 0 292.373 3.964 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCO[C@H](C(C)C)C1)c1ccccc1O ZINC000824798825 1131484667 /nfs/dbraw/zinc/48/46/67/1131484667.db2.gz GRYVLRAUADSDTG-HFTRVMKXSA-N 1 0 291.435 3.884 20 10 CHCDRO CO[C@@H]1CCC[C@H]1[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000824903387 1131487697 /nfs/dbraw/zinc/48/76/97/1131487697.db2.gz FWEBXYUNSYPSPW-IEBWSBKVSA-N 1 0 297.398 3.716 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2ccc3c(c2)CCCN3C)CCC1(F)F ZINC001138354472 1131493844 /nfs/dbraw/zinc/49/38/44/1131493844.db2.gz LBLOURMGAJOALT-CYBMUJFWSA-N 1 0 294.389 3.546 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CC3(CCC3)[C@@H]2c2ccco2)c1 ZINC000825104528 1131495539 /nfs/dbraw/zinc/49/55/39/1131495539.db2.gz ZKMQXUVEDRRGOY-KRWDZBQOSA-N 1 0 299.370 3.721 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCCC[C@@H]2C)c(OC)c1 ZINC001138387787 1131496764 /nfs/dbraw/zinc/49/67/64/1131496764.db2.gz LGNUQCRVAICUNB-HNNXBMFYSA-N 1 0 290.451 3.916 20 10 CHCDRO CC[C@@H]1CC[N@H+](Cc2ccc(N(CC)CC)cc2OC)C1 ZINC001138391948 1131498581 /nfs/dbraw/zinc/49/85/81/1131498581.db2.gz KGEBADYZKZCUIA-OAHLLOKOSA-N 1 0 290.451 3.773 20 10 CHCDRO CCc1ncc(C[NH2+]Cc2ccc(N3CCCCC3)cc2)o1 ZINC000825079406 1131499115 /nfs/dbraw/zinc/49/91/15/1131499115.db2.gz RVJTYQQPSHQLHU-UHFFFAOYSA-N 1 0 299.418 3.517 20 10 CHCDRO Cc1c2cc(F)ccc2[nH]c1C[N@@H+](C)Cc1ccccc1O ZINC001138414268 1131501170 /nfs/dbraw/zinc/50/11/70/1131501170.db2.gz UUXGAIHATBEBAQ-UHFFFAOYSA-N 1 0 298.361 3.953 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@]2(CCSC2)C1 ZINC000825214927 1131502662 /nfs/dbraw/zinc/50/26/62/1131502662.db2.gz BFBPCGLVCMWBSN-HNNXBMFYSA-N 1 0 297.851 3.765 20 10 CHCDRO CC[C@H]([NH2+]CC(C)(C)C1(O)CCCC1)c1ccccc1O ZINC000825240628 1131503287 /nfs/dbraw/zinc/50/32/87/1131503287.db2.gz OTTOCHIZTJYUPN-HNNXBMFYSA-N 1 0 291.435 3.764 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CCNc2ccccc2)cc1Cl ZINC000825326992 1131506623 /nfs/dbraw/zinc/50/66/23/1131506623.db2.gz UEKKTYLJZVBYCW-UHFFFAOYSA-N 1 0 290.794 3.556 20 10 CHCDRO C[C@H]([NH2+]CC[C@H]1CCc2ccccc2N1)c1ccccc1O ZINC000844924559 1131608105 /nfs/dbraw/zinc/60/81/05/1131608105.db2.gz LXAIIQXBMWQGMY-GOEBONIOSA-N 1 0 296.414 3.860 20 10 CHCDRO Cc1cc(C[NH+]2CC3(C2)CCCCC3)ccc1N(C)C ZINC001139673176 1131627638 /nfs/dbraw/zinc/62/76/38/1131627638.db2.gz BKCXCTAGDWUUBW-UHFFFAOYSA-N 1 0 272.436 3.827 20 10 CHCDRO Cc1cc(C[N@@H+]2CCc3c(F)cccc3C2)ccc1N(C)C ZINC001139673958 1131628087 /nfs/dbraw/zinc/62/80/87/1131628087.db2.gz OFEFLSNDUTXGLR-UHFFFAOYSA-N 1 0 298.405 3.758 20 10 CHCDRO Oc1ccc(F)cc1C[NH+]1CCC2(CC[C@H](F)C2)CC1 ZINC001140059214 1131659938 /nfs/dbraw/zinc/65/99/38/1131659938.db2.gz ZOXFBZNUCSKTHW-AWEZNQCLSA-N 1 0 281.346 3.636 20 10 CHCDRO C[N@H+](CCc1ccccc1Cl)Cc1cc(F)ccc1O ZINC001140055162 1131660266 /nfs/dbraw/zinc/66/02/66/1131660266.db2.gz MOOOMODFHBNOSA-UHFFFAOYSA-N 1 0 293.769 3.859 20 10 CHCDRO COc1ccc(O)c(C[NH2+]Cc2ccc(C)cc2Cl)c1 ZINC000845935861 1131671801 /nfs/dbraw/zinc/67/18/01/1131671801.db2.gz CAWOVFVHFQDFNV-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCC[C@@H]2c2ccccn2)c1O ZINC001140179503 1131672949 /nfs/dbraw/zinc/67/29/49/1131672949.db2.gz LEEVTNQHLDLRJD-QGZVFWFLSA-N 1 0 282.387 3.741 20 10 CHCDRO Cc1ccc(C)c(C[N@H+](C)Cc2ccc(F)cc2)c1O ZINC001140178148 1131673596 /nfs/dbraw/zinc/67/35/96/1131673596.db2.gz APANZTGNDSRPJN-UHFFFAOYSA-N 1 0 273.351 3.780 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CCC23CCCC3)c1O ZINC000846000538 1131677052 /nfs/dbraw/zinc/67/70/52/1131677052.db2.gz SNWHPTKRNCLAED-UHFFFAOYSA-N 1 0 281.783 3.573 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]CC[C@]1(C)C[C@]1(F)Cl ZINC000846030127 1131680059 /nfs/dbraw/zinc/68/00/59/1131680059.db2.gz QDXDEXVPUNKHFG-HZPDHXFCSA-N 1 0 298.833 3.855 20 10 CHCDRO CSc1ccc(C[NH2+][C@H]2CCc3cccc(O)c32)cc1 ZINC000834530114 1131681829 /nfs/dbraw/zinc/68/18/29/1131681829.db2.gz BXDQGMYOABMHNA-HNNXBMFYSA-N 1 0 285.412 3.891 20 10 CHCDRO C[C@@H](Cc1ccccc1F)[NH2+][C@H]1CCc2cccc(O)c21 ZINC000834526336 1131682059 /nfs/dbraw/zinc/68/20/59/1131682059.db2.gz GYKOGXZEJWQVAM-LRDDRELGSA-N 1 0 285.362 3.739 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]CCC[C@@H]1CC1(Cl)Cl ZINC000846110831 1131687277 /nfs/dbraw/zinc/68/72/77/1131687277.db2.gz OLWAGNULIMAAFN-SNVBAGLBSA-N 1 0 292.181 3.595 20 10 CHCDRO CC(C)c1csc(C[NH2+][C@H]2CCc3cccc(O)c32)n1 ZINC000834624878 1131688175 /nfs/dbraw/zinc/68/81/75/1131688175.db2.gz RDSSUCUOOPWGEJ-LBPRGKRZSA-N 1 0 288.416 3.749 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@H]1CCc3ccc(F)cc31)CC2 ZINC000834640882 1131690307 /nfs/dbraw/zinc/69/03/07/1131690307.db2.gz SAQPWIFGYPBFLC-HOTGVXAUSA-N 1 0 283.346 3.796 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000846103845 1131690568 /nfs/dbraw/zinc/69/05/68/1131690568.db2.gz ACTZHHBFJHXHIP-MRXNPFEDSA-N 1 0 294.389 3.682 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]C2CCC(F)(F)CC2)c1O ZINC000846158341 1131691922 /nfs/dbraw/zinc/69/19/22/1131691922.db2.gz WREQSFOKEIGRAR-SNVBAGLBSA-N 1 0 285.334 3.629 20 10 CHCDRO CC[C@H](C)C[C@H](C)[NH2+][C@@H](C)c1cccc(OC)c1O ZINC000846155030 1131692400 /nfs/dbraw/zinc/69/24/00/1131692400.db2.gz OTQBOJYYBBXLPP-AVGNSLFASA-N 1 0 265.397 3.876 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CCCCCSC)c1O ZINC000846165830 1131692925 /nfs/dbraw/zinc/69/29/25/1131692925.db2.gz ZKGRMRCAKPYNLF-LBPRGKRZSA-N 1 0 283.437 3.585 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H]2CCCc3occc32)c1O ZINC000846138252 1131693833 /nfs/dbraw/zinc/69/38/33/1131693833.db2.gz AGCBNDXIWOHFDT-SMDDNHRTSA-N 1 0 287.359 3.722 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CC2CCCCC2)c1O ZINC000846136238 1131693946 /nfs/dbraw/zinc/69/39/46/1131693946.db2.gz HSGSWDUPVWNTLP-GFCCVEGCSA-N 1 0 263.381 3.632 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]C[C@H](C)c2ccccc2)c1O ZINC000846138119 1131694033 /nfs/dbraw/zinc/69/40/33/1131694033.db2.gz SVLJNGBWSDTGJY-KBPBESRZSA-N 1 0 285.387 3.855 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H](C)Cc2cccs2)c1O ZINC000846139059 1131694157 /nfs/dbraw/zinc/69/41/57/1131694157.db2.gz PGPLIZCSAODSGW-NEPJUHHUSA-N 1 0 291.416 3.744 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]C[C@H](C)CC(F)(F)F)c1O ZINC000846172335 1131694181 /nfs/dbraw/zinc/69/41/81/1131694181.db2.gz LGFNNNKDFPIJRO-NXEZZACHSA-N 1 0 291.313 3.640 20 10 CHCDRO CCc1cnccc1[C@@H](C)[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000834698220 1131695142 /nfs/dbraw/zinc/69/51/42/1131695142.db2.gz WSQJRYYIHNFRAK-MLGOLLRUSA-N 1 0 282.387 3.688 20 10 CHCDRO CCc1cnccc1[C@H](C)[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000834698217 1131695203 /nfs/dbraw/zinc/69/52/03/1131695203.db2.gz WSQJRYYIHNFRAK-BLLLJJGKSA-N 1 0 282.387 3.688 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H]2C[C@H]2c2ccccc2C)c1O ZINC000846188829 1131697482 /nfs/dbraw/zinc/69/74/82/1131697482.db2.gz KADKBFATNGFIEP-RRQGHBQHSA-N 1 0 297.398 3.916 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]C1(c3ccc(F)cc3)CC1)CC2 ZINC000834722743 1131697704 /nfs/dbraw/zinc/69/77/04/1131697704.db2.gz YTZVRJQADUWPAN-OAHLLOKOSA-N 1 0 283.346 3.798 20 10 CHCDRO C[C@H]([NH2+]CC[C@@]1(C)C[C@]1(F)Cl)c1ccccc1O ZINC000846185852 1131698001 /nfs/dbraw/zinc/69/80/01/1131698001.db2.gz UDTRKNACVWEWIU-LEWSCRJBSA-N 1 0 271.763 3.748 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CCC12CCCCC2 ZINC001140337901 1131702768 /nfs/dbraw/zinc/70/27/68/1131702768.db2.gz MBEKGGWZBGRRGX-UHFFFAOYSA-N 1 0 265.784 3.954 20 10 CHCDRO CS[C@H](C[NH2+][C@H]1CCc2cccc(O)c21)C(C)(C)C ZINC000834759890 1131703464 /nfs/dbraw/zinc/70/34/64/1131703464.db2.gz GPQOGVZQIJIAGS-GXTWGEPZSA-N 1 0 279.449 3.747 20 10 CHCDRO C[N@H+](CCc1cccc(F)c1)Cc1c(O)cccc1Cl ZINC001140342248 1131703681 /nfs/dbraw/zinc/70/36/81/1131703681.db2.gz ZULZQZZQDGMRRH-UHFFFAOYSA-N 1 0 293.769 3.859 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)Cc1c(O)cccc1Cl ZINC001140341668 1131703854 /nfs/dbraw/zinc/70/38/54/1131703854.db2.gz BDUJNKVISOSSAQ-UHFFFAOYSA-N 1 0 291.778 3.773 20 10 CHCDRO CO[C@@H](C[NH2+][C@H](C)c1ccc(C)cc1O)Cc1ccccc1 ZINC000834856648 1131712627 /nfs/dbraw/zinc/71/26/27/1131712627.db2.gz SVIPGLOHAGDMEO-NVXWUHKLSA-N 1 0 299.414 3.609 20 10 CHCDRO CC[C@H]([NH2+]C[C@@](C)(CC)OC)c1ccc(N(C)C)cc1 ZINC000834881952 1131717597 /nfs/dbraw/zinc/71/75/97/1131717597.db2.gz GVQKYSZTDJMOFO-DLBZAZTESA-N 1 0 278.440 3.608 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCO[C@@H](C(C)C)C2)c1 ZINC000834887231 1131719115 /nfs/dbraw/zinc/71/91/15/1131719115.db2.gz ZXLCPPUPWRXTGL-RLFYNMQTSA-N 1 0 291.435 3.802 20 10 CHCDRO Cc1ccc(F)c(CC[NH2+][C@H](C)c2ccccc2O)c1 ZINC000834892392 1131719579 /nfs/dbraw/zinc/71/95/79/1131719579.db2.gz MHWWUVPDPHNJRE-CYBMUJFWSA-N 1 0 273.351 3.733 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C2CCC(OC(F)F)CC2)c1 ZINC000834903463 1131726913 /nfs/dbraw/zinc/72/69/13/1131726913.db2.gz KLOQLGFSTWBFRZ-HIFPTAJRSA-N 1 0 299.361 3.902 20 10 CHCDRO Cc1cc(C)c(C[NH2+][C@H](C)c2cc(Cl)ccc2O)cn1 ZINC000834902022 1131727393 /nfs/dbraw/zinc/72/73/93/1131727393.db2.gz CVASSCQIKLXYEU-GFCCVEGCSA-N 1 0 290.794 3.908 20 10 CHCDRO C[C@H]([NH2+]CC(C)(C)C1(O)CCCC1)c1cc(F)ccc1O ZINC000834906197 1131729124 /nfs/dbraw/zinc/72/91/24/1131729124.db2.gz NPNWDIVEUCYPRD-LBPRGKRZSA-N 1 0 295.398 3.513 20 10 CHCDRO CCC(C)(C)OCC[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000834911748 1131731611 /nfs/dbraw/zinc/73/16/11/1131731611.db2.gz AMFOATAYHKVJNW-CQSZACIVSA-N 1 0 279.424 3.865 20 10 CHCDRO CCO[C@@H]1CCCC[C@H]1[NH2+][C@H](C)c1cc(C)ccc1O ZINC000834913653 1131731748 /nfs/dbraw/zinc/73/17/48/1131731748.db2.gz QHVJNYAUIYATDA-FRFSOERESA-N 1 0 277.408 3.699 20 10 CHCDRO Oc1cc(Cl)ccc1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC001140465399 1131751338 /nfs/dbraw/zinc/75/13/38/1131751338.db2.gz LWEBDLVWLCVVOD-OAHLLOKOSA-N 1 0 273.763 3.993 20 10 CHCDRO CC[N@H+](C/C=C\c1ccc(N(C)C)cc1)Cc1ccccn1 ZINC000835030386 1131759068 /nfs/dbraw/zinc/75/90/68/1131759068.db2.gz XQXLOLXXLPTNTQ-FPLPWBNLSA-N 1 0 295.430 3.683 20 10 CHCDRO Cc1noc(C)c1[C@@H](C)[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC000835040234 1131762637 /nfs/dbraw/zinc/76/26/37/1131762637.db2.gz OICSMSZYKAAAFB-KTRBRXNASA-N 1 0 299.418 3.721 20 10 CHCDRO Cc1noc(C)c1[C@@H](C)[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC000835040232 1131762708 /nfs/dbraw/zinc/76/27/08/1131762708.db2.gz OICSMSZYKAAAFB-FMFIFOJESA-N 1 0 299.418 3.721 20 10 CHCDRO CS[C@@H]1CC[C@@H]([NH2+]C/C=C\c2ccc(N(C)C)cc2)C1 ZINC000835044266 1131763610 /nfs/dbraw/zinc/76/36/10/1131763610.db2.gz YPUWRFKVWAIYPL-XQJUWPJRSA-N 1 0 290.476 3.640 20 10 CHCDRO Cc1ccc(C[N@@H+](C)C/C=C/c2ccc(N(C)C)cc2)nc1 ZINC000835051248 1131766874 /nfs/dbraw/zinc/76/68/74/1131766874.db2.gz XQDITESJYQEAOI-AATRIKPKSA-N 1 0 295.430 3.601 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2c([O-])cc(F)cc2F)CCC1(F)F ZINC001140582899 1131807183 /nfs/dbraw/zinc/80/71/83/1131807183.db2.gz OYLVIYSRRQDYBX-SECBINFHSA-N 1 0 291.288 3.538 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCC[C@@H]2c2ccc(C)nc2)c1 ZINC001140623620 1131833085 /nfs/dbraw/zinc/83/30/85/1131833085.db2.gz YHSZRMVDAUNEJD-QGZVFWFLSA-N 1 0 282.387 3.741 20 10 CHCDRO Cc1cc(C[NH2+][C@@H](C)c2ccsc2)ccc1N(C)C ZINC000772994838 1131873372 /nfs/dbraw/zinc/87/33/72/1131873372.db2.gz BSKUDTBBMFFJSJ-ZDUSSCGKSA-N 1 0 274.433 3.973 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCCC(F)(F)C2)c1 ZINC000282786012 1131900274 /nfs/dbraw/zinc/90/02/74/1131900274.db2.gz PVJIKVVCQOGHQM-NWDGAFQWSA-N 1 0 299.361 3.877 20 10 CHCDRO Cc1c(O)ccc(C[N@@H+]2CCC[C@H]2c2ccccc2)c1O ZINC001140745546 1131906051 /nfs/dbraw/zinc/90/60/51/1131906051.db2.gz KHMQAGQAWLAMJX-INIZCTEOSA-N 1 0 283.371 3.743 20 10 CHCDRO Cc1c(O)ccc(C[NH+]2CCCCCCCC2)c1O ZINC001140749815 1131906551 /nfs/dbraw/zinc/90/65/51/1131906551.db2.gz NQOLEQVXJNRHNM-UHFFFAOYSA-N 1 0 263.381 3.562 20 10 CHCDRO CC[C@H]([NH2+]Cc1cccc(F)n1)c1ccc(N(C)C)cc1 ZINC000773088196 1131941301 /nfs/dbraw/zinc/94/13/01/1131941301.db2.gz NWENEDURGDDZOY-INIZCTEOSA-N 1 0 287.382 3.528 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H](C)[C@@H]2C)c(O)c1 ZINC001140855225 1131947850 /nfs/dbraw/zinc/94/78/50/1131947850.db2.gz SKADXVOFYZGION-CABCVRRESA-N 1 0 290.451 3.859 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)C[C@H]2CC2(C)C)c(O)c1 ZINC001140855608 1131949669 /nfs/dbraw/zinc/94/96/69/1131949669.db2.gz FIRZPOBWHPFFTP-OAHLLOKOSA-N 1 0 290.451 3.716 20 10 CHCDRO C[C@H]([NH2+][C@H](c1cccnc1)C1CC1)c1ccc(N(C)C)cc1 ZINC000773120925 1131950714 /nfs/dbraw/zinc/95/07/14/1131950714.db2.gz SUKWJLPKIJOVGV-LIRRHRJNSA-N 1 0 295.430 3.950 20 10 CHCDRO CC[C@@H]1CC[N@H+](Cc2ccc(N(C)C)cc2Cl)C1 ZINC001140925525 1131966478 /nfs/dbraw/zinc/96/64/78/1131966478.db2.gz CLUBJBDVVGQACI-GFCCVEGCSA-N 1 0 266.816 3.638 20 10 CHCDRO Cc1ccc(C[N@@H+]2CCCC3(CCCC3)C2)c(O)c1 ZINC001140948108 1131969061 /nfs/dbraw/zinc/96/90/61/1131969061.db2.gz TZALAMBINABZCS-UHFFFAOYSA-N 1 0 259.393 3.857 20 10 CHCDRO C[C@H]([NH2+]Cc1ccccc1O)c1ccc(F)cc1F ZINC000036952737 1131982842 /nfs/dbraw/zinc/98/28/42/1131982842.db2.gz VZIYCDIKEAATHL-JTQLQIEISA-N 1 0 263.287 3.521 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)Cc2cccs2)c1 ZINC000036992893 1131985586 /nfs/dbraw/zinc/98/55/86/1131985586.db2.gz REXXBAJHFPVKSL-NEPJUHHUSA-N 1 0 291.416 3.744 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(OC)ccc1O)c1ccc(C)cc1 ZINC000037048037 1131990316 /nfs/dbraw/zinc/99/03/16/1131990316.db2.gz KWPDTYCFUZMKGT-KRWDZBQOSA-N 1 0 285.387 3.950 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccccc1O)c1ccc(C)cc1 ZINC000037048092 1131990449 /nfs/dbraw/zinc/99/04/49/1131990449.db2.gz IMAYSANDEWDDMW-MRXNPFEDSA-N 1 0 255.361 3.942 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2ccns2)cc1 ZINC000716045337 1132003591 /nfs/dbraw/zinc/00/35/91/1132003591.db2.gz ARNUBKONXOFFRP-CYBMUJFWSA-N 1 0 289.448 3.840 20 10 CHCDRO c1c(C[NH+]2CCCCCC2)cc2c3c1CCCN3CCC2 ZINC001141074354 1132005642 /nfs/dbraw/zinc/00/56/42/1132005642.db2.gz GARPEFRUZAXDFW-UHFFFAOYSA-N 1 0 284.447 3.761 20 10 CHCDRO CC[C@@H](C)[N@H+](C)Cc1cc2c3c(c1)CCCN3CCC2 ZINC001141074770 1132005654 /nfs/dbraw/zinc/00/56/54/1132005654.db2.gz BCTUTZBLZBWXQT-CQSZACIVSA-N 1 0 272.436 3.616 20 10 CHCDRO CC(C)[NH+](CCN[C@H](C)c1ccc(N(C)C)cc1)C(C)C ZINC000037188685 1132009764 /nfs/dbraw/zinc/00/97/64/1132009764.db2.gz KHYZTVMWXYZFEA-MRXNPFEDSA-N 1 0 291.483 3.522 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C2CC(OCc3ccccc3)C2)c1 ZINC000716211556 1132022720 /nfs/dbraw/zinc/02/27/20/1132022720.db2.gz DILQPPREHGTALR-UHFFFAOYSA-N 1 0 297.398 3.538 20 10 CHCDRO C[N@H+](Cc1ccc2ccccc2c1)Cc1cc(O)ccc1O ZINC001141161848 1132030866 /nfs/dbraw/zinc/03/08/66/1132030866.db2.gz FZWOUPAQOJJHPE-UHFFFAOYSA-N 1 0 293.366 3.883 20 10 CHCDRO Cc1cc(C)c(C[NH2+][C@H]2CCc3c(C)cccc3C2)c(O)c1 ZINC001171561362 1132055717 /nfs/dbraw/zinc/05/57/17/1132055717.db2.gz YESXSCILXHSQKY-KRWDZBQOSA-N 1 0 295.426 3.965 20 10 CHCDRO Cc1ccc(CC[C@@H](C)[NH2+]CCc2ccc(O)c(O)c2)cc1 ZINC001171659009 1132070888 /nfs/dbraw/zinc/07/08/88/1132070888.db2.gz WMYOYFFMAGKUEC-OAHLLOKOSA-N 1 0 299.414 3.560 20 10 CHCDRO C[C@@H]1CC[C@@H]([N@@H+]2CCc3cccc(O)c3C2)C[C@H]1C ZINC001172379577 1132171245 /nfs/dbraw/zinc/17/12/45/1132171245.db2.gz ORFCPCVCZOOULJ-UMVBOHGHSA-N 1 0 259.393 3.575 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H](C)CCCc2cccnc2)cc1C ZINC000839149568 1132184594 /nfs/dbraw/zinc/18/45/94/1132184594.db2.gz DTAPVVJLCLVTPB-MRXNPFEDSA-N 1 0 298.430 3.905 20 10 CHCDRO Oc1ccccc1C[NH2+][C@@H]1C[C@H]1c1c(F)cccc1Cl ZINC000839163400 1132187337 /nfs/dbraw/zinc/18/73/37/1132187337.db2.gz RFFDGWDIDFRKKZ-BXUZGUMPSA-N 1 0 291.753 3.830 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]C2CCC(C(F)F)CC2)c1 ZINC000839179530 1132188433 /nfs/dbraw/zinc/18/84/33/1132188433.db2.gz KPCFIQUDLJOEMG-UNXYVOJBSA-N 1 0 299.361 3.875 20 10 CHCDRO Oc1cc2c(cc1C[N@@H+]1CC[C@@H](F)C1)oc1ccccc12 ZINC000840103272 1132247405 /nfs/dbraw/zinc/24/74/05/1132247405.db2.gz AQGKLZRJBKSPMH-GFCCVEGCSA-N 1 0 285.318 3.835 20 10 CHCDRO Cc1cc(C)c(O)c(CN2Cc3cccc(F)c3C2)c1 ZINC000840160682 1132247926 /nfs/dbraw/zinc/24/79/26/1132247926.db2.gz CBZOZRLHCMVMRR-UHFFFAOYSA-N 1 0 271.335 3.664 20 10 CHCDRO COc1ccc([C@H](C)[NH2+]Cc2ccc3c(c2)CCO3)c(C)c1 ZINC000840721204 1132276840 /nfs/dbraw/zinc/27/68/40/1132276840.db2.gz UBZBFAUKAQTCNC-AWEZNQCLSA-N 1 0 297.398 3.789 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)c(O)c1C ZINC000840820099 1132290911 /nfs/dbraw/zinc/29/09/11/1132290911.db2.gz JVKKDWBLASAHCS-LUYZLQTOSA-N 1 0 259.393 3.848 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CS[C@H](C)C2)cc1 ZINC000840855581 1132294703 /nfs/dbraw/zinc/29/47/03/1132294703.db2.gz MQYSWOWUGPGSLQ-IPYPFGDCSA-N 1 0 278.465 3.687 20 10 CHCDRO CO[C@@](C)([C@@H](C)[NH2+][C@@H](C)c1ccc(C)cc1O)C1CC1 ZINC000840859514 1132295720 /nfs/dbraw/zinc/29/57/20/1132295720.db2.gz MYFGNKCVMOHHKV-AHIWAGSCSA-N 1 0 277.408 3.555 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CS[C@@H](C)C1)c1ccc(C)cc1O ZINC000840858967 1132295774 /nfs/dbraw/zinc/29/57/74/1132295774.db2.gz FGEKWZMMQRBCCZ-SCRDCRAPSA-N 1 0 265.422 3.635 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)[C@](C)(OC)C1CC1)c1ccc(C)cc1O ZINC000840858838 1132295800 /nfs/dbraw/zinc/29/58/00/1132295800.db2.gz GZHIPPALFDWLBD-OWQGQXMQSA-N 1 0 291.435 3.945 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)C1(OC)CCC1)c1ccc(C)cc1O ZINC000840883916 1132303225 /nfs/dbraw/zinc/30/32/25/1132303225.db2.gz HDLCQBRRDONMCR-ZFWWWQNUSA-N 1 0 277.408 3.699 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CC(C)(C)c2cccnc2)c1 ZINC000840890376 1132304446 /nfs/dbraw/zinc/30/44/46/1132304446.db2.gz ADEFYVVJCKHIOX-CQSZACIVSA-N 1 0 284.403 3.724 20 10 CHCDRO COc1cccc([C@@H]2C[C@H]2C[NH2+][C@@H](C)c2ccccc2O)c1 ZINC000840889626 1132304551 /nfs/dbraw/zinc/30/45/51/1132304551.db2.gz SSDZFMORASZSED-YEWWUXTCSA-N 1 0 297.398 3.855 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)CCc1cccn1C ZINC000840933679 1132310073 /nfs/dbraw/zinc/31/00/73/1132310073.db2.gz HIGYXROGIYEUCK-MRXNPFEDSA-N 1 0 299.462 3.510 20 10 CHCDRO CSC1(C[NH2+]Cc2c(O)cc(C)cc2Cl)CCC1 ZINC000840940636 1132310720 /nfs/dbraw/zinc/31/07/20/1132310720.db2.gz IUIAKOKCPPSCNW-UHFFFAOYSA-N 1 0 285.840 3.729 20 10 CHCDRO Oc1ccc2ccccc2c1C[NH+]1CC2(C1)CCCC2 ZINC001231587840 1132317215 /nfs/dbraw/zinc/31/72/15/1132317215.db2.gz ZUYUSKCRXGAHQK-UHFFFAOYSA-N 1 0 267.372 3.921 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2c(O)ccc3ccccc32)CCC[C@]1(C)O ZINC001231586956 1132317295 /nfs/dbraw/zinc/31/72/95/1132317295.db2.gz NTLNOTIRAQHSDX-KUHUBIRLSA-N 1 0 299.414 3.528 20 10 CHCDRO Cc1cccc(C[N@H+](C)CCc2cccc(F)c2)c1O ZINC001231594423 1132320347 /nfs/dbraw/zinc/32/03/47/1132320347.db2.gz HJZKMYKXQXSUFQ-UHFFFAOYSA-N 1 0 273.351 3.514 20 10 CHCDRO CCCC1CCC([NH2+]CCc2ccc(N)cc2)CC1 ZINC000841034511 1132321534 /nfs/dbraw/zinc/32/15/34/1132321534.db2.gz HAHMZBPJQKHSEY-UHFFFAOYSA-N 1 0 260.425 3.760 20 10 CHCDRO CCCCOc1ccc(C[NH2+]CCc2ccc(N)cc2)cc1 ZINC000841036911 1132321603 /nfs/dbraw/zinc/32/16/03/1132321603.db2.gz QHCNLTXIERXYFE-UHFFFAOYSA-N 1 0 298.430 3.780 20 10 CHCDRO C[C@H]([NH3+])c1ccc(NCc2ccc(N(C)C)c(F)c2)cc1 ZINC000841028779 1132321618 /nfs/dbraw/zinc/32/16/18/1132321618.db2.gz RTXGRQWSDOGXFH-LBPRGKRZSA-N 1 0 287.382 3.524 20 10 CHCDRO Cc1cc(O)c(CNc2ccc([C@H](C)[NH3+])cc2)c(Cl)c1 ZINC000841031613 1132321906 /nfs/dbraw/zinc/32/19/06/1132321906.db2.gz YFSFHTQJIXZIOO-NSHDSACASA-N 1 0 290.794 3.986 20 10 CHCDRO Cc1ccc(CC[C@@H](C)[NH2+]CCc2ccc(N)cc2)cc1 ZINC000841036497 1132323158 /nfs/dbraw/zinc/32/31/58/1132323158.db2.gz TVHOUXFEFKYUKF-MRXNPFEDSA-N 1 0 282.431 3.731 20 10 CHCDRO CC[NH2+]Cc1cccc(NCc2ccc(N(C)C)cc2C)c1 ZINC000841044136 1132324046 /nfs/dbraw/zinc/32/40/46/1132324046.db2.gz WNGUCKKCGSNLCG-UHFFFAOYSA-N 1 0 297.446 3.783 20 10 CHCDRO CCN(CC)c1ccc(CNc2ccccc2C[NH2+]C)cc1 ZINC000841044182 1132324701 /nfs/dbraw/zinc/32/47/01/1132324701.db2.gz XCXTUZDMZKHHPB-UHFFFAOYSA-N 1 0 297.446 3.864 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)cc1)[C@@H]1CCC[C@@H](OC)C1 ZINC001172950291 1132374095 /nfs/dbraw/zinc/37/40/95/1132374095.db2.gz MGPWCMBGCOZFRU-QZTJIDSGSA-N 1 0 290.451 3.532 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCC[C@@H](c3ccccn3)C2)c(O)c1 ZINC001231845638 1132378149 /nfs/dbraw/zinc/37/81/49/1132378149.db2.gz DVYXICYBVHSDRM-MRXNPFEDSA-N 1 0 296.414 3.784 20 10 CHCDRO COCC[C@H]1CCCC[N@@H+]1Cc1cc(Cl)c(C)cc1O ZINC001231870805 1132383561 /nfs/dbraw/zinc/38/35/61/1132383561.db2.gz UTRSHPHHPWRDPH-CQSZACIVSA-N 1 0 297.826 3.745 20 10 CHCDRO COCCCC[N@H+](C)Cc1cc(C)cc(C(C)(C)C)c1O ZINC000841690847 1132384450 /nfs/dbraw/zinc/38/44/50/1132384450.db2.gz MZKSPTAIYCWRSS-UHFFFAOYSA-N 1 0 293.451 3.857 20 10 CHCDRO C[C@]1(CF)CC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC001231879668 1132389911 /nfs/dbraw/zinc/38/99/11/1132389911.db2.gz MZSVACGCKVMYGW-QGZVFWFLSA-N 1 0 273.351 3.727 20 10 CHCDRO Oc1c(C[NH+]2CC3(C2)CCCC3)ccc2ccccc21 ZINC001231879940 1132390401 /nfs/dbraw/zinc/39/04/01/1132390401.db2.gz XMQMEYQURXKTBX-UHFFFAOYSA-N 1 0 267.372 3.921 20 10 CHCDRO C[C@@]1(F)CC[N@H+](Cc2ccc3ccccc3c2O)C[C@@H]1F ZINC001231879902 1132390511 /nfs/dbraw/zinc/39/05/11/1132390511.db2.gz VLDMJLURPAWOLT-DOTOQJQBSA-N 1 0 291.341 3.817 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)c1cncc(F)c1 ZINC000841752763 1132392492 /nfs/dbraw/zinc/39/24/92/1132392492.db2.gz HRZDLWUVEIUBNI-UWVGGRQHSA-N 1 0 294.757 3.992 20 10 CHCDRO CO[C@@](C)([C@@H](C)[NH2+][C@H](C)c1ccc(Cl)cc1O)C1CC1 ZINC000841756513 1132393050 /nfs/dbraw/zinc/39/30/50/1132393050.db2.gz WNNVADQODZLWHW-UVWXRNBGSA-N 1 0 297.826 3.900 20 10 CHCDRO C[C@@H]([NH2+]CCC(C)(F)F)c1ccc(Cl)cc1O ZINC000841758979 1132394653 /nfs/dbraw/zinc/39/46/53/1132394653.db2.gz WLQLESLBKIVNJL-MRVPVSSYSA-N 1 0 263.715 3.742 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2cc(F)c(F)cc2[O-])cc1C ZINC001142530310 1132404925 /nfs/dbraw/zinc/40/49/25/1132404925.db2.gz CNWDRRRCEPUJNE-UHFFFAOYSA-N 1 0 291.341 3.919 20 10 CHCDRO CCCC[C@H](CC(C)C)[NH2+]Cc1cccc(O)c1O ZINC001173252524 1132422355 /nfs/dbraw/zinc/42/23/55/1132422355.db2.gz JGPSAPRWCZAQLD-CQSZACIVSA-N 1 0 265.397 3.792 20 10 CHCDRO COc1cc(O)c(C[N@H+](C)Cc2ccccc2)cc1Cl ZINC001232263640 1132445156 /nfs/dbraw/zinc/44/51/56/1132445156.db2.gz CARHQDXOWPLHSQ-UHFFFAOYSA-N 1 0 291.778 3.686 20 10 CHCDRO CC[C@H]1CCCC[N@@H+]1Cc1cc(Cl)c(OC)cc1O ZINC001232269871 1132446976 /nfs/dbraw/zinc/44/69/76/1132446976.db2.gz LNFGNGMVTAFWNY-LBPRGKRZSA-N 1 0 283.799 3.819 20 10 CHCDRO COc1cc(O)c(C[NH+]2C[C@@H]3CCCC[C@H]3C2)cc1Cl ZINC001232266590 1132447591 /nfs/dbraw/zinc/44/75/91/1132447591.db2.gz PLWHVYIKGYPSHS-RYUDHWBXSA-N 1 0 295.810 3.676 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CCC[C@@H](C)[C@@H]2C)cc1Cl ZINC001232264947 1132447611 /nfs/dbraw/zinc/44/76/11/1132447611.db2.gz PDNGOFVVJKSUEY-MNOVXSKESA-N 1 0 283.799 3.675 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CCC[C@@H](C)[C@H](C)C2)cc1Cl ZINC001232267102 1132447700 /nfs/dbraw/zinc/44/77/00/1132447700.db2.gz WIXUZAURVWWOFK-VXGBXAGGSA-N 1 0 297.826 3.922 20 10 CHCDRO CCOc1ccc(C[NH2+]C[C@H]2C[C@@H]2c2ccccc2)c(O)c1 ZINC000842736186 1132456827 /nfs/dbraw/zinc/45/68/27/1132456827.db2.gz CCWUPBGZGFGWOQ-SJLPKXTDSA-N 1 0 297.398 3.684 20 10 CHCDRO CC[C@H]([NH2+][C@H]1C[C@@H](OC(C)(C)C)C1)c1ccccc1O ZINC000842922893 1132476582 /nfs/dbraw/zinc/47/65/82/1132476582.db2.gz YYSQIMPGWIXYSH-GUTXKFCHSA-N 1 0 277.408 3.779 20 10 CHCDRO CC[C@@H]([NH2+]CC1CCC(F)CC1)c1ccccc1O ZINC000842930685 1132477817 /nfs/dbraw/zinc/47/78/17/1132477817.db2.gz ZKUQHLBDLNQFRZ-SSDMNJCBSA-N 1 0 265.372 3.961 20 10 CHCDRO C[N@H+](CCc1cccnc1)Cc1cccc(C(C)(C)C)c1O ZINC001143110771 1132504930 /nfs/dbraw/zinc/50/49/30/1132504930.db2.gz OIHKRKRPGBQRCU-UHFFFAOYSA-N 1 0 298.430 3.759 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H]3CCCC[C@@H]32)c(O)c1 ZINC001232840455 1132527927 /nfs/dbraw/zinc/52/79/27/1132527927.db2.gz XOSMRRLOCKPUFL-YOEHRIQHSA-N 1 0 288.435 3.613 20 10 CHCDRO C[N@H+](Cc1ccncc1)Cc1cc(C(C)(C)C)ccc1O ZINC001233284017 1132594180 /nfs/dbraw/zinc/59/41/80/1132594180.db2.gz DUFWPDKFQQGJLW-UHFFFAOYSA-N 1 0 284.403 3.717 20 10 CHCDRO CC[N@H+](Cc1cc(C(C)(C)C)ccc1O)C1CCOCC1 ZINC001233286051 1132594220 /nfs/dbraw/zinc/59/42/20/1132594220.db2.gz CODIJXSLOKYLSU-UHFFFAOYSA-N 1 0 291.435 3.691 20 10 CHCDRO COCC1CC[NH+](Cc2cc(C(C)(C)C)ccc2O)CC1 ZINC001233283947 1132594471 /nfs/dbraw/zinc/59/44/71/1132594471.db2.gz BTCVSHWSXDUOMY-UHFFFAOYSA-N 1 0 291.435 3.548 20 10 CHCDRO COCC[N@H+](Cc1cc(C(C)(C)C)ccc1O)C(C)C ZINC001233286458 1132595142 /nfs/dbraw/zinc/59/51/42/1132595142.db2.gz UVFZMCNTCDEXRY-UHFFFAOYSA-N 1 0 279.424 3.547 20 10 CHCDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CC[C@@]3(CC3(F)F)C2)c1 ZINC001233286226 1132595401 /nfs/dbraw/zinc/59/54/01/1132595401.db2.gz KTHQTNUOQZIUQA-MRXNPFEDSA-N 1 0 295.373 3.921 20 10 CHCDRO Oc1cc(C(F)(F)F)ccc1C[NH+]1C[C@@H]2CCC[C@H]2C1 ZINC001233451511 1132625015 /nfs/dbraw/zinc/62/50/15/1132625015.db2.gz NBXQVYYKSBLXFN-QWRGUYRKSA-N 1 0 285.309 3.643 20 10 CHCDRO C[C@@H]1C[C@H](C)C[N@@H+](Cc2ccc(C(F)(F)F)cc2O)C1 ZINC001233455142 1132625473 /nfs/dbraw/zinc/62/54/73/1132625473.db2.gz XYEANVNDKVJNFA-PHIMTYICSA-N 1 0 287.325 3.889 20 10 CHCDRO CCC[N@H+](CC)Cc1ccc(C(F)(F)F)cc1O ZINC001233451461 1132625526 /nfs/dbraw/zinc/62/55/26/1132625526.db2.gz LKNXNKVEUKNYKO-UHFFFAOYSA-N 1 0 261.287 3.643 20 10 CHCDRO CCCCC[N@H+](C)Cc1cccc(OC(F)(F)F)c1O ZINC001233727267 1132671580 /nfs/dbraw/zinc/67/15/80/1132671580.db2.gz LICMWQPELGTOCX-UHFFFAOYSA-N 1 0 291.313 3.913 20 10 CHCDRO Nc1ccc(Cc2ccc(NC3=CCC[NH2+]CC3)cc2)cc1 ZINC001159704330 1132895663 /nfs/dbraw/zinc/89/56/63/1132895663.db2.gz WVNPYDUITBZHDM-UHFFFAOYSA-N 1 0 293.414 3.539 20 10 CHCDRO Cc1c[nH+]ccc1Nc1cc(Cl)cc(Cl)c1O ZINC001174539706 1132899492 /nfs/dbraw/zinc/89/94/92/1132899492.db2.gz QEKXCCFDGPQILZ-UHFFFAOYSA-N 1 0 269.131 3.568 20 10 CHCDRO Cc1cc(Nc2cc(Cl)c(Cl)cc2O)cc[nH+]1 ZINC001174656519 1132951795 /nfs/dbraw/zinc/95/17/95/1132951795.db2.gz BZTBJEYWVQEZKX-UHFFFAOYSA-N 1 0 269.131 3.568 20 10 CHCDRO C[C@@H]([N@H+](C)Cc1cc(F)c(N(C)C)cc1F)C1(C)CC1 ZINC001204389565 1132974472 /nfs/dbraw/zinc/97/44/72/1132974472.db2.gz NGPAEVLMQIQIGF-LLVKDONJSA-N 1 0 282.378 3.651 20 10 CHCDRO CC(C)[NH+](Cc1cc(Br)ccc1O)C(C)C ZINC001203635172 1133347023 /nfs/dbraw/zinc/34/70/23/1133347023.db2.gz MVWFGYRGULHDKI-UHFFFAOYSA-N 1 0 286.213 3.774 20 10 CHCDRO CCOc1cccc(C[N@H+](C)[C@H]2CC[C@H](C)CC2)c1O ZINC001203617856 1133345470 /nfs/dbraw/zinc/34/54/70/1133345470.db2.gz VSBBRZDQVDHNNU-CTYIDZIISA-N 1 0 277.408 3.801 20 10 CHCDRO CC[N@H+](Cc1ccc(OC)c(F)c1)Cc1ccccc1O ZINC001203791920 1133370086 /nfs/dbraw/zinc/37/00/86/1133370086.db2.gz IPKIDSRNSLMBPV-UHFFFAOYSA-N 1 0 289.350 3.562 20 10 CHCDRO Oc1ccc(C[N@@H+]2CCC[C@H](c3ccccc3)CC2)cc1O ZINC001203878572 1133378119 /nfs/dbraw/zinc/37/81/19/1133378119.db2.gz CVVXHNURZYWJGR-KRWDZBQOSA-N 1 0 297.398 3.868 20 10 CHCDRO Oc1ccc(C[N@@H+]2CCC[C@H]2c2cccc(F)c2)cc1O ZINC001203881095 1133378708 /nfs/dbraw/zinc/37/87/08/1133378708.db2.gz DHHVMNLSLIXJEC-HNNXBMFYSA-N 1 0 287.334 3.574 20 10 CHCDRO Cc1ccc(CC[N@@H+](C)Cc2ccc(N(C)C)cc2)cc1 ZINC001203934349 1133386090 /nfs/dbraw/zinc/38/60/90/1133386090.db2.gz RMVDHKZOUJGYIW-UHFFFAOYSA-N 1 0 282.431 3.736 20 10 CHCDRO C[C@H]1c2ccccc2CC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC001203930317 1133386681 /nfs/dbraw/zinc/38/66/81/1133386681.db2.gz RUDYCILAFFBEKS-HNNXBMFYSA-N 1 0 280.415 3.872 20 10 CHCDRO CN(C)c1ccc(C[NH+]2CCC3(CC[C@H](F)C3)CC2)cc1 ZINC001203937692 1133386690 /nfs/dbraw/zinc/38/66/90/1133386690.db2.gz MHEQIKKXRIKTON-INIZCTEOSA-N 1 0 290.426 3.857 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2ccc(N(C)C)cc2)CCC1(F)F ZINC001203930322 1133387026 /nfs/dbraw/zinc/38/70/26/1133387026.db2.gz RZPYFDIXSWYJMT-CYBMUJFWSA-N 1 0 282.378 3.620 20 10 CHCDRO CC[C@@H]1CC[N@H+](Cc2ccc(N(CC)CC)cc2)C1 ZINC001203945985 1133387980 /nfs/dbraw/zinc/38/79/80/1133387980.db2.gz QYWJQLGBSPKSBI-OAHLLOKOSA-N 1 0 260.425 3.765 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2C[C@@H](C)CC23CC3)cc1 ZINC001203942448 1133388069 /nfs/dbraw/zinc/38/80/69/1133388069.db2.gz QUIMZFCMFAIJHL-HNNXBMFYSA-N 1 0 272.436 3.907 20 10 CHCDRO Oc1ccc(C[N@@H+]2CCC[C@@H]2c2ccccc2F)c(O)c1 ZINC001204274758 1133426900 /nfs/dbraw/zinc/42/69/00/1133426900.db2.gz INGKCADYLKSOLU-MRXNPFEDSA-N 1 0 287.334 3.574 20 10 CHCDRO Cn1cc(C[N@H+](C)Cc2ccccc2O)c2ccccc21 ZINC001204319281 1133436943 /nfs/dbraw/zinc/43/69/43/1133436943.db2.gz MVVYFCNYPIAEMO-UHFFFAOYSA-N 1 0 280.371 3.516 20 10 CHCDRO CC[C@@H]1CC[N@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001204329332 1133438588 /nfs/dbraw/zinc/43/85/88/1133438588.db2.gz MOTNHTYVNVUJMF-OAHLLOKOSA-N 1 0 258.409 3.519 20 10 CHCDRO CC[C@@H]1CC[N@H+](Cc2cc(Cl)c(C)cc2O)C1 ZINC001204388369 1133441882 /nfs/dbraw/zinc/44/18/82/1133441882.db2.gz BKANOOCJZIKCSB-LLVKDONJSA-N 1 0 253.773 3.586 20 10 CHCDRO CC[C@@H](C)C[N@H+](CC)Cc1ccc(Cl)cc1[O-] ZINC001204401657 1133442692 /nfs/dbraw/zinc/44/26/92/1133442692.db2.gz KRUQUKNGYUXCTF-LLVKDONJSA-N 1 0 255.789 3.914 20 10 CHCDRO CC(C)[C@@H]1CCC[N@@H+]1Cc1cc(F)c(N(C)C)cc1F ZINC001204657192 1133472191 /nfs/dbraw/zinc/47/21/91/1133472191.db2.gz BKNCCABSYFLBDD-HNNXBMFYSA-N 1 0 282.378 3.651 20 10 CHCDRO CCC[C@H](C[N@H+](Cc1ccccc1O)C1CCCC1)OC ZINC001204923354 1133499923 /nfs/dbraw/zinc/49/99/23/1133499923.db2.gz KUJHFNJBBCJQAQ-QGZVFWFLSA-N 1 0 291.435 3.952 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CC[C@@H](C)C(C)(C)C2)c1O ZINC001205298884 1133556907 /nfs/dbraw/zinc/55/69/07/1133556907.db2.gz JREWYIKVTWWOSZ-LLVKDONJSA-N 1 0 297.826 3.922 20 10 CHCDRO CCC[C@]1(CO)CCC[N@@H+]1Cc1cc(C(C)C)ccc1O ZINC001205589534 1133591309 /nfs/dbraw/zinc/59/13/09/1133591309.db2.gz QKBNOYMEGCODME-GOSISDBHSA-N 1 0 291.435 3.643 20 10 CHCDRO Oc1cccc2c1CC[C@@H]2[NH2+]Cc1ccc(Cl)cc1O ZINC001206005709 1133640958 /nfs/dbraw/zinc/64/09/58/1133640958.db2.gz PPYZQZJMHBUZIM-AWEZNQCLSA-N 1 0 289.762 3.528 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@]1(C)CC=CCC1 ZINC001206240052 1133674672 /nfs/dbraw/zinc/67/46/72/1133674672.db2.gz RZQZDKXUQHQEIY-QGZVFWFLSA-N 1 0 258.409 3.649 20 10 CHCDRO Cc1ccc(CCC[N@@H+](C)Cc2ccc(N(C)C)cc2)o1 ZINC001207950759 1133870208 /nfs/dbraw/zinc/87/02/08/1133870208.db2.gz RFHVLEIIRVYVDQ-UHFFFAOYSA-N 1 0 286.419 3.719 20 10 CHCDRO Cc1ccc([C@H](C)CC[N@H+](C)Cc2ccccc2O)o1 ZINC001208169755 1133894333 /nfs/dbraw/zinc/89/43/33/1133894333.db2.gz VDSUCJRIKIEFQH-CYBMUJFWSA-N 1 0 273.376 3.919 20 10 CHCDRO C[N@H+]1CC=C(Nc2ccccc2C(=O)c2ccccc2)CC1 ZINC001208836794 1133950338 /nfs/dbraw/zinc/95/03/38/1133950338.db2.gz BCBCDMDACYXBOQ-UHFFFAOYSA-N 1 0 292.382 3.549 20 10 CHCDRO CO[C@H]1CCC[N@H+](Cc2ccc(-n3c(C)ccc3C)cc2)C1 ZINC001209517418 1134033929 /nfs/dbraw/zinc/03/39/29/1134033929.db2.gz DVIJFTRRZSDLAV-IBGZPJMESA-N 1 0 298.430 3.705 20 10 CHCDRO C[C@@H]([NH2+]C1C[C@H]2CC[C@@H](C1)S2)c1ccc(N(C)C)cc1 ZINC000403659776 1134828687 /nfs/dbraw/zinc/82/86/87/1134828687.db2.gz XSPUPBHQSDLISJ-JATKITJMSA-N 1 0 290.476 3.830 20 10 CHCDRO C[C@@H]1C[C@@H](OC2=CC(=O)C=CC2=NNc2ccccc2)C[NH2+]1 ZINC001218039735 1135047703 /nfs/dbraw/zinc/04/77/03/1135047703.db2.gz UINVCSHHSUPWIP-CCRJCHAPSA-N 1 0 297.358 3.937 20 10 CHCDRO O=C1C=CC(=NNc2ccc(O[C@@H]3CC[NH2+]C3)cc2)C=C1 ZINC001218037255 1135047914 /nfs/dbraw/zinc/04/79/14/1135047914.db2.gz WLPBSTJDSOVWPW-MRXNPFEDSA-N 1 0 283.331 3.548 20 10 CHCDRO CC[C@@H](C)C[C@H](CC)Oc1ccc(N2CC[NH2+]CC2)cc1 ZINC001218295541 1135080804 /nfs/dbraw/zinc/08/08/04/1135080804.db2.gz ODCDGIMKGZRDFE-WBVHZDCISA-N 1 0 290.451 3.690 20 10 CHCDRO CCC(CC)[C@H](CC)Oc1ccc(N2CC[NH2+]CC2)cc1 ZINC001218295345 1135081292 /nfs/dbraw/zinc/08/12/92/1135081292.db2.gz FSJMIFTYFKVYPR-SFHVURJKSA-N 1 0 290.451 3.690 20 10 CHCDRO C[C@@H]([NH2+]CCOCC1CCCC1)c1ccc(N(C)C)cc1 ZINC000313298827 1135137453 /nfs/dbraw/zinc/13/74/53/1135137453.db2.gz MZOROQLZZYQAOB-OAHLLOKOSA-N 1 0 290.451 3.610 20 10 CHCDRO COCC1(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)CCC1 ZINC000313857911 1135140996 /nfs/dbraw/zinc/14/09/96/1135140996.db2.gz IXFSHKGRWJRASN-KGLIPLIRSA-N 1 0 289.419 3.655 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCN(C)[C@H](C)C1)c1ccc2ccccc2c1O ZINC000316830244 1135169265 /nfs/dbraw/zinc/16/92/65/1135169265.db2.gz RVFHFZKHYXGQQW-YCPHGPKFSA-N 1 0 298.430 3.679 20 10 CHCDRO C[C@@H]([NH2+]CCc1cccc2cccnc21)c1ccccc1O ZINC000316948189 1135170306 /nfs/dbraw/zinc/17/03/06/1135170306.db2.gz BXOJCHBVBTXQGC-CQSZACIVSA-N 1 0 292.382 3.834 20 10 CHCDRO COc1ccc(C[NH+]2CCCCCCCC2)c(O)c1 ZINC000322293991 1135664832 /nfs/dbraw/zinc/66/48/32/1135664832.db2.gz YHBKKRCVYQVLTF-UHFFFAOYSA-N 1 0 263.381 3.557 20 10 CHCDRO CCOc1cccc(C[NH2+]C2CCCCCC2)c1O ZINC000020122619 171003771 /nfs/dbraw/zinc/00/37/71/171003771.db2.gz PMMXWEAGZNXNQS-UHFFFAOYSA-N 1 0 263.381 3.603 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccccn2)c(O)c1 ZINC000020123900 171005382 /nfs/dbraw/zinc/00/53/82/171005382.db2.gz YMEWWNOZLMKLFL-OLZOCXBDSA-N 1 0 256.349 3.507 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccccn2)c(O)c1 ZINC000020123897 171005505 /nfs/dbraw/zinc/00/55/05/171005505.db2.gz YMEWWNOZLMKLFL-QWHCGFSZSA-N 1 0 256.349 3.507 20 10 CHCDRO C[C@H](C[NH2+]Cc1ccc(N(C)C)cc1)c1ccccc1 ZINC000021805022 171327240 /nfs/dbraw/zinc/32/72/40/171327240.db2.gz ZCKMJEKIJZKRDA-OAHLLOKOSA-N 1 0 268.404 3.646 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccco1)c1ccc2ccccc2c1O ZINC000022174219 171369416 /nfs/dbraw/zinc/36/94/16/171369416.db2.gz IIYVWNHAXMWTMB-GFCCVEGCSA-N 1 0 267.328 3.989 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccc(F)cc1F ZINC000037363179 260094666 /nfs/dbraw/zinc/09/46/66/260094666.db2.gz GOKHWXNXRNIACR-NSHDSACASA-N 1 0 289.325 3.751 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2ccco2)cc1 ZINC000152029588 261058439 /nfs/dbraw/zinc/05/84/39/261058439.db2.gz UPRVPWAWPKJRAE-ZDUSSCGKSA-N 1 0 258.365 3.587 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1ccccn1)c1ccc(N(C)C)cc1 ZINC000152369879 261063525 /nfs/dbraw/zinc/06/35/25/261063525.db2.gz CVCJYTOBDVULRH-PBHICJAKSA-N 1 0 283.419 3.950 20 10 CHCDRO CC[C@H]([NH2+][C@@H](CC)c1ccccc1O)c1ccncc1 ZINC000156002294 261111353 /nfs/dbraw/zinc/11/13/53/261111353.db2.gz PPAGKJMBFCLIPT-HOTGVXAUSA-N 1 0 270.376 3.979 20 10 CHCDRO CC[C@H]([NH2+]CC(CC)(CC)CCO)c1ccccc1O ZINC000156159726 261115260 /nfs/dbraw/zinc/11/52/60/261115260.db2.gz KULRGVQVBUSKTR-HNNXBMFYSA-N 1 0 279.424 3.622 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCO[C@H](c2ccccc2)C1)c1ccccc1O ZINC000158169108 261159749 /nfs/dbraw/zinc/15/97/49/261159749.db2.gz OYSGCKZZGIGBKB-OGWOLHLISA-N 1 0 297.398 3.963 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCO[C@H](c2ccccc2)C1)c1ccccc1O ZINC000158169394 261159882 /nfs/dbraw/zinc/15/98/82/261159882.db2.gz OYSGCKZZGIGBKB-ALKREAHSSA-N 1 0 297.398 3.963 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1ccc(N(C)C)cc1)c1ccncc1 ZINC000163667099 261324485 /nfs/dbraw/zinc/32/44/85/261324485.db2.gz WUKVVCXBRNNFMT-RDTXWAMCSA-N 1 0 283.419 3.950 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCC[C@@H]2CCCCO2)c(O)c1 ZINC000183985581 262003647 /nfs/dbraw/zinc/00/36/47/262003647.db2.gz VUXKIFWSSLLDGS-CABCVRRESA-N 1 0 277.408 3.701 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)cc1 ZINC000184836361 262030544 /nfs/dbraw/zinc/03/05/44/262030544.db2.gz LFMARUWZJRDERY-NSHDSACASA-N 1 0 291.778 3.905 20 10 CHCDRO Cc1noc(C)c1CC[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000185395778 262052781 /nfs/dbraw/zinc/05/27/81/262052781.db2.gz JXCFVJYCINLXFY-VIFPVBQESA-N 1 0 294.782 3.544 20 10 CHCDRO Cc1nc(CC[NH2+][C@@H](C)c2ccc(C)cc2O)sc1C ZINC000185797898 262071684 /nfs/dbraw/zinc/07/16/84/262071684.db2.gz OHTKPXOAGAGNPR-LBPRGKRZSA-N 1 0 290.432 3.667 20 10 CHCDRO COC[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1O)c1ccccc1 ZINC000186035493 262075957 /nfs/dbraw/zinc/07/59/57/262075957.db2.gz NHEBICJCAPTJRV-BLLLJJGKSA-N 1 0 289.350 3.570 20 10 CHCDRO C[C@H]([NH2+]Cc1nc(C2CC2)cs1)c1cc(F)ccc1O ZINC000186117720 262079669 /nfs/dbraw/zinc/07/96/69/262079669.db2.gz AWIVKYDMSQETAB-VIFPVBQESA-N 1 0 292.379 3.716 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2nc(C3CC3)cs2)c(O)c1 ZINC000186117557 262080250 /nfs/dbraw/zinc/08/02/50/262080250.db2.gz PKMUOCKLRAVSTC-NSHDSACASA-N 1 0 288.416 3.885 20 10 CHCDRO Oc1ccccc1C[NH2+]C[C@H](c1ccccc1)C(F)(F)F ZINC000186433560 262093137 /nfs/dbraw/zinc/09/31/37/262093137.db2.gz SARXEURNEXYNNY-CQSZACIVSA-N 1 0 295.304 3.828 20 10 CHCDRO C[C@H]([NH2+]CC[C@@H]1CCCCO1)c1cc(Cl)ccc1O ZINC000186515104 262096099 /nfs/dbraw/zinc/09/60/99/262096099.db2.gz YCANDAKMZMTIHR-AAEUAGOBSA-N 1 0 283.799 3.655 20 10 CHCDRO Cc1csc([C@H](C)C[NH2+][C@@H](C)c2cc(C)ccc2O)n1 ZINC000186561759 262098699 /nfs/dbraw/zinc/09/86/99/262098699.db2.gz WVOIPWXVSNRTFL-YPMHNXCESA-N 1 0 290.432 3.920 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C[C@@H]2CCCC(F)(F)C2)c1 ZINC000281876326 263072755 /nfs/dbraw/zinc/07/27/55/263072755.db2.gz CYSIOIALEXFKLP-GFCCVEGCSA-N 1 0 269.335 3.616 20 10 CHCDRO Cc1ccc([C@H]([NH2+]Cc2ccccc2O)C2CC2)cc1 ZINC000134226224 264503311 /nfs/dbraw/zinc/50/33/11/264503311.db2.gz WMXKEAHWNCKQOM-SFHVURJKSA-N 1 0 267.372 3.942 20 10 CHCDRO CCOCc1cc(C[NH2+]C23CCC(CC2)C3)ccc1OC ZINC000368256631 267156784 /nfs/dbraw/zinc/15/67/84/267156784.db2.gz MGSCVHJESQBIFH-UHFFFAOYSA-N 1 0 289.419 3.654 20 10 CHCDRO COc1cccc(C2([NH2+][C@@H](C)c3ccccc3O)CC2)c1 ZINC000272908841 328201269 /nfs/dbraw/zinc/20/12/69/328201269.db2.gz WHMFBXFEGWHGRS-ZDUSSCGKSA-N 1 0 283.371 3.741 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@@H](C)c2ccccc2O)c1 ZINC000037771111 326861055 /nfs/dbraw/zinc/86/10/55/326861055.db2.gz OAOKAGQRUFATSS-OLZOCXBDSA-N 1 0 271.360 3.813 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H]2[C@H]3Cc4cc(Cl)ccc4[C@@H]23)c1 ZINC000527749724 330280926 /nfs/dbraw/zinc/28/09/26/330280926.db2.gz PMSOONDLKNIQCM-CGTJXYLNSA-N 1 0 299.801 3.782 20 10 CHCDRO C[C@H]([NH2+]CC1CC=CC1)c1cc(Cl)ccc1O ZINC000527952411 330294459 /nfs/dbraw/zinc/29/44/59/330294459.db2.gz VFFXCTSDNZWGLB-JTQLQIEISA-N 1 0 251.757 3.662 20 10 CHCDRO Cc1ncccc1C[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000527983400 330298396 /nfs/dbraw/zinc/29/83/96/330298396.db2.gz AAIXWNOHSNDOJQ-LLVKDONJSA-N 1 0 276.767 3.600 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCSC1)c1ccc2ccccc2c1O ZINC000230667647 333320342 /nfs/dbraw/zinc/32/03/42/333320342.db2.gz CRXMAJSUWQSBDJ-YPMHNXCESA-N 1 0 273.401 3.702 20 10 CHCDRO Oc1ccccc1C[NH2+][C@@H]1CCc2cc(Cl)ccc21 ZINC000134230240 334084929 /nfs/dbraw/zinc/08/49/29/334084929.db2.gz XOSDZVHOOBGKNV-OAHLLOKOSA-N 1 0 273.763 3.823 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H]1CC[C@H]1C1CC1 ZINC000554097448 334412396 /nfs/dbraw/zinc/41/23/96/334412396.db2.gz ZBKYEIBQFUHZMO-HOTGVXAUSA-N 1 0 268.404 3.765 20 10 CHCDRO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccccn1 ZINC000299195118 519655067 /nfs/dbraw/zinc/65/50/67/519655067.db2.gz MQZZEFIXZMZPJD-UHFFFAOYSA-N 1 0 283.419 3.558 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]Cc2ccc(O)cc2)cc1 ZINC000069749855 520907402 /nfs/dbraw/zinc/90/74/02/520907402.db2.gz GZOJKFUGCMZEEA-UHFFFAOYSA-N 1 0 284.403 3.528 20 10 CHCDRO CCOc1cccc(C[N@H+](C)[C@H](C)c2ccco2)c1O ZINC000131075368 521333035 /nfs/dbraw/zinc/33/30/35/521333035.db2.gz IHBODAFKZSEZOV-GFCCVEGCSA-N 1 0 275.348 3.577 20 10 CHCDRO CC[N@H+](Cc1cccc(C)c1O)[C@@H](C)c1cccnc1 ZINC000290519859 521338912 /nfs/dbraw/zinc/33/89/12/521338912.db2.gz PZWCNROIBMBHCC-AWEZNQCLSA-N 1 0 270.376 3.679 20 10 CHCDRO CCOc1cccc(C[NH2+][C@H](C)c2cc(F)ccc2O)c1 ZINC000094617618 521373690 /nfs/dbraw/zinc/37/36/90/521373690.db2.gz YAZKKVJERGBGNC-GFCCVEGCSA-N 1 0 289.350 3.781 20 10 CHCDRO CCC[N@@H+](Cc1ccccc1O)Cc1ccc(F)nc1C ZINC000278498059 521690078 /nfs/dbraw/zinc/69/00/78/521690078.db2.gz VBOATOQQVDYISQ-UHFFFAOYSA-N 1 0 288.366 3.647 20 10 CHCDRO CC[C@H]([NH2+]CC1CCSCC1)c1ccc(C)cc1O ZINC000280065774 522577956 /nfs/dbraw/zinc/57/79/56/522577956.db2.gz KRAYTONFILKSDE-HNNXBMFYSA-N 1 0 279.449 3.885 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(F)c(F)c1)c1ccccc1O ZINC000049577262 522644255 /nfs/dbraw/zinc/64/42/55/522644255.db2.gz DRISSRUFIMCVFL-HNNXBMFYSA-N 1 0 277.314 3.911 20 10 CHCDRO CC[C@H]([NH2+]Cc1cn2ccccc2n1)c1ccc(C)cc1O ZINC000279971899 522661659 /nfs/dbraw/zinc/66/16/59/522661659.db2.gz CZBVYXVVGXAZRY-INIZCTEOSA-N 1 0 295.386 3.589 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)[C@H](O)c1ccccc1)c1ccc(C)cc1O ZINC000290161506 522694295 /nfs/dbraw/zinc/69/42/95/522694295.db2.gz DETHPXILTXEBIK-FNHZYXHNSA-N 1 0 299.414 3.863 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1nnc(C)s1)c1ccc(C)cc1O ZINC000280126268 522703033 /nfs/dbraw/zinc/70/30/33/522703033.db2.gz ORGKINCXGNHVPP-GWCFXTLKSA-N 1 0 291.420 3.662 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCCc2c1cnn2C)c1ccc(C)cc1O ZINC000280272574 522752457 /nfs/dbraw/zinc/75/24/57/522752457.db2.gz YABYPQNEXFHBIX-HOTGVXAUSA-N 1 0 299.418 3.552 20 10 CHCDRO CC[C@@H]([NH2+]CC(C)(C)CCOC)c1ccc(C)cc1O ZINC000280136303 522818538 /nfs/dbraw/zinc/81/85/38/522818538.db2.gz PINDCUJXLDINAQ-OAHLLOKOSA-N 1 0 279.424 3.804 20 10 CHCDRO CC[C@@H]([NH2+]CC[C@H]1CCCCO1)c1ccc(C)cc1O ZINC000280270776 522839293 /nfs/dbraw/zinc/83/92/93/522839293.db2.gz XUXJESBEFNCECX-GDBMZVCRSA-N 1 0 277.408 3.701 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cccc2c1OCO2)c1ccc(C)cc1O ZINC000279945359 522884117 /nfs/dbraw/zinc/88/41/17/522884117.db2.gz BLNDAVHEXFSPCN-OAHLLOKOSA-N 1 0 299.370 3.670 20 10 CHCDRO CC[C@@H]([NH2+]Cc1nc(C)cs1)c1ccc(C)cc1O ZINC000280003401 522893749 /nfs/dbraw/zinc/89/37/49/522893749.db2.gz GDRWEBOWQPCEPR-CYBMUJFWSA-N 1 0 276.405 3.706 20 10 CHCDRO CC[C@@H]([NH2+][C@H](CCOC)c1ccco1)c1ccccc1O ZINC000274741732 522943801 /nfs/dbraw/zinc/94/38/01/522943801.db2.gz FLXBZCYUGZSUGU-HUUCEWRRSA-N 1 0 289.375 3.804 20 10 CHCDRO COc1ccc(C[NH2+]Cc2ccc(C(C)(C)O)cc2)cc1C ZINC000274797015 524072697 /nfs/dbraw/zinc/07/26/97/524072697.db2.gz NSXKLSGXMYENEO-UHFFFAOYSA-N 1 0 299.414 3.521 20 10 CHCDRO COc1ccc(C[NH2+]Cc2ccc3c(n2)CCCC3)cc1C ZINC000277695353 524072911 /nfs/dbraw/zinc/07/29/11/524072911.db2.gz KVHTWUCHRNZCIA-UHFFFAOYSA-N 1 0 296.414 3.567 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccccc2N(C)C)c(O)c1 ZINC000285402778 524330776 /nfs/dbraw/zinc/33/07/76/524330776.db2.gz XHSGOAXOJYQJSL-OAHLLOKOSA-N 1 0 298.430 3.926 20 10 CHCDRO Cc1cccc(C[N@@H+]2CC(C)(C)[C@@H]2c2cccnc2)c1O ZINC000292757603 524385753 /nfs/dbraw/zinc/38/57/53/524385753.db2.gz JDIBQWRDVSUTHH-KRWDZBQOSA-N 1 0 282.387 3.679 20 10 CHCDRO COc1ccc(O)c(C[NH2+]C[C@@H]2CCCCC(F)(F)C2)c1 ZINC000292705912 524752695 /nfs/dbraw/zinc/75/26/95/524752695.db2.gz CUZQIPKFRPVMEH-GFCCVEGCSA-N 1 0 299.361 3.706 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cccc(Cl)c2)c1 ZINC000053148766 524762011 /nfs/dbraw/zinc/76/20/11/524762011.db2.gz PLQQXCTTZHGRSK-LLVKDONJSA-N 1 0 291.778 3.905 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2ccsc2)c1 ZINC000061360736 524774284 /nfs/dbraw/zinc/77/42/84/524774284.db2.gz IVIFEZNDICHTPX-MNOVXSKESA-N 1 0 277.389 3.874 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@H]2c2ccncc2)cc1C ZINC000289868712 525316882 /nfs/dbraw/zinc/31/68/82/525316882.db2.gz RBWUMLQNNICMLV-QGZVFWFLSA-N 1 0 282.387 3.741 20 10 CHCDRO CSC1(C[NH2+][C@@H](C)c2cc(C)ccc2O)CCC1 ZINC000193812781 525335347 /nfs/dbraw/zinc/33/53/47/525335347.db2.gz LMSSGHTYHWHRPD-LBPRGKRZSA-N 1 0 265.422 3.637 20 10 CHCDRO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2ccc(N(C)C)cc2)o1 ZINC000020146018 525342851 /nfs/dbraw/zinc/34/28/51/525342851.db2.gz ZEONXEUHLVAUEL-DYVFJYSZSA-N 1 0 284.403 3.759 20 10 CHCDRO C[C@H]([NH2+]CCF)c1ccc(N2CCCCCC2)cc1 ZINC000280918204 525347904 /nfs/dbraw/zinc/34/79/04/525347904.db2.gz DPQOTOKJMMIXCR-AWEZNQCLSA-N 1 0 264.388 3.687 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2c(F)cncc2F)c1 ZINC000285731437 525362469 /nfs/dbraw/zinc/36/24/69/525362469.db2.gz QTYWWSGWYCKREH-GHMZBOCLSA-N 1 0 292.329 3.786 20 10 CHCDRO C[C@H]([NH2+]Cc1cc(-c2ccccc2)ccc1O)[C@@H]1CCOC1 ZINC000266149688 525428893 /nfs/dbraw/zinc/42/88/93/525428893.db2.gz JZRHMFVKZXNGGZ-WMLDXEAASA-N 1 0 297.398 3.574 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000122141089 525445078 /nfs/dbraw/zinc/44/50/78/525445078.db2.gz HQMARMHKMLTEDJ-ZDUSSCGKSA-N 1 0 299.374 3.512 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)[C@@H](O)c1ccccc1 ZINC000290197948 525609716 /nfs/dbraw/zinc/60/97/16/525609716.db2.gz GKXJMBPFWYRXPI-QMTMVMCOSA-N 1 0 298.430 3.525 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc3c(c2)CCCN3C)o1 ZINC000050286562 525928642 /nfs/dbraw/zinc/92/86/42/525928642.db2.gz ZUMGZNTWBRIKGU-AWEZNQCLSA-N 1 0 284.403 3.821 20 10 CHCDRO COc1cccc(C[NH2+]C(C)(C)c2ccccc2F)c1O ZINC000291761240 526010224 /nfs/dbraw/zinc/01/02/24/526010224.db2.gz RMRFYSOYFRIZAG-UHFFFAOYSA-N 1 0 289.350 3.565 20 10 CHCDRO Oc1ccc(-c2ccccc2)cc1C[NH2+][C@@H]1CCSC1 ZINC000266174658 526337401 /nfs/dbraw/zinc/33/74/01/526337401.db2.gz SNHCKUOMVDTELB-MRXNPFEDSA-N 1 0 285.412 3.654 20 10 CHCDRO Oc1ccccc1C[NH2+][C@H]1C[C@H](c2cccc(F)c2)C1 ZINC000280604258 526373721 /nfs/dbraw/zinc/37/37/21/526373721.db2.gz JNVHHLAFOCDLRC-KOMQPUFPSA-N 1 0 271.335 3.567 20 10 CHCDRO C[C@@H](CCc1ccccc1)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000013726361 567942214 /nfs/dbraw/zinc/94/22/14/567942214.db2.gz DLUPTZKMVBIHMP-INIZCTEOSA-N 1 0 282.431 3.864 20 10 CHCDRO C[C@@H]1CCC[N@H+](Cc2c(O)cccc2Br)[C@@H]1C ZINC000707147310 1118648205 /nfs/dbraw/zinc/64/82/05/1118648205.db2.gz YHBHIUDHHFLRGD-GHMZBOCLSA-N 1 0 298.224 3.775 20 10 CHCDRO C[C@@H]1C[C@@H](C)CC[N@@H+]1Cc1c(O)cccc1Br ZINC000707145802 1118648212 /nfs/dbraw/zinc/64/82/12/1118648212.db2.gz HJJZHDSLWDVUJY-WDEREUQCSA-N 1 0 298.224 3.775 20 10 CHCDRO CCSCC[C@@H](C)[NH2+][C@H](C)c1ccc(C)cc1O ZINC000168809380 1120097284 /nfs/dbraw/zinc/09/72/84/1120097284.db2.gz HHIWVUYQBJPZNQ-CHWSQXEVSA-N 1 0 267.438 3.883 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCCC12CC2)c1cc(F)ccc1O ZINC000706226651 1121419085 /nfs/dbraw/zinc/41/90/85/1121419085.db2.gz SDSWRBHGIMQVAW-NEPJUHHUSA-N 1 0 263.356 3.762 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCC[C@@H](F)C2)c1 ZINC001118176397 1121559269 /nfs/dbraw/zinc/55/92/69/1121559269.db2.gz AZFIZULQJBEJDF-XQQFMLRXSA-N 1 0 251.345 3.632 20 10 CHCDRO CC[C@H](CC(F)(F)F)[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001178430267 1121783463 /nfs/dbraw/zinc/78/34/63/1121783463.db2.gz DHLFNNZSMDOJSS-CYBMUJFWSA-N 1 0 287.325 3.832 20 10 CHCDRO CC[C@H]([NH2+]CCCCOC)c1cc(Cl)ccc1O ZINC000775488159 1122616195 /nfs/dbraw/zinc/61/61/95/1122616195.db2.gz MXIVWFNGKPZCIH-ZDUSSCGKSA-N 1 0 271.788 3.513 20 10 CHCDRO CC[C@H]([NH2+]CCN(CC)C1CC1)c1cc(Cl)ccc1O ZINC000775499412 1122628012 /nfs/dbraw/zinc/62/80/12/1122628012.db2.gz CXYKKNBNAREFLU-HNNXBMFYSA-N 1 0 296.842 3.571 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC[C@H]2CCSC2)c(O)c1C ZINC000866401879 1124062624 /nfs/dbraw/zinc/06/26/24/1124062624.db2.gz GAWKUNVFXSLLQD-KGLIPLIRSA-N 1 0 279.449 3.803 20 10 CHCDRO CCCC[C@@H](CC)C[NH2+]Cc1cccc(OC)c1O ZINC000021505379 1124929082 /nfs/dbraw/zinc/92/90/82/1124929082.db2.gz MXISXRWYWYNVCG-CYBMUJFWSA-N 1 0 265.397 3.707 20 10 CHCDRO CSCCCCCC[NH2+][C@@H](C)c1ccccc1O ZINC000184104212 1125291462 /nfs/dbraw/zinc/29/14/62/1125291462.db2.gz WQVHSSCIYMNNSN-ZDUSSCGKSA-N 1 0 267.438 3.966 20 10 CHCDRO Cc1cc(O)c(C[NH+](C(C)C)C(C)C)cc1Cl ZINC001231866254 1132380215 /nfs/dbraw/zinc/38/02/15/1132380215.db2.gz BDMGDIRIYHFLPZ-UHFFFAOYSA-N 1 0 255.789 3.973 20 10 CHCDRO Cc1ncsc1C[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841746651 1132390943 /nfs/dbraw/zinc/39/09/43/1132390943.db2.gz JSNKQEWVSPAGHJ-MRVPVSSYSA-N 1 0 282.796 3.661 20 10 CHCDRO C[C@H]([NH2+]CC1CCC(F)CC1)c1cc(F)ccc1O ZINC000842929295 1132477479 /nfs/dbraw/zinc/47/74/79/1132477479.db2.gz OQWZAOFVWGZLGN-UNXYVOJBSA-N 1 0 269.335 3.710 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@@H]2CCCC[C@H]2C(C)C)c1 ZINC000214933862 1125547500 /nfs/dbraw/zinc/54/75/00/1125547500.db2.gz NVVHAGFYXIWMRZ-JKSUJKDBSA-N 1 0 277.408 3.705 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CCCC2CC2)cc1 ZINC000134869238 1125567405 /nfs/dbraw/zinc/56/74/05/1125567405.db2.gz PJXZKUAMEKWWKB-UHFFFAOYSA-N 1 0 260.425 3.813 20 10 CHCDRO C[C@H]1CC[C@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000135166546 1125579224 /nfs/dbraw/zinc/57/92/24/1125579224.db2.gz GASYKDIUNRZAPU-RDJZCZTQSA-N 1 0 272.436 3.955 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CC(C)(C)SC)cc1 ZINC000135383713 1125587842 /nfs/dbraw/zinc/58/78/42/1125587842.db2.gz VLCVGZGKPRZLJR-UHFFFAOYSA-N 1 0 280.481 3.764 20 10 CHCDRO CCOC[C@@H]([NH2+][C@H](C)c1ccc(Cl)cc1O)C(C)C ZINC000841753800 1125591580 /nfs/dbraw/zinc/59/15/80/1125591580.db2.gz WOAYGEAGYPUBBR-BXUZGUMPSA-N 1 0 285.815 3.757 20 10 CHCDRO Oc1c(C[NH2+]C[C@H]2CC[C@@H](C3CC3)O2)ccc2ccccc21 ZINC000897506276 1125595289 /nfs/dbraw/zinc/59/52/89/1125595289.db2.gz XSZMREPTMKWGHU-AEFFLSMTSA-N 1 0 297.398 3.593 20 10 CHCDRO CC(C)([NH2+]Cc1ccccc1O)c1ccc(F)cc1F ZINC000886350552 1125673088 /nfs/dbraw/zinc/67/30/88/1125673088.db2.gz YIVUUCGGLYJYKB-UHFFFAOYSA-N 1 0 277.314 3.695 20 10 CHCDRO COc1ccc(C[NH2+]C[C@@H]2C[C@H]2c2ccccc2)cc1C ZINC000237411630 1125701866 /nfs/dbraw/zinc/70/18/66/1125701866.db2.gz PZCAEBRQYLGXMF-ROUUACIJSA-N 1 0 281.399 3.897 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCCSC1)c1ccc(N(C)C)cc1 ZINC000286859860 1125754293 /nfs/dbraw/zinc/75/42/93/1125754293.db2.gz BAWZXIUNXGOYKK-UONOGXRCSA-N 1 0 278.465 3.546 20 10 CHCDRO COc1cccc(C[N@H+]([C@H](C)c2ccco2)C2CC2)c1O ZINC000092483930 1125758760 /nfs/dbraw/zinc/75/87/60/1125758760.db2.gz PAHAUMCHAQDNEF-GFCCVEGCSA-N 1 0 287.359 3.719 20 10 CHCDRO CC[C@@H]([NH2+]CCCCCOC)c1ccc(N(C)C)cc1 ZINC000122714650 1125789075 /nfs/dbraw/zinc/78/90/75/1125789075.db2.gz YDZMALBLHBNTJR-QGZVFWFLSA-N 1 0 278.440 3.610 20 10 CHCDRO CCC[N@H+](Cc1cccs1)Cc1ccccc1O ZINC000092705068 1129405022 /nfs/dbraw/zinc/40/50/22/1129405022.db2.gz RVCFUWWWZVRIAN-UHFFFAOYSA-N 1 0 261.390 3.866 20 10 CHCDRO CC[C@@H]1CCC[C@H]1C[NH2+]Cc1ccc(OC)c(C)c1 ZINC001461514397 1129934638 /nfs/dbraw/zinc/93/46/38/1129934638.db2.gz JQWSWDVWWBKLSJ-CVEARBPZSA-N 1 0 261.409 3.920 20 10 CHCDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]Cc1cccnc1C ZINC001118808566 1131238040 /nfs/dbraw/zinc/23/80/40/1131238040.db2.gz RZYMONMLTFNMEA-WFASDCNBSA-N 1 0 282.387 3.742 20 10 CHCDRO Cc1ccccc1C[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC000302740033 1126741130 /nfs/dbraw/zinc/74/11/30/1126741130.db2.gz NEAPPETXNJMJJC-UHFFFAOYSA-N 1 0 268.404 3.693 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H](C)c2ccc(F)cc2F)c1O ZINC000158087465 1126745460 /nfs/dbraw/zinc/74/54/60/1126745460.db2.gz GQYPMHHYDBVSOR-NSHDSACASA-N 1 0 277.314 3.830 20 10 CHCDRO C[C@H]([NH2+]Cc1nc(C(C)(C)C)cs1)c1ccccc1O ZINC000179891986 1126836109 /nfs/dbraw/zinc/83/61/09/1126836109.db2.gz KEOATADWNSQFOU-NSHDSACASA-N 1 0 290.432 3.997 20 10 CHCDRO CCN(CC)c1ccc(CNc2ccccc2C[NH3+])cc1 ZINC000904485649 1126854642 /nfs/dbraw/zinc/85/46/42/1126854642.db2.gz XDCCGIWIAHCOCB-UHFFFAOYSA-N 1 0 283.419 3.604 20 10 CHCDRO COc1ccc(O)c(C[NH2+]C(C)(C)c2cccc(F)c2)c1 ZINC000182222795 1126868264 /nfs/dbraw/zinc/86/82/64/1126868264.db2.gz NFHVSZRCHHJEGL-UHFFFAOYSA-N 1 0 289.350 3.565 20 10 CHCDRO CC[C@@](C)([NH2+]Cc1cccc(C)c1O)c1nccs1 ZINC000182371447 1126870959 /nfs/dbraw/zinc/87/09/59/1126870959.db2.gz WWQXUIXTJPQBTM-OAHLLOKOSA-N 1 0 276.405 3.572 20 10 CHCDRO COc1ccc(O)c(C[NH2+]C(C)(C)c2cccc(C)c2)c1 ZINC000182419152 1126872206 /nfs/dbraw/zinc/87/22/06/1126872206.db2.gz RCDAAJHSMFUFFW-UHFFFAOYSA-N 1 0 285.387 3.734 20 10 CHCDRO CS[C@H]1CCC[C@H]([NH2+][C@H](C)c2ccccc2O)C1 ZINC000183518686 1126887503 /nfs/dbraw/zinc/88/75/03/1126887503.db2.gz QKKXJWCLJCVODL-AGIUHOORSA-N 1 0 265.422 3.717 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccccc1O ZINC000183471333 1126887893 /nfs/dbraw/zinc/88/78/93/1126887893.db2.gz BSDMQBOYDYNKFM-CQSZACIVSA-N 1 0 296.414 3.625 20 10 CHCDRO C[C@@H]([NH2+][C@@H](CCCO)c1ccccc1)c1ccccc1O ZINC000183527367 1126888492 /nfs/dbraw/zinc/88/84/92/1126888492.db2.gz IAMRWERTWKTRCU-PBHICJAKSA-N 1 0 285.387 3.557 20 10 CHCDRO C[C@@H](c1ccncc1)[N@H+](C)Cc1cccc(Cl)c1[O-] ZINC000183713554 1126890638 /nfs/dbraw/zinc/89/06/38/1126890638.db2.gz ACEJVXSPJVGJOP-NSHDSACASA-N 1 0 276.767 3.634 20 10 CHCDRO COc1cccc(O)c1C[NH2+]Cc1cc2ccccc2s1 ZINC000777452062 1126933078 /nfs/dbraw/zinc/93/30/78/1126933078.db2.gz CWWLGIHPFBXMHR-UHFFFAOYSA-N 1 0 299.395 3.905 20 10 CHCDRO CCCC[NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1 ZINC000906526359 1126957116 /nfs/dbraw/zinc/95/71/16/1126957116.db2.gz DYAJNDQEZCJXDA-UHFFFAOYSA-N 1 0 298.377 3.647 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H]2CCCNc3ccccc32)cc1 ZINC000192616256 1126962661 /nfs/dbraw/zinc/96/26/61/1126962661.db2.gz QWGQQMMHZDGYAA-IBGZPJMESA-N 1 0 295.430 3.789 20 10 CHCDRO COC[C@@H]([NH2+]Cc1ccccc1O)c1ccc(Cl)cc1 ZINC000193279475 1126967488 /nfs/dbraw/zinc/96/74/88/1126967488.db2.gz FSKOKEDXQIWCBP-OAHLLOKOSA-N 1 0 291.778 3.523 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]CCC(C)(C)C2CC2)c1 ZINC000815162104 1130963632 /nfs/dbraw/zinc/96/36/32/1130963632.db2.gz BSUGPFMLHWIADL-UHFFFAOYSA-N 1 0 277.408 3.707 20 10 CHCDRO C[C@H]1C[C@@H]([NH2+]Cc2cc(-c3ccccc3)ccc2O)CCO1 ZINC000271198802 1127072121 /nfs/dbraw/zinc/07/21/21/1127072121.db2.gz AZLQSNPHHLLBCD-KSSFIOAISA-N 1 0 297.398 3.716 20 10 CHCDRO CCC(CC)[N@H+](CC)Cc1c(C)cc(OC)cc1O ZINC001236811307 1131012078 /nfs/dbraw/zinc/01/20/78/1131012078.db2.gz OIEAYWZVDXMXHJ-UHFFFAOYSA-N 1 0 265.397 3.720 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCOC2(CCC2)C1)c1ccc(N(C)C)cc1 ZINC000271565877 1127092886 /nfs/dbraw/zinc/09/28/86/1127092886.db2.gz XWUVBCYBIGFRPS-GOEBONIOSA-N 1 0 288.435 3.505 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCc2c1cccc2F)c1ccccc1O ZINC000271669739 1127097105 /nfs/dbraw/zinc/09/71/05/1127097105.db2.gz MYOAYXJYXLVLKM-MEDUHNTESA-N 1 0 271.335 3.869 20 10 CHCDRO C[C@@H]1C[C@@H](C)C[NH+](Cc2c(O)ccc(F)c2Cl)C1 ZINC001237125458 1131055977 /nfs/dbraw/zinc/05/59/77/1131055977.db2.gz CAIZAZIZLJAFNK-NXEZZACHSA-N 1 0 271.763 3.663 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CC[C@@H](C(C)(C)C)C2)c1O ZINC000163860969 1127145510 /nfs/dbraw/zinc/14/55/10/1127145510.db2.gz DHPONHLPQVYZJZ-CQSZACIVSA-N 1 0 277.408 3.659 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]Cc1ccoc1 ZINC000168737201 1127224375 /nfs/dbraw/zinc/22/43/75/1127224375.db2.gz CBWWQHDNBKVUJE-YPMHNXCESA-N 1 0 257.333 3.632 20 10 CHCDRO CC[C@@H]1CC[C@@H]1[NH2+]Cc1c(C)c2ccccc2n1C ZINC000572790622 1127227174 /nfs/dbraw/zinc/22/71/74/1127227174.db2.gz GSMAOXKOUAESRK-HIFRSBDPSA-N 1 0 256.393 3.765 20 10 CHCDRO C[C@]1(F)CCCCN(Cc2cc(F)c(Cl)cc2O)C1 ZINC001237934198 1131153908 /nfs/dbraw/zinc/15/39/08/1131153908.db2.gz IWXMRNGSVWRJOR-AWEZNQCLSA-N 1 0 289.753 3.899 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCOC[C@H]1C)c1ccc2ccccc2c1O ZINC000287373494 1127302332 /nfs/dbraw/zinc/30/23/32/1127302332.db2.gz HYDATGNFFWOVES-IJEWVQPXSA-N 1 0 299.414 3.869 20 10 CHCDRO C[C@@H]1CC[C@H]([NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)C1 ZINC000783311312 1127363417 /nfs/dbraw/zinc/36/34/17/1127363417.db2.gz VHSHPJXETVHWJH-DCQANWLSSA-N 1 0 263.356 3.858 20 10 CHCDRO c1cc(C[NH2+]CCCC2CCCC2)cc2c1OCC2 ZINC000226180624 1127380905 /nfs/dbraw/zinc/38/09/05/1127380905.db2.gz XYOVWXSPDALUCS-UHFFFAOYSA-N 1 0 259.393 3.682 20 10 CHCDRO COc1ccc([C@H](C)[NH2+]Cc2cc(F)ccc2O)cc1F ZINC000226582999 1127412663 /nfs/dbraw/zinc/41/26/63/1127412663.db2.gz MRSPOVDWLPPERG-JTQLQIEISA-N 1 0 293.313 3.530 20 10 CHCDRO COC(C)(C)C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000168824081 1127471080 /nfs/dbraw/zinc/47/10/80/1127471080.db2.gz XHLLHUPAFGTNAS-LBPRGKRZSA-N 1 0 273.376 3.621 20 10 CHCDRO CC(C)[C@H](C[NH2+]Cc1ccccc1O)c1ccccc1 ZINC000227436418 1127478067 /nfs/dbraw/zinc/47/80/67/1127478067.db2.gz AMKFEQDIUYSPOT-KRWDZBQOSA-N 1 0 269.388 3.922 20 10 CHCDRO C[C@H]([NH2+][C@H](c1ccccc1)[C@H]1CCOC1)c1ccccc1O ZINC000360697804 1127506621 /nfs/dbraw/zinc/50/66/21/1127506621.db2.gz IYZLLBXHXMBBEW-URLQWDBASA-N 1 0 297.398 3.821 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@@](C)(O)c2ccccc2)c(O)c1 ZINC000293922963 1127534063 /nfs/dbraw/zinc/53/40/63/1127534063.db2.gz XLNJZMOEKAGHBJ-DNVCBOLYSA-N 1 0 299.414 3.567 20 10 CHCDRO Cc1cccc(C[N@@H+]2CC(C)(C)[C@@H]2c2ccncc2)c1O ZINC000294050993 1127545547 /nfs/dbraw/zinc/54/55/47/1127545547.db2.gz WZMBGAKWXKMAHF-KRWDZBQOSA-N 1 0 282.387 3.679 20 10 CHCDRO CC[C@H](CC(F)(F)F)[NH2+]Cc1cccc(C)c1O ZINC000761229920 1127553392 /nfs/dbraw/zinc/55/33/92/1127553392.db2.gz VRSJXTFNCBCRPE-LLVKDONJSA-N 1 0 261.287 3.521 20 10 CHCDRO C[C@H]1C[C@H](C(F)(F)F)CC[N@@H+]1Cc1ccccc1O ZINC000295094366 1127619565 /nfs/dbraw/zinc/61/95/65/1127619565.db2.gz UFQDSKBQSVPTJX-CMPLNLGQSA-N 1 0 273.298 3.555 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]Cc2cscc2C)c1O ZINC000229053212 1127643628 /nfs/dbraw/zinc/64/36/28/1127643628.db2.gz VFBQQEZUZNNEGQ-UHFFFAOYSA-N 1 0 297.807 3.714 20 10 CHCDRO CC[C@H]1CC[C@H](C)[N@@H+]1Cc1cc(Cl)cc(OC)c1O ZINC000229121215 1127650543 /nfs/dbraw/zinc/65/05/43/1127650543.db2.gz WEZAQJGVAMVYNT-GWCFXTLKSA-N 1 0 283.799 3.817 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H](c3ccncc3)C2)cc1 ZINC000296047779 1127661035 /nfs/dbraw/zinc/66/10/35/1127661035.db2.gz TWGRUOZOUYLELO-GOSISDBHSA-N 1 0 295.430 3.527 20 10 CHCDRO CCOc1ccc(C[NH2+][C@@H]2CCc3cccc(O)c32)cc1 ZINC000296039877 1127661263 /nfs/dbraw/zinc/66/12/63/1127661263.db2.gz QOQUPIQMOIZPRW-MRXNPFEDSA-N 1 0 283.371 3.568 20 10 CHCDRO C[C@H]([NH2+][C@@H]1C[C@@H](C)Oc2ccccc21)c1ccccc1O ZINC000296262052 1127667004 /nfs/dbraw/zinc/66/70/04/1127667004.db2.gz DHWCZCIGFIDKBN-DVOMOZLQSA-N 1 0 283.371 3.955 20 10 CHCDRO Cc1cnc([C@@H](C)C[NH2+][C@@H]2CCc3cccc(O)c32)s1 ZINC000296275605 1127667008 /nfs/dbraw/zinc/66/70/08/1127667008.db2.gz CKIFILYDWWRDMR-GXFFZTMASA-N 1 0 288.416 3.538 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]CCc1cccc3[nH]ccc31)CC2 ZINC000296296912 1127668163 /nfs/dbraw/zinc/66/81/63/1127668163.db2.gz DKHLOOMTZRYMAM-QGZVFWFLSA-N 1 0 292.382 3.693 20 10 CHCDRO COc1ccc(O)c(C[NH2+]CC[C@H](C)c2ccccc2)c1 ZINC000061910006 1127724037 /nfs/dbraw/zinc/72/40/37/1127724037.db2.gz IPGLLBYNSYJCNL-AWEZNQCLSA-N 1 0 285.387 3.684 20 10 CHCDRO C[C@@H]([NH2+]CC[C@H]1CCOC1)c1ccc2ccccc2c1O ZINC000230672527 1127771148 /nfs/dbraw/zinc/77/11/48/1127771148.db2.gz PXXDEJIQSDOXCA-KGLIPLIRSA-N 1 0 285.387 3.623 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)CC(F)(F)F)c(O)c1 ZINC000231791506 1127854334 /nfs/dbraw/zinc/85/43/34/1127854334.db2.gz PYVKAOSZCBJJSG-NXEZZACHSA-N 1 0 261.287 3.692 20 10 CHCDRO CCC[N@H+](Cc1ccccc1O)Cc1ccncc1Cl ZINC000174374074 1127889772 /nfs/dbraw/zinc/88/97/72/1127889772.db2.gz OFDIMUPKZSIBMZ-UHFFFAOYSA-N 1 0 290.794 3.853 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H](c2ccccc2)[C@@H]2CCOC2)c1 ZINC000374472280 1127900098 /nfs/dbraw/zinc/90/00/98/1127900098.db2.gz PMFHVGRNOMDROK-APWZRJJASA-N 1 0 297.398 3.568 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)CCCCO)c1ccc2ccccc2c1O ZINC000296604039 1129223716 /nfs/dbraw/zinc/22/37/16/1129223716.db2.gz VVSZALOXXDCXEV-UONOGXRCSA-N 1 0 287.403 3.747 20 10 CHCDRO CC[C@H](C[NH2+][C@@H](C)c1ccc2ccccc2c1O)OC ZINC000290214329 1127939015 /nfs/dbraw/zinc/93/90/15/1127939015.db2.gz QEBIBHBLDLMEHJ-GXTWGEPZSA-N 1 0 273.376 3.621 20 10 CHCDRO CC[C@@H](C[NH2+][C@H](C)c1ccc2ccccc2c1O)OC ZINC000290214332 1127939247 /nfs/dbraw/zinc/93/92/47/1127939247.db2.gz QEBIBHBLDLMEHJ-OCCSQVGLSA-N 1 0 273.376 3.621 20 10 CHCDRO CS[C@@H]1CCCC[C@H]1[NH2+][C@H]1CCc2cccc(O)c21 ZINC000312062995 1127976652 /nfs/dbraw/zinc/97/66/52/1127976652.db2.gz DHHUFARMNSSSSU-VNHYZAJKSA-N 1 0 277.433 3.643 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]CCCC(C)(C)C)c1 ZINC000313262950 1128112937 /nfs/dbraw/zinc/11/29/37/1128112937.db2.gz CNTDDMFISLBOEB-LBPRGKRZSA-N 1 0 265.397 3.878 20 10 CHCDRO CCC[C@H](CCO)C[NH2+][C@@H](C)c1ccc(N(C)CC)cc1 ZINC000152432250 1128123663 /nfs/dbraw/zinc/12/36/63/1128123663.db2.gz JFTFBUACDRMHOC-JKSUJKDBSA-N 1 0 292.467 3.592 20 10 CHCDRO CCC[C@H]1C[N@H+](Cc2c(O)ccc3ccccc32)CCO1 ZINC000152486424 1128128354 /nfs/dbraw/zinc/12/83/54/1128128354.db2.gz YBWVWEUMHDGABE-HNNXBMFYSA-N 1 0 285.387 3.546 20 10 CHCDRO C[C@@H]1CCC[C@@H]([NH2+]Cc2cc(Cl)ccc2O)[C@H]1C ZINC000252180556 1128129453 /nfs/dbraw/zinc/12/94/53/1128129453.db2.gz PYNDCJHKCHYMQX-UHIISALHSA-N 1 0 267.800 3.960 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CS[C@@H](C(C)C)C1 ZINC000754120394 1128196800 /nfs/dbraw/zinc/19/68/00/1128196800.db2.gz HOHVIDKUNHRWFQ-NVXWUHKLSA-N 1 0 292.492 3.681 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2CCC[C@H]2CCCF)cc1 ZINC000800965090 1128160268 /nfs/dbraw/zinc/16/02/68/1128160268.db2.gz CHLIURNXFYKROB-DOTOQJQBSA-N 1 0 278.415 3.761 20 10 CHCDRO CC(C)[C@@H]([NH2+][C@H](C)c1cc(F)ccc1O)C1CC1 ZINC000324229946 1128160508 /nfs/dbraw/zinc/16/05/08/1128160508.db2.gz GXWMJOBWRWZBDS-MEBBXXQBSA-N 1 0 251.345 3.617 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H]2CC[C@@H]2SC)cc1F ZINC000761988258 1128259324 /nfs/dbraw/zinc/25/93/24/1128259324.db2.gz ZKRPWQVGFYPMAD-HOCLYGCPSA-N 1 0 296.455 3.656 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H]2C[C@H]2C(F)(F)F)c(O)c1 ZINC000926948932 1128205173 /nfs/dbraw/zinc/20/51/73/1128205173.db2.gz LKVDUERFKPMKAU-GRYCIOLGSA-N 1 0 287.325 3.858 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](c1cnn(C)c1)C(C)C)c1ccccc1O ZINC000927071019 1128215819 /nfs/dbraw/zinc/21/58/19/1128215819.db2.gz RUWOGLPKVKMNEG-NVXWUHKLSA-N 1 0 287.407 3.564 20 10 CHCDRO CC[C@H]([NH2+][C@@H](c1cnn(C)c1)C(C)C)c1ccccc1O ZINC000927071018 1128215938 /nfs/dbraw/zinc/21/59/38/1128215938.db2.gz RUWOGLPKVKMNEG-DOTOQJQBSA-N 1 0 287.407 3.564 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C2CC2)[C@H]2CCCOC2)c1 ZINC000927068990 1128215943 /nfs/dbraw/zinc/21/59/43/1128215943.db2.gz LJWLHQOHSZWNGD-DHSIGJKJSA-N 1 0 289.419 3.556 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2cccc3c2OCC3)c(O)c1 ZINC000927090584 1128216412 /nfs/dbraw/zinc/21/64/12/1128216412.db2.gz NPJSQNBGZAYOAD-AWEZNQCLSA-N 1 0 297.398 3.795 20 10 CHCDRO Cn1cccc1C[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000153301609 1128228798 /nfs/dbraw/zinc/22/87/98/1128228798.db2.gz JQHOGWVVMKRJBV-UHFFFAOYSA-N 1 0 297.446 3.647 20 10 CHCDRO C[C@@H]([NH2+]C1CC(C)C1)c1ccc(Br)cc1O ZINC000134934292 1128234653 /nfs/dbraw/zinc/23/46/53/1128234653.db2.gz FFRSUAATSZBCKE-INWMGODYSA-N 1 0 284.197 3.604 20 10 CHCDRO C[C@@H]1CC2(CCC2)C[N@@H+]1Cc1cc2c(cc1O)CCC2 ZINC000762140520 1128273167 /nfs/dbraw/zinc/27/31/67/1128273167.db2.gz FFTRNNUIWUZICA-CYBMUJFWSA-N 1 0 271.404 3.645 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCOC[C@H]1C)c1cc(Cl)ccc1O ZINC000762650723 1128313205 /nfs/dbraw/zinc/31/32/05/1128313205.db2.gz RJKYXXXICACUCT-SWHYSGLUSA-N 1 0 283.799 3.511 20 10 CHCDRO C[C@H]1C[C@H]([NH2+]C2Cc3ccccc3C2)c2c1c(F)ccc2O ZINC000762776133 1128317754 /nfs/dbraw/zinc/31/77/54/1128317754.db2.gz CWGSATOMNRNBJG-ZBEGNZNMSA-N 1 0 297.373 3.837 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2c(O)ccc3ccccc32)C[C@H]1F ZINC000777970827 1128351027 /nfs/dbraw/zinc/35/10/27/1128351027.db2.gz WGQRSYNCWHOPDA-MLGOLLRUSA-N 1 0 273.351 3.725 20 10 CHCDRO CCC[C@@H](C)CC[C@H](C)[NH2+]CCc1ccc(O)c(O)c1 ZINC001257466690 1128452969 /nfs/dbraw/zinc/45/29/69/1128452969.db2.gz FEVAIQICHYQQEU-KGLIPLIRSA-N 1 0 279.424 3.835 20 10 CHCDRO CC(C)[N@H+](CCc1ccncc1)Cc1ccc(N(C)C)cc1 ZINC000917075493 1128474713 /nfs/dbraw/zinc/47/47/13/1128474713.db2.gz XKDRQUWFVZRWBC-UHFFFAOYSA-N 1 0 297.446 3.601 20 10 CHCDRO CCC(C)(C)CC[NH2+][C@@H](C)c1cc(OC)ccc1O ZINC000686312327 1128486977 /nfs/dbraw/zinc/48/69/77/1128486977.db2.gz VIVZEONEFAJXQH-LBPRGKRZSA-N 1 0 265.397 3.878 20 10 CHCDRO CC[N@H+](CCc1ccccc1)Cc1cc2c(cc1O)CCC2 ZINC000917466736 1128500986 /nfs/dbraw/zinc/50/09/86/1128500986.db2.gz NAVRJNJFPXZFFZ-UHFFFAOYSA-N 1 0 295.426 3.946 20 10 CHCDRO CCCCOCC[N@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000917973709 1128528581 /nfs/dbraw/zinc/52/85/81/1128528581.db2.gz YACKJGFVHZHKGA-UHFFFAOYSA-N 1 0 292.467 3.780 20 10 CHCDRO C[C@H]([NH2+]Cc1nccs1)c1ccc2ccccc2c1O ZINC000041011678 1128533663 /nfs/dbraw/zinc/53/36/63/1128533663.db2.gz DHSJLVGUSWVCNO-NSHDSACASA-N 1 0 284.384 3.853 20 10 CHCDRO CC[N@H+](Cc1ccc(OC)cc1)Cc1cc(C)ccc1O ZINC000154673058 1128540133 /nfs/dbraw/zinc/54/01/33/1128540133.db2.gz JPJBTUZBOILYRQ-UHFFFAOYSA-N 1 0 285.387 3.731 20 10 CHCDRO CC[C@H]([NH2+]CCCNc1ccccc1)c1ccccc1O ZINC000155889288 1128617490 /nfs/dbraw/zinc/61/74/90/1128617490.db2.gz CRKVSNZUPZLVLB-KRWDZBQOSA-N 1 0 284.403 3.935 20 10 CHCDRO CCO[C@H](CC[NH2+][C@@H](CC)c1ccccc1O)C(C)C ZINC000156164725 1128628810 /nfs/dbraw/zinc/62/88/10/1128628810.db2.gz MOOSWOKYJLMMEE-DOTOQJQBSA-N 1 0 279.424 3.884 20 10 CHCDRO Cn1ccc(C[N@H+](Cc2ccco2)Cc2ccccc2O)c1 ZINC000156411763 1128635735 /nfs/dbraw/zinc/63/57/35/1128635735.db2.gz AYSQEOLQOJOYDK-UHFFFAOYSA-N 1 0 296.370 3.526 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CC[C@@H](Cc2ccccc2)C1 ZINC000778995540 1128674575 /nfs/dbraw/zinc/67/45/75/1128674575.db2.gz BIVYPFZXWZREFX-HNNXBMFYSA-N 1 0 285.362 3.596 20 10 CHCDRO Oc1ccc(F)cc1C[NH+]1CCC(c2ccccc2)CC1 ZINC000778994864 1128675523 /nfs/dbraw/zinc/67/55/23/1128675523.db2.gz PNGAFSVPMFUUTR-UHFFFAOYSA-N 1 0 285.362 3.911 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CC[C@H](c2cccc(F)c2)C1 ZINC000779015862 1128681999 /nfs/dbraw/zinc/68/19/99/1128681999.db2.gz XJAYMJYMWDASGE-ZDUSSCGKSA-N 1 0 289.325 3.660 20 10 CHCDRO C[C@@H]1[C@H](c2ccccc2)CC[N@@H+]1Cc1cc(F)ccc1O ZINC000779022677 1128685115 /nfs/dbraw/zinc/68/51/15/1128685115.db2.gz FTTMQSNWRPCOEN-CXAGYDPISA-N 1 0 285.362 3.909 20 10 CHCDRO C[C@]1(c2ccccc2)CC[N@H+](Cc2cc(F)ccc2O)C1 ZINC000779022445 1128685341 /nfs/dbraw/zinc/68/53/41/1128685341.db2.gz BTCNNIBOSJUDMT-SFHVURJKSA-N 1 0 285.362 3.695 20 10 CHCDRO CCOCCC1(C[NH2+]Cc2c(O)cccc2Cl)CCC1 ZINC000130723017 1128685487 /nfs/dbraw/zinc/68/54/87/1128685487.db2.gz HJBUAYWJKIDYBD-UHFFFAOYSA-N 1 0 297.826 3.732 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccccc1O)c1ccc(OC(F)F)cc1 ZINC000134225988 1128705867 /nfs/dbraw/zinc/70/58/67/1128705867.db2.gz VPKIWPRROOPKQO-LLVKDONJSA-N 1 0 293.313 3.844 20 10 CHCDRO Clc1cnccc1NCc1ccc(N2CCCC2)cc1 ZINC000175024417 1128713760 /nfs/dbraw/zinc/71/37/60/1128713760.db2.gz SBRXXMLRMUFCBR-UHFFFAOYSA-N 1 0 287.794 3.947 20 10 CHCDRO COc1ccc(C[NH2+]C[C@H]2CCO[C@H](C(C)C)C2)cc1C ZINC000779063919 1128716334 /nfs/dbraw/zinc/71/63/34/1128716334.db2.gz CTOJHLWECDCXCX-WMZOPIPTSA-N 1 0 291.435 3.544 20 10 CHCDRO COc1cccc(C[N@H+](C(C)C)C2CCCCC2)c1O ZINC000159770447 1128726691 /nfs/dbraw/zinc/72/66/91/1128726691.db2.gz AFYYMBICYBRFKX-UHFFFAOYSA-N 1 0 277.408 3.944 20 10 CHCDRO COc1ccc(C[N@H+](C)Cc2cc(Cl)ccc2O)cc1 ZINC000159859236 1128733779 /nfs/dbraw/zinc/73/37/79/1128733779.db2.gz JYCZHPPADLWWMN-UHFFFAOYSA-N 1 0 291.778 3.686 20 10 CHCDRO COCCC1(C[NH2+]Cc2cc(C)ccc2O)CCCCC1 ZINC000185225980 1117792557 /nfs/dbraw/zinc/79/25/57/1117792557.db2.gz UOMPBSNVSYUGFY-UHFFFAOYSA-N 1 0 291.435 3.777 20 10 CHCDRO C[C@H]([NH2+]CCCOC1CCCC1)c1cc(F)ccc1O ZINC000185240765 1117797051 /nfs/dbraw/zinc/79/70/51/1117797051.db2.gz GVHARTCCQBDECV-LBPRGKRZSA-N 1 0 281.371 3.531 20 10 CHCDRO COc1ccccc1C1(C[NH2+]Cc2ccccc2O)CCC1 ZINC000185293464 1117807415 /nfs/dbraw/zinc/80/74/15/1117807415.db2.gz CYGWDJIRAZGIFK-UHFFFAOYSA-N 1 0 297.398 3.612 20 10 CHCDRO CCC1(C[NH2+][C@H](C)c2cc(OC)ccc2O)CCC1 ZINC000185666239 1117866928 /nfs/dbraw/zinc/86/69/28/1117866928.db2.gz AYGQFNFTBSIZED-GFCCVEGCSA-N 1 0 263.381 3.632 20 10 CHCDRO CSc1ccc([C@H](C)[NH2+]Cc2ccccc2O)cc1 ZINC000036994321 1117954861 /nfs/dbraw/zinc/95/48/61/1117954861.db2.gz HJQMPFUOFSCMAA-LBPRGKRZSA-N 1 0 273.401 3.965 20 10 CHCDRO CCC(=O)C(C)(C)C[N@H+](CC)Cc1ccc(N(C)C)cc1 ZINC001208921460 1117966437 /nfs/dbraw/zinc/96/64/37/1117966437.db2.gz JZSDFTWSHULKJO-UHFFFAOYSA-N 1 0 290.451 3.580 20 10 CHCDRO C[C@@H]([NH2+]C1CC=CC1)c1ccc(Br)cc1O ZINC000134929602 1118082139 /nfs/dbraw/zinc/08/21/39/1118082139.db2.gz KZRSWXJPYMHASN-SECBINFHSA-N 1 0 282.181 3.524 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccoc1C)c1ccc(N(C)C)cc1 ZINC000765395289 1118148320 /nfs/dbraw/zinc/14/83/20/1118148320.db2.gz GMKLODPUQOYGRK-KRWDZBQOSA-N 1 0 272.392 3.895 20 10 CHCDRO CC[C@H]([NH2+]CCC1(COC)CC1)c1cc(Cl)ccc1O ZINC000842890506 1118157768 /nfs/dbraw/zinc/15/77/68/1118157768.db2.gz FZAGECVBBHYOKL-AWEZNQCLSA-N 1 0 297.826 3.903 20 10 CHCDRO CC(C)(C)CC[NH2+]CCCSc1nccs1 ZINC000188031659 1128759379 /nfs/dbraw/zinc/75/93/79/1128759379.db2.gz OIQQAYHGVKIZIE-UHFFFAOYSA-N 1 0 258.456 3.651 20 10 CHCDRO Cc1ccc(O)c(C[N@H+]2CC=C(c3ccc(O)cc3)CC2)c1 ZINC000179804584 1128760797 /nfs/dbraw/zinc/76/07/97/1128760797.db2.gz MNHXQPHBZBIBMQ-UHFFFAOYSA-N 1 0 295.382 3.696 20 10 CHCDRO CS[C@@H](C)C[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000186156905 1118199531 /nfs/dbraw/zinc/19/95/31/1118199531.db2.gz IUHJRRNQKVEAJK-RYUDHWBXSA-N 1 0 279.449 3.673 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@@H]2C[C@H]2c2ccccc2)cc1C ZINC000237861382 1128765390 /nfs/dbraw/zinc/76/53/90/1128765390.db2.gz GGKSWEPOLIDSTA-WMZOPIPTSA-N 1 0 281.399 3.902 20 10 CHCDRO C[C@H](c1ccc(F)cc1)[N@H+](C)Cc1cc(F)ccc1O ZINC000179893773 1128764284 /nfs/dbraw/zinc/76/42/84/1128764284.db2.gz KZGWAULFKDECOT-LLVKDONJSA-N 1 0 277.314 3.863 20 10 CHCDRO Cc1cc([C@@H](C)[NH2+]Cc2cc(C)ccc2O)c(C)o1 ZINC000071408681 1118277966 /nfs/dbraw/zinc/27/79/66/1118277966.db2.gz IWSJEDCDABAPLH-GFCCVEGCSA-N 1 0 259.349 3.761 20 10 CHCDRO CSCC[C@H](C)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000076772016 1118284753 /nfs/dbraw/zinc/28/47/53/1118284753.db2.gz YGUDDEVHOQRZKE-HNNXBMFYSA-N 1 0 292.492 3.908 20 10 CHCDRO CCc1ccccc1C[NH2+]Cc1cc(C)ccc1O ZINC000077901658 1118285506 /nfs/dbraw/zinc/28/55/06/1118285506.db2.gz ZFPYIJGHWQTCOY-UHFFFAOYSA-N 1 0 255.361 3.553 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]CCSc1ccccc1 ZINC000083551540 1118356412 /nfs/dbraw/zinc/35/64/12/1118356412.db2.gz JRASVDVZIDRXQX-UHFFFAOYSA-N 1 0 293.819 3.928 20 10 CHCDRO Cc1cccc(C[N@H+]2C[C@H](c3ccccc3)OC[C@@H]2C)c1O ZINC000180021694 1128772412 /nfs/dbraw/zinc/77/24/12/1128772412.db2.gz LVPSTXSRHAIHQG-MAUKXSAKSA-N 1 0 297.398 3.663 20 10 CHCDRO CCC[N@H+](Cc1ccccc1)Cc1cccc(OC)c1O ZINC000160479170 1118438493 /nfs/dbraw/zinc/43/84/93/1118438493.db2.gz ZKEBVHQUWINUAK-UHFFFAOYSA-N 1 0 285.387 3.813 20 10 CHCDRO Cc1cc(C[N@@H+](C)Cc2ccc(N(C)C)cc2)oc1C ZINC001204538363 1118452503 /nfs/dbraw/zinc/45/25/03/1118452503.db2.gz BJFCPAXPWILEMN-UHFFFAOYSA-N 1 0 272.392 3.594 20 10 CHCDRO CCc1cccc(C[N@@H+]2CCS[C@@H]3CCCC[C@H]32)c1O ZINC001204542811 1118476035 /nfs/dbraw/zinc/47/60/35/1118476035.db2.gz IOVUFLHBEHDGKE-HZPDHXFCSA-N 1 0 291.460 3.815 20 10 CHCDRO CCc1cccc(C[N@@H+]2CCS[C@H]3CCCC[C@@H]32)c1O ZINC001204542809 1118476075 /nfs/dbraw/zinc/47/60/75/1118476075.db2.gz IOVUFLHBEHDGKE-HOTGVXAUSA-N 1 0 291.460 3.815 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CC(C2CC2)C2CC2)c1 ZINC000088455406 1118521158 /nfs/dbraw/zinc/52/11/58/1118521158.db2.gz XQQYKTNAPKXXMI-LBPRGKRZSA-N 1 0 259.393 3.787 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H]2CCC[C@H](CC)C2)c1O ZINC000068591627 1128786394 /nfs/dbraw/zinc/78/63/94/1128786394.db2.gz WZWVJHAGXZYZOW-DZGCQCFKSA-N 1 0 277.408 3.849 20 10 CHCDRO CSCCCCC[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000296490575 1118587146 /nfs/dbraw/zinc/58/71/46/1118587146.db2.gz POELFVOAYMAXII-CYBMUJFWSA-N 1 0 265.422 3.502 20 10 CHCDRO Cc1cccc(C(C)(C)[NH2+]Cc2ccc3c(c2)CCO3)c1 ZINC000076764053 1128788368 /nfs/dbraw/zinc/78/83/68/1128788368.db2.gz BVJVOXZBBNXAOM-UHFFFAOYSA-N 1 0 281.399 3.955 20 10 CHCDRO Cc1ccc(OC[C@@H](C)[NH2+][C@H](C)c2ccccc2O)cc1 ZINC000040499382 1118613837 /nfs/dbraw/zinc/61/38/37/1118613837.db2.gz OLIAQGPRKMBCML-HUUCEWRRSA-N 1 0 285.387 3.819 20 10 CHCDRO C[C@@H]1C[C@@H](C)C[NH+](Cc2c(O)cccc2Br)C1 ZINC000707145858 1118648037 /nfs/dbraw/zinc/64/80/37/1118648037.db2.gz JJWUYTCHYYMASP-GHMZBOCLSA-N 1 0 298.224 3.633 20 10 CHCDRO Oc1cc(Cl)ccc1C[N@@H+]1CCC[C@H]1c1cccnc1 ZINC001140461594 1118719892 /nfs/dbraw/zinc/71/98/92/1118719892.db2.gz NDGMTBCEEUTRIS-HNNXBMFYSA-N 1 0 288.778 3.778 20 10 CHCDRO CCS[C@H]1CC[C@H]([N@H+](C)Cc2cccc(C)c2O)C1 ZINC000180668014 1128801307 /nfs/dbraw/zinc/80/13/07/1128801307.db2.gz GDHRUIZDRNBNCX-GJZGRUSLSA-N 1 0 279.449 3.807 20 10 CHCDRO CCS[C@@H]1CC[C@@H]([N@H+](C)Cc2cccc(C)c2O)C1 ZINC000180668033 1128801559 /nfs/dbraw/zinc/80/15/59/1128801559.db2.gz GDHRUIZDRNBNCX-HUUCEWRRSA-N 1 0 279.449 3.807 20 10 CHCDRO COc1ccc(O)c(C[N@H+](C)C[C@@H](C)C(C)(C)C)c1 ZINC000399577595 1118950076 /nfs/dbraw/zinc/95/00/76/1118950076.db2.gz BTCKGTFBLOCSGH-GFCCVEGCSA-N 1 0 265.397 3.515 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCc3ccccc3C2)c1 ZINC000051630817 1119062034 /nfs/dbraw/zinc/06/20/34/1119062034.db2.gz DJDXTTSHSDXZLI-WMLDXEAASA-N 1 0 281.399 3.909 20 10 CHCDRO C[C@H]([NH2+]CCc1ccsc1)c1ccc(N(C)C)cc1 ZINC000049153462 1119087247 /nfs/dbraw/zinc/08/72/47/1119087247.db2.gz VEIBPKMCDORIHT-ZDUSSCGKSA-N 1 0 274.433 3.707 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCC[C@H]3CCCC[C@H]32)c1O ZINC000226156719 1119103613 /nfs/dbraw/zinc/10/36/13/1119103613.db2.gz MJZIKPXPQRHHSQ-GDBMZVCRSA-N 1 0 259.393 3.855 20 10 CHCDRO CCc1cc(OC)ccc1N1C(C)(C)CC([NH3+])CC1(C)C ZINC001167624213 1119230256 /nfs/dbraw/zinc/23/02/56/1119230256.db2.gz CNQBIELVQYSCHM-UHFFFAOYSA-N 1 0 290.451 3.742 20 10 CHCDRO CCCC[C@H](C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000050887548 1119303022 /nfs/dbraw/zinc/30/30/22/1119303022.db2.gz QCVJDUMDQVTNIL-HNNXBMFYSA-N 1 0 260.425 3.955 20 10 CHCDRO CCC[N@H+](CCc1csc(C)n1)Cc1ccccc1O ZINC000124752937 1119320694 /nfs/dbraw/zinc/32/06/94/1119320694.db2.gz GRUZKTZHAMOEIR-UHFFFAOYSA-N 1 0 290.432 3.612 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(F)cc1F)c1ccccc1O ZINC000051016582 1119360661 /nfs/dbraw/zinc/36/06/61/1119360661.db2.gz ZEMUNUIEIIEOCT-HNNXBMFYSA-N 1 0 277.314 3.911 20 10 CHCDRO CC1(C)C(C[NH2+]Cc2c(O)cccc2Cl)C1(C)C ZINC000127347493 1119362819 /nfs/dbraw/zinc/36/28/19/1119362819.db2.gz MOPHZZLUDXOSDX-UHFFFAOYSA-N 1 0 267.800 3.817 20 10 CHCDRO Cc1ccsc1C[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000092253021 1119405046 /nfs/dbraw/zinc/40/50/46/1119405046.db2.gz BEDFAGZBXISHFP-UHFFFAOYSA-N 1 0 286.444 3.947 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CC[C@@H](C)CC1)c1ccc(F)cc1[O-] ZINC000252817225 1119466872 /nfs/dbraw/zinc/46/68/72/1119466872.db2.gz XTKDPJQCGFXZLM-GVXVVHGQSA-N 1 0 251.345 3.761 20 10 CHCDRO CCSCC[C@@H](C)[NH2+][C@@H](C)c1cc(OC)ccc1O ZINC000168808087 1119479061 /nfs/dbraw/zinc/47/90/61/1119479061.db2.gz VPBHBRJHDNBSSD-NEPJUHHUSA-N 1 0 283.437 3.583 20 10 CHCDRO CC[C@H](Cc1ccccc1)[NH2+]Cc1ccccc1O ZINC000075944387 1128866108 /nfs/dbraw/zinc/86/61/08/1128866108.db2.gz FRABYLDKUJKNHC-MRXNPFEDSA-N 1 0 255.361 3.503 20 10 CHCDRO Oc1ccccc1C[N@H+](Cc1cccc(F)c1)C1CC1 ZINC000179556803 1119752029 /nfs/dbraw/zinc/75/20/29/1119752029.db2.gz MITZQWWQOQBQLL-UHFFFAOYSA-N 1 0 271.335 3.696 20 10 CHCDRO Cc1ccccc1OCCC[NH2+][C@H](C)c1ccccc1O ZINC000179874735 1119787251 /nfs/dbraw/zinc/78/72/51/1119787251.db2.gz HSPAFHYTBDKVCG-OAHLLOKOSA-N 1 0 285.387 3.820 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H](C)C2CCCCC2)c1O ZINC000052332740 1119814192 /nfs/dbraw/zinc/81/41/92/1119814192.db2.gz WZEFBBQDLIZBIM-ZDUSSCGKSA-N 1 0 277.408 3.849 20 10 CHCDRO CSCC1CCC([NH2+]Cc2cc(C)ccc2O)CC1 ZINC000295015413 1119838530 /nfs/dbraw/zinc/83/85/30/1119838530.db2.gz JWURBQCWCYCLJW-UHFFFAOYSA-N 1 0 279.449 3.712 20 10 CHCDRO CSCC1CCC([NH2+]Cc2cc(F)ccc2O)CC1 ZINC000295141746 1119864307 /nfs/dbraw/zinc/86/43/07/1119864307.db2.gz ZVDVHHBCULDEOD-UHFFFAOYSA-N 1 0 283.412 3.543 20 10 CHCDRO CCOc1ccc(C[NH2+]C2(c3ccccc3)CCC2)c(O)c1 ZINC000725850172 1119919657 /nfs/dbraw/zinc/91/96/57/1119919657.db2.gz OXFNUISMEHPCEI-UHFFFAOYSA-N 1 0 297.398 3.960 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CCC(F)(F)C1)c1ccccc1O ZINC000310933173 1119993727 /nfs/dbraw/zinc/99/37/27/1119993727.db2.gz HYLYWDQSTWIZQB-ZYHUDNBSSA-N 1 0 255.308 3.621 20 10 CHCDRO C[C@H]([NH2+]Cc1cc(F)ccc1F)c1ccc(N(C)C)cc1 ZINC000107929133 1120062596 /nfs/dbraw/zinc/06/25/96/1120062596.db2.gz ZFTYJTHYGDAHIH-LBPRGKRZSA-N 1 0 290.357 3.882 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)c1cc(F)cc(F)c1[O-])c1cncs1 ZINC000903311058 1120082099 /nfs/dbraw/zinc/08/20/99/1120082099.db2.gz MLGCMNCWRXWPHO-YUMQZZPRSA-N 1 0 284.331 3.539 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CCSC(C)C)cc1 ZINC000311655505 1120096869 /nfs/dbraw/zinc/09/68/69/1120096869.db2.gz VEXQJSKPIMKJGZ-UHFFFAOYSA-N 1 0 280.481 3.764 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCCC(F)(F)C2)c1 ZINC000695081284 1120100180 /nfs/dbraw/zinc/10/01/80/1120100180.db2.gz FHLBXTJLZRRLDM-MNOVXSKESA-N 1 0 285.334 3.629 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCCC(F)(F)C2)c(O)c1 ZINC000695125454 1120110872 /nfs/dbraw/zinc/11/08/72/1120110872.db2.gz ICGFJGDPFLDWGR-RYUDHWBXSA-N 1 0 269.335 3.929 20 10 CHCDRO Cc1ccc(O)c(C[N@H+](C)Cc2cc3ccccc3[nH]2)c1 ZINC001116445614 1120121825 /nfs/dbraw/zinc/12/18/25/1120121825.db2.gz PDKGWXITKGBDGL-UHFFFAOYSA-N 1 0 280.371 3.814 20 10 CHCDRO CO[C@@H](C[NH2+][C@@H](C)c1ccccc1O)C1CCCCC1 ZINC000695159889 1120128859 /nfs/dbraw/zinc/12/88/59/1120128859.db2.gz HHEXYGLCFPWORI-GUYCJALGSA-N 1 0 277.408 3.638 20 10 CHCDRO CC[C@H]1CCCC[N@@H+]1Cc1ccc(OC)c(Cl)c1[O-] ZINC001236808672 1128896869 /nfs/dbraw/zinc/89/68/69/1128896869.db2.gz IALIQJCLNQWDKP-LBPRGKRZSA-N 1 0 283.799 3.819 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(F)cc1 ZINC000020095285 1120195572 /nfs/dbraw/zinc/19/55/72/1120195572.db2.gz QBROXOABHOZPQV-CYBMUJFWSA-N 1 0 272.367 3.743 20 10 CHCDRO FC(F)c1cccc(C[NH2+]Cc2ccc3c(c2)CCO3)c1 ZINC001116702205 1120199076 /nfs/dbraw/zinc/19/90/76/1120199076.db2.gz AXXDURFLNTXWGB-UHFFFAOYSA-N 1 0 289.325 3.849 20 10 CHCDRO FC1(F)CCC[C@@H]([NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC000921861671 1120256868 /nfs/dbraw/zinc/25/68/68/1120256868.db2.gz YFHCYRYJTPGKDH-CQSZACIVSA-N 1 0 281.346 3.679 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+]Cc2ccsc2)c2c1c(F)ccc2O ZINC000756410184 1120325521 /nfs/dbraw/zinc/32/55/21/1120325521.db2.gz DXKDNTDKWSHADU-SKDRFNHKSA-N 1 0 277.364 3.931 20 10 CHCDRO C[C@H]([NH2+]Cc1cccc2c1OCC2)c1ccc(N(C)C)cc1 ZINC000922015851 1120336490 /nfs/dbraw/zinc/33/64/90/1120336490.db2.gz USSQSMNCVIRLQN-AWEZNQCLSA-N 1 0 296.414 3.538 20 10 CHCDRO CC(C)OCCC[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000184863386 1120364057 /nfs/dbraw/zinc/36/40/57/1120364057.db2.gz FMHBACSYSZEKBM-NSHDSACASA-N 1 0 271.788 3.511 20 10 CHCDRO C[C@H](C[NH2+]Cc1ccc2c(c1)CCCO2)CC(F)(F)F ZINC000922187019 1120454180 /nfs/dbraw/zinc/45/41/80/1120454180.db2.gz SHLVJRRTSXFJJY-NSHDSACASA-N 1 0 287.325 3.690 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@@H]1c1ccc[nH]1 ZINC000840908197 1120532386 /nfs/dbraw/zinc/53/23/86/1120532386.db2.gz PSYTVYMCUKHENE-GOSISDBHSA-N 1 0 283.419 3.726 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccccc1F)c1ccccc1O ZINC000019950295 1120549898 /nfs/dbraw/zinc/54/98/98/1120549898.db2.gz TWJLIAFOQSLKIE-HNNXBMFYSA-N 1 0 259.324 3.772 20 10 CHCDRO c1ccc([C@H]([NH2+]Cc2ccc3c(c2)CCCO3)C2CC2)nc1 ZINC000922583438 1120557547 /nfs/dbraw/zinc/55/75/47/1120557547.db2.gz XPSJKEHGGFVSEP-LJQANCHMSA-N 1 0 294.398 3.648 20 10 CHCDRO COc1ccc([C@H](C)[NH2+]Cc2ccc3c(c2)CCO3)cc1C ZINC000922672112 1120575012 /nfs/dbraw/zinc/57/50/12/1120575012.db2.gz MLZVARDWQOMYQM-AWEZNQCLSA-N 1 0 297.398 3.789 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)c2ccc(C)cc2O)cc1 ZINC000020088437 1120581994 /nfs/dbraw/zinc/58/19/94/1120581994.db2.gz CGYMWSSTPUKSSG-CYBMUJFWSA-N 1 0 271.360 3.560 20 10 CHCDRO CSC1(C[NH2+][C@H](C)c2ccc(C)cc2O)CCC1 ZINC000193806049 1120582232 /nfs/dbraw/zinc/58/22/32/1120582232.db2.gz NLNYXORYIMWKMC-GFCCVEGCSA-N 1 0 265.422 3.637 20 10 CHCDRO CC(C)CC[C@@](C)(O)C[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000756606153 1120595652 /nfs/dbraw/zinc/59/56/52/1120595652.db2.gz VXBMAZZACBQRHO-MLGOLLRUSA-N 1 0 299.842 3.883 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@H](C)[C@@H]1CCCOC1 ZINC000388463892 1120597294 /nfs/dbraw/zinc/59/72/94/1120597294.db2.gz KNPJMDMZEONUHL-TUVASFSCSA-N 1 0 289.419 3.654 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H]2CCSC3(CCC3)C2)cc1 ZINC000922843161 1120609583 /nfs/dbraw/zinc/60/95/83/1120609583.db2.gz SBGSKLFGOHCDCO-HNNXBMFYSA-N 1 0 290.476 3.661 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+][C@H]1CCSC2(CCC2)C1 ZINC000922845306 1120612736 /nfs/dbraw/zinc/61/27/36/1120612736.db2.gz LZQNCNSKDGBMHC-ZDUSSCGKSA-N 1 0 297.851 3.954 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+][C@@H]1CCCc2cccnc21 ZINC000922879230 1120617213 /nfs/dbraw/zinc/61/72/13/1120617213.db2.gz GAGKMHDGYGUTIU-CQSZACIVSA-N 1 0 288.778 3.608 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]C12CC3CC(CC(C3)C1)C2 ZINC000191443140 1128933024 /nfs/dbraw/zinc/93/30/24/1128933024.db2.gz YTTIACFTWINZIX-UHFFFAOYSA-N 1 0 275.367 3.590 20 10 CHCDRO C[C@@H](C[NH2+][C@H]1CCc2cccc(O)c21)c1ccccc1 ZINC000313529979 1120748138 /nfs/dbraw/zinc/74/81/38/1120748138.db2.gz MUEQEGMRLKXXDB-BBRMVZONSA-N 1 0 267.372 3.773 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCc2ccc(F)c(F)c2)c(O)c1 ZINC000191514519 1128942272 /nfs/dbraw/zinc/94/22/72/1128942272.db2.gz UWXNWLQUHLNCKX-GFCCVEGCSA-N 1 0 291.341 3.872 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]CCc2sccc2C)c1 ZINC000756787869 1120853507 /nfs/dbraw/zinc/85/35/07/1120853507.db2.gz SNCDEMUSXCDREV-LBPRGKRZSA-N 1 0 291.416 3.664 20 10 CHCDRO CC(C)[C@](C)(O)C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000185434106 1120911584 /nfs/dbraw/zinc/91/15/84/1120911584.db2.gz ZLSZNWIZNXLKCN-SCLBCKFNSA-N 1 0 287.403 3.603 20 10 CHCDRO Cc1cccc(C[NH2+]Cc2ccc(C3CC3)cc2)c1O ZINC000191681548 1128950817 /nfs/dbraw/zinc/95/08/17/1128950817.db2.gz GKQDSXNRRCNHRP-UHFFFAOYSA-N 1 0 267.372 3.868 20 10 CHCDRO CO[C@H](C)CC[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000273617852 1120973623 /nfs/dbraw/zinc/97/36/23/1120973623.db2.gz YCSOSONNEIMJNT-CHWSQXEVSA-N 1 0 273.376 3.621 20 10 CHCDRO CCN(C[C@@H]1CCCC[N@@H+]1C(C)C)c1ccc(OC)cc1 ZINC001167835453 1121035070 /nfs/dbraw/zinc/03/50/70/1121035070.db2.gz QQPDEMYLAHFNSK-KRWDZBQOSA-N 1 0 290.451 3.784 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@H](O)CC(C)(C)C)cc1 ZINC000766060540 1121069517 /nfs/dbraw/zinc/06/95/17/1121069517.db2.gz LZNQLYKKQCUCST-WMLDXEAASA-N 1 0 292.467 3.590 20 10 CHCDRO CCc1cnccc1[C@@H](C)[NH2+]Cc1cc(C)c(C)cc1O ZINC000773428538 1121116521 /nfs/dbraw/zinc/11/65/21/1121116521.db2.gz QCSKORQSWPSFNU-CQSZACIVSA-N 1 0 284.403 3.817 20 10 CHCDRO C[C@H]([NH2+]CCc1ccc(F)cc1)c1cc(F)ccc1O ZINC000094616589 1121215782 /nfs/dbraw/zinc/21/57/82/1121215782.db2.gz QIJLTLIEWCNQRG-NSHDSACASA-N 1 0 277.314 3.564 20 10 CHCDRO Cc1cc(F)ccc1CC[NH2+]Cc1ccc(N(C)C)cc1 ZINC000094950481 1121246863 /nfs/dbraw/zinc/24/68/63/1121246863.db2.gz SNFUKQMDGWVKPO-UHFFFAOYSA-N 1 0 286.394 3.532 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@@H+]2CC[C@H](CC(F)(F)F)C2)c1 ZINC000766116894 1121266708 /nfs/dbraw/zinc/26/67/08/1121266708.db2.gz JBZIPMLOAJAIIN-GFCCVEGCSA-N 1 0 287.325 3.783 20 10 CHCDRO CCC[NH+](CCC)Cc1c(O)ccc(F)c1Cl ZINC001237121835 1128979224 /nfs/dbraw/zinc/97/92/24/1128979224.db2.gz PVYNUVVKPUAVIO-UHFFFAOYSA-N 1 0 259.752 3.807 20 10 CHCDRO CC1(C)C[C@@H]([NH2+]Cc2ccc(Cl)cc2O)CCS1 ZINC001207675692 1121395117 /nfs/dbraw/zinc/39/51/17/1121395117.db2.gz QKJHDZSGIYGALS-LBPRGKRZSA-N 1 0 285.840 3.809 20 10 CHCDRO CCC[C@@H](C[NH2+][C@@H](CC)c1ccccc1O)OCC ZINC000705317189 1121396280 /nfs/dbraw/zinc/39/62/80/1121396280.db2.gz OZANMPOICANNHA-ZFWWWQNUSA-N 1 0 265.397 3.638 20 10 CHCDRO COc1cccc(C[NH2+]CC[C@@H]2CCC[C@@H](C)C2)c1O ZINC000070546719 1128984895 /nfs/dbraw/zinc/98/48/95/1128984895.db2.gz NPKBEOIUSFMCMZ-KGLIPLIRSA-N 1 0 277.408 3.707 20 10 CHCDRO COc1cccc(C[N@@H+]2CCC[C@H](C(C)(C)C)C2)c1O ZINC000708455664 1121465034 /nfs/dbraw/zinc/46/50/34/1121465034.db2.gz XSLWAOARBFCHHZ-AWEZNQCLSA-N 1 0 277.408 3.659 20 10 CHCDRO CCc1cccc(C[NH2+][C@@H](C)Cc2cccs2)c1O ZINC000709444813 1121471074 /nfs/dbraw/zinc/47/10/74/1121471074.db2.gz KAONWPCBYZFOPF-LBPRGKRZSA-N 1 0 275.417 3.737 20 10 CHCDRO CCOc1cccc(C[NH2+][C@H](C)CCc2ccccc2)c1O ZINC000236960170 1121527545 /nfs/dbraw/zinc/52/75/45/1121527545.db2.gz GLDGQSKDROHZOB-OAHLLOKOSA-N 1 0 299.414 3.902 20 10 CHCDRO CCCN(CCC)c1ccc(C[NH2+][C@@H]2CCCOC2)cc1 ZINC000237002433 1121595130 /nfs/dbraw/zinc/59/51/30/1121595130.db2.gz ZGTVWTXIVONDQN-QGZVFWFLSA-N 1 0 290.451 3.582 20 10 CHCDRO CSCC[C@H](C)[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC000168789000 1121610493 /nfs/dbraw/zinc/61/04/93/1121610493.db2.gz USRLCZFZKXAQQD-FRRDWIJNSA-N 1 0 279.449 3.980 20 10 CHCDRO CC[C@@H]1CCC[N@@H+]1Cc1c(O)ccc2ccc(OC)cc21 ZINC000727825267 1121750363 /nfs/dbraw/zinc/75/03/63/1121750363.db2.gz XMPMZAAUHCQWDE-CQSZACIVSA-N 1 0 285.387 3.928 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@@]2(C)CC2(C)C)c(Cl)c1 ZINC001179468541 1121882087 /nfs/dbraw/zinc/88/20/87/1121882087.db2.gz GSUDJLAFDCCUON-OAHLLOKOSA-N 1 0 267.800 3.880 20 10 CHCDRO C[C@@H](CCc1ccccc1)[N@H+](C)Cc1ccccc1O ZINC000731842773 1121888009 /nfs/dbraw/zinc/88/80/09/1121888009.db2.gz AIDZHBKQDDNZMV-HNNXBMFYSA-N 1 0 269.388 3.845 20 10 CHCDRO CCCOc1ccc(C[NH2+]C[C@H](COC)C(C)C)cc1C ZINC001179661793 1121895493 /nfs/dbraw/zinc/89/54/93/1121895493.db2.gz ABONBIZXSLKXBO-QGZVFWFLSA-N 1 0 293.451 3.792 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@H]2CCCC(C)(C)O2)c(Cl)c1 ZINC001179740362 1121904644 /nfs/dbraw/zinc/90/46/44/1121904644.db2.gz MLPQHNUJCIRWBS-GFCCVEGCSA-N 1 0 297.826 3.791 20 10 CHCDRO Oc1ccccc1C[N@H+](CCc1ccccn1)C1CCCC1 ZINC000732204799 1121912292 /nfs/dbraw/zinc/91/22/92/1121912292.db2.gz SEHPBOBRESSZFX-UHFFFAOYSA-N 1 0 296.414 3.775 20 10 CHCDRO C[C@@]1([NH2+]Cc2ccc3c(c2)CCO3)CCCc2ccccc21 ZINC000732201854 1121912470 /nfs/dbraw/zinc/91/24/70/1121912470.db2.gz PPJOMODIYIAWTF-HXUWFJFHSA-N 1 0 293.410 3.963 20 10 CHCDRO Cc1ccc(C[N@H+]2C[C@@H](C)[C@H]2c2ccccc2)c(O)c1 ZINC001180141992 1121950007 /nfs/dbraw/zinc/95/00/07/1121950007.db2.gz KFTXUQVVSIKOMQ-KDOFPFPSSA-N 1 0 267.372 3.894 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2ccc3ccccc3n2)c1 ZINC000733325634 1121975942 /nfs/dbraw/zinc/97/59/42/1121975942.db2.gz OKSIFQSWTVKXTB-UHFFFAOYSA-N 1 0 278.355 3.539 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C2(C)CCCCC2)cc1F ZINC000733326787 1121977537 /nfs/dbraw/zinc/97/75/37/1121977537.db2.gz AKGGTVKBBKCPEH-UHFFFAOYSA-N 1 0 264.388 3.704 20 10 CHCDRO CC1(c2ccccc2)CC([NH2+]Cc2ccccc2O)C1 ZINC000733326635 1121978055 /nfs/dbraw/zinc/97/80/55/1121978055.db2.gz PYIFVBAEYOCHFD-UHFFFAOYSA-N 1 0 267.372 3.602 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C[C@H]2CCc3ccccc32)cc1F ZINC000733327666 1121978155 /nfs/dbraw/zinc/97/81/55/1121978155.db2.gz AVRGSBQDGHFMRL-MRXNPFEDSA-N 1 0 298.405 3.711 20 10 CHCDRO CCC[NH+](CCC)Cc1cc(Cl)c(F)cc1[O-] ZINC001180374990 1121981578 /nfs/dbraw/zinc/98/15/78/1121981578.db2.gz AFEZZPKCFDRILF-UHFFFAOYSA-N 1 0 259.752 3.807 20 10 CHCDRO Oc1c(C[N@@H+]2CC[C@H](C3CC3)C2)ccc2ccccc21 ZINC000816516591 1122026584 /nfs/dbraw/zinc/02/65/84/1122026584.db2.gz KMHNDLSRAJGPMO-HNNXBMFYSA-N 1 0 267.372 3.777 20 10 CHCDRO COc1ccc(O)c(C[NH2+]C[C@@H]2CCC[C@H](C)[C@H]2C)c1 ZINC001181234593 1122044204 /nfs/dbraw/zinc/04/42/04/1122044204.db2.gz MMYUIUUSCMXIHT-MJBXVCDLSA-N 1 0 277.408 3.563 20 10 CHCDRO COc1cccc([C@@H](C)[N@H+](C)Cc2ccccc2O)c1 ZINC000079433193 1129033692 /nfs/dbraw/zinc/03/36/92/1129033692.db2.gz LGVCJECAYKNVIM-CYBMUJFWSA-N 1 0 271.360 3.594 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc3c(c2)OCO3)c(O)c1 ZINC000192749839 1129033727 /nfs/dbraw/zinc/03/37/27/1129033727.db2.gz AVIIXEVAVDUYQA-CHWSQXEVSA-N 1 0 299.370 3.841 20 10 CHCDRO CC[C@@H]1C[NH+](Cc2cc(C(C)C)ccc2O)C[C@@H](CC)O1 ZINC001182461949 1122165581 /nfs/dbraw/zinc/16/55/81/1122165581.db2.gz MREREULEKOYZOC-IAGOWNOFSA-N 1 0 291.435 3.905 20 10 CHCDRO COc1ccccc1[C@H]1CC[N@H+](Cc2cccc(C)c2O)C1 ZINC000271896623 1122181451 /nfs/dbraw/zinc/18/14/51/1122181451.db2.gz YGMUHIVRLBVJAI-HNNXBMFYSA-N 1 0 297.398 3.699 20 10 CHCDRO c1csc(SCCC[NH2+][C@@H]2CCCc3occc32)n1 ZINC000192880040 1129043410 /nfs/dbraw/zinc/04/34/10/1129043410.db2.gz FGOWBOAFNXGGIF-GFCCVEGCSA-N 1 0 294.445 3.886 20 10 CHCDRO CN(C)c1ccc(C[NH2+]Cc2cccc3[nH]ccc32)cc1F ZINC000237126474 1122208554 /nfs/dbraw/zinc/20/85/54/1122208554.db2.gz OYLJXURCJONYMK-UHFFFAOYSA-N 1 0 297.377 3.663 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+][C@@H]1CCC[C@@H]1c1ccccc1 ZINC001183311354 1122217135 /nfs/dbraw/zinc/21/71/35/1122217135.db2.gz APACLZLTQBVPAU-IAGOWNOFSA-N 1 0 285.362 3.957 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC[C@H]2CCO[C@H](C)C2)c(O)c1 ZINC000273386361 1122229868 /nfs/dbraw/zinc/22/98/68/1122229868.db2.gz CTMJLAVDHLXHEI-ILXRZTDVSA-N 1 0 277.408 3.556 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)cc1 ZINC000273364825 1122229976 /nfs/dbraw/zinc/22/99/76/1122229976.db2.gz DVVNMYDGYAFMRY-AWEZNQCLSA-N 1 0 285.387 3.868 20 10 CHCDRO COCC[C@@H]([NH2+][C@H](C)c1cc(C)ccc1O)c1ccco1 ZINC000273413966 1122231128 /nfs/dbraw/zinc/23/11/28/1122231128.db2.gz IIGZGODMWFLOON-UKRRQHHQSA-N 1 0 289.375 3.722 20 10 CHCDRO CC(C)[C@H]1C[C@@H]([NH2+][C@@H](C)c2cc(Cl)ccc2O)CCO1 ZINC000273482405 1122235672 /nfs/dbraw/zinc/23/56/72/1122235672.db2.gz MGVVBLHMWWBDQO-DETPVDSQSA-N 1 0 297.826 3.900 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCO[C@@H](C(C)C)C2)c(O)c1C ZINC000273538274 1122237721 /nfs/dbraw/zinc/23/77/21/1122237721.db2.gz XSXXRYZFIDFKOK-YQQAZPJKSA-N 1 0 291.435 3.863 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCc3c2cccc3O)c(O)c1 ZINC000273606058 1122240100 /nfs/dbraw/zinc/24/01/00/1122240100.db2.gz UEQZSGKFPWCZSL-LRDDRELGSA-N 1 0 283.371 3.744 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCCNc2ccccn2)c(O)c1C ZINC000273608512 1122240298 /nfs/dbraw/zinc/24/02/98/1122240298.db2.gz UYIIVZJSDXQION-HNNXBMFYSA-N 1 0 299.418 3.557 20 10 CHCDRO Cc1ncc(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)s1 ZINC000273619251 1122241521 /nfs/dbraw/zinc/24/15/21/1122241521.db2.gz YMHUZOZGNBDSIQ-NSHDSACASA-N 1 0 276.405 3.625 20 10 CHCDRO CCCCCC[C@@H](C)[NH2+]Cc1c([O-])cccc1F ZINC001183919230 1122248498 /nfs/dbraw/zinc/24/84/98/1122248498.db2.gz HMCPRUNWOACNCQ-GFCCVEGCSA-N 1 0 253.361 3.980 20 10 CHCDRO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)C[C@@H]1CCC=CO1 ZINC000774832730 1122319328 /nfs/dbraw/zinc/31/93/28/1122319328.db2.gz KUGANBKUNOCEPN-SFHVURJKSA-N 1 0 288.435 3.656 20 10 CHCDRO CC[N@H+](Cc1ccc(OC)cc1O)Cc1ccccc1F ZINC001203628544 1122364325 /nfs/dbraw/zinc/36/43/25/1122364325.db2.gz CNFSYVMQAXOMCW-UHFFFAOYSA-N 1 0 289.350 3.562 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CC[C@@H]2CCC[C@H]2C1 ZINC001203650910 1122415029 /nfs/dbraw/zinc/41/50/29/1122415029.db2.gz GEFWCXJNLALZRC-RYUDHWBXSA-N 1 0 265.784 3.668 20 10 CHCDRO C[C@@H]([NH2+]C[C@H](C)N(C)c1ccccc1)c1ccccc1O ZINC000183419223 1129053111 /nfs/dbraw/zinc/05/31/11/1129053111.db2.gz DOZBMEWVSPJCRK-LSDHHAIUSA-N 1 0 284.403 3.568 20 10 CHCDRO Cc1cccc(C)c1C[NH2+][C@H](C)c1ccccc1O ZINC000775135056 1122437676 /nfs/dbraw/zinc/43/76/76/1122437676.db2.gz CORYDFCCWROWBK-CQSZACIVSA-N 1 0 255.361 3.860 20 10 CHCDRO CCCC[C@@H](COC)N(CCC)c1ccc(C[NH3+])cc1 ZINC000775141016 1122440393 /nfs/dbraw/zinc/44/03/93/1122440393.db2.gz TZJNYMNDHLQBRZ-KRWDZBQOSA-N 1 0 278.440 3.567 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(Cl)s2)c1 ZINC000071306635 1129055776 /nfs/dbraw/zinc/05/57/76/1129055776.db2.gz XTEDCAOYZHXDDU-VIFPVBQESA-N 1 0 297.807 3.967 20 10 CHCDRO C[C@@H]([NH2+]Cc1cc(-c2ccccc2)on1)c1ccccc1O ZINC000183481019 1129057927 /nfs/dbraw/zinc/05/79/27/1129057927.db2.gz PGKBCLWVLUHGIT-CYBMUJFWSA-N 1 0 294.354 3.898 20 10 CHCDRO C[C@H]([NH2+]Cc1cccnc1Cl)c1ccc(N(C)C)cc1 ZINC000775363331 1122528610 /nfs/dbraw/zinc/52/86/10/1122528610.db2.gz MVRGCSRWHVKKSN-LBPRGKRZSA-N 1 0 289.810 3.652 20 10 CHCDRO C[C@H]1CCC[C@H](C)[N@H+](Cc2ccc(N(C)C)cc2)C1 ZINC001191068039 1122567870 /nfs/dbraw/zinc/56/78/70/1122567870.db2.gz AIMOLYJGAOLHCH-GJZGRUSLSA-N 1 0 260.425 3.763 20 10 CHCDRO C[C@@H]1CCC[C@H](C)[N@H+](Cc2ccc(N(C)C)cc2)C1 ZINC001191068038 1122568394 /nfs/dbraw/zinc/56/83/94/1122568394.db2.gz AIMOLYJGAOLHCH-CABCVRRESA-N 1 0 260.425 3.763 20 10 CHCDRO CC[C@H]1C[C@@H](C)C[N@@H+]1Cc1ccc(N(C)CC)cc1 ZINC001191232479 1122586689 /nfs/dbraw/zinc/58/66/89/1122586689.db2.gz IAEMVYMARYNBJA-ZBFHGGJFSA-N 1 0 260.425 3.763 20 10 CHCDRO CCOCCCC[NH2+][C@@H](CC)c1cc(Cl)ccc1O ZINC000775491320 1122622635 /nfs/dbraw/zinc/62/26/35/1122622635.db2.gz IDQZJHDMGDWAGZ-AWEZNQCLSA-N 1 0 285.815 3.903 20 10 CHCDRO CC[C@H]([NH2+]Cc1nccs1)c1cc(Cl)ccc1O ZINC000775494107 1122625020 /nfs/dbraw/zinc/62/50/20/1122625020.db2.gz YCSVTPJXQNXXTH-NSHDSACASA-N 1 0 282.796 3.743 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1cnn(C(C)C)c1)c1ccccc1O ZINC000775503422 1122630721 /nfs/dbraw/zinc/63/07/21/1122630721.db2.gz IGQHUXGUUJAFGR-BBRMVZONSA-N 1 0 287.407 3.972 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1cnn(C(C)C)c1)c1ccccc1O ZINC000775503423 1122630927 /nfs/dbraw/zinc/63/09/27/1122630927.db2.gz IGQHUXGUUJAFGR-CJNGLKHVSA-N 1 0 287.407 3.972 20 10 CHCDRO CC[C@H]([NH2+]CC[C@@H](C)OC)c1cc(Cl)ccc1O ZINC000775502531 1122631393 /nfs/dbraw/zinc/63/13/93/1122631393.db2.gz XGOQMAQCLLBVEV-MFKMUULPSA-N 1 0 271.788 3.511 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1C[C@](C)(OC)C1(C)C)c1ccccc1O ZINC000775513166 1122633538 /nfs/dbraw/zinc/63/35/38/1122633538.db2.gz OONHHJIOUSRLHJ-LXZKKBNFSA-N 1 0 277.408 3.637 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccncc1)c1cc(Cl)ccc1O ZINC000775513764 1122634695 /nfs/dbraw/zinc/63/46/95/1122634695.db2.gz MASMYCWACJZPSR-HNNXBMFYSA-N 1 0 290.794 3.724 20 10 CHCDRO CC[C@H]([NH2+][C@H](CO)CC(C)(C)C)c1cc(Cl)ccc1O ZINC000775522609 1122639858 /nfs/dbraw/zinc/63/98/58/1122639858.db2.gz VPWFPNUDJNTOBV-JSGCOSHPSA-N 1 0 299.842 3.883 20 10 CHCDRO CC[C@H]([NH2+]Cc1cnn(CC)c1)c1cc(Cl)ccc1O ZINC000775524427 1122642592 /nfs/dbraw/zinc/64/25/92/1122642592.db2.gz PZJCDCFSJNHCRG-AWEZNQCLSA-N 1 0 293.798 3.503 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CC[C@@H](C(C)(C)C)C2)cc1 ZINC001192481863 1122649361 /nfs/dbraw/zinc/64/93/61/1122649361.db2.gz QXPOPQQWZZCIBO-OAHLLOKOSA-N 1 0 260.425 3.621 20 10 CHCDRO Cc1cc(C[NH2+]C[C@@H]2C[C@@H]2C)c(C)n1-c1ccccc1 ZINC000159037488 1122770046 /nfs/dbraw/zinc/77/00/46/1122770046.db2.gz FXBRBULNQFAPKB-BBRMVZONSA-N 1 0 268.404 3.840 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2nc(C)cs2)c1 ZINC000080273396 1129079487 /nfs/dbraw/zinc/07/94/87/1129079487.db2.gz IIBXYNQPVZSJSB-GHMZBOCLSA-N 1 0 292.404 3.578 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cccc(C)c1O ZINC000775636796 1122842749 /nfs/dbraw/zinc/84/27/49/1122842749.db2.gz HAALRZPBMLJBRP-UHFFFAOYSA-N 1 0 298.430 3.789 20 10 CHCDRO CCC[N@H+](Cc1ccccc1)Cc1cc(OC)ccc1O ZINC000775643425 1122852408 /nfs/dbraw/zinc/85/24/08/1122852408.db2.gz XSKHOBPDLSFSOC-UHFFFAOYSA-N 1 0 285.387 3.813 20 10 CHCDRO COc1ccc(O)c(C[N@H+](C)[C@H]2CCCc3ccccc32)c1 ZINC000775646190 1122853972 /nfs/dbraw/zinc/85/39/72/1122853972.db2.gz HQQBSSFIESPHJW-SFHVURJKSA-N 1 0 297.398 3.910 20 10 CHCDRO Cc1ccc(C)n1C1CC[NH+](Cc2cccc(C)c2O)CC1 ZINC000775668176 1122881152 /nfs/dbraw/zinc/88/11/52/1122881152.db2.gz SVHNVLGGPAVTHX-UHFFFAOYSA-N 1 0 298.430 3.956 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CCC2(C1)CCOCC2 ZINC000266444520 1129086068 /nfs/dbraw/zinc/08/60/68/1129086068.db2.gz MQLUHUIZHOFQGL-UHFFFAOYSA-N 1 0 297.398 3.548 20 10 CHCDRO Cc1cccc(C[N@@H+]2CC[C@@H](Cc3ccc(F)cc3)C2)c1O ZINC000775698992 1122912173 /nfs/dbraw/zinc/91/21/73/1122912173.db2.gz WXYBTZICQABJNJ-INIZCTEOSA-N 1 0 299.389 3.904 20 10 CHCDRO Cc1cc(Cl)cc(C[NH+]2CCC(C(F)F)CC2)c1O ZINC000775701698 1122913838 /nfs/dbraw/zinc/91/38/38/1122913838.db2.gz VVPKIKYHOHIKQI-UHFFFAOYSA-N 1 0 289.753 3.831 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+](C)CCCOC(C)C)c1O ZINC000775708216 1122916090 /nfs/dbraw/zinc/91/60/90/1122916090.db2.gz AJTGBUPADDMQPU-UHFFFAOYSA-N 1 0 285.815 3.601 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CC[C@@H](c3ccccc3)[C@H]2C)c1 ZINC000775723021 1122924499 /nfs/dbraw/zinc/92/44/99/1122924499.db2.gz BNKFRYHACYFYLN-RDTXWAMCSA-N 1 0 297.398 3.779 20 10 CHCDRO CSC[C@@H]1CCC[N@@H+]1Cc1cc(Cl)cc(C)c1O ZINC000775724828 1122926183 /nfs/dbraw/zinc/92/61/83/1122926183.db2.gz RDAOTVLLRSWCQW-ZDUSSCGKSA-N 1 0 285.840 3.681 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+]2CC[C@H](OCC(C)C)C2)c1O ZINC000775737449 1122928571 /nfs/dbraw/zinc/92/85/71/1122928571.db2.gz HGFXAOBDWUZTNV-HNNXBMFYSA-N 1 0 297.826 3.601 20 10 CHCDRO CC(C)C[NH2+]Cc1ccc2c(c1)CCN2Cc1ccccc1 ZINC001198970455 1123017239 /nfs/dbraw/zinc/01/72/39/1123017239.db2.gz WVGQDIHHNPILDJ-UHFFFAOYSA-N 1 0 294.442 3.995 20 10 CHCDRO C[C@@H](CO)C[N@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000776002600 1123034655 /nfs/dbraw/zinc/03/46/55/1123034655.db2.gz GGWQZZKIGGHXHD-CVEARBPZSA-N 1 0 299.414 3.584 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCn3cccc3[C@H]2C)cc1 ZINC001203942460 1123041637 /nfs/dbraw/zinc/04/16/37/1123041637.db2.gz RFKUMPNIGOWQMR-MRXNPFEDSA-N 1 0 297.446 3.911 20 10 CHCDRO Cc1cccc(C[NH2+]Cc2ccc([C@H]3C[C@H]3C)o2)c1O ZINC000776024907 1123041774 /nfs/dbraw/zinc/04/17/74/1123041774.db2.gz ZVDBXACNYQXJJY-DOMZBBRYSA-N 1 0 271.360 3.707 20 10 CHCDRO CCOc1ccccc1C[NH2+]Cc1cccc(Cl)c1[O-] ZINC000776038941 1123050837 /nfs/dbraw/zinc/05/08/37/1123050837.db2.gz OBDFJVMFUWHXOQ-UHFFFAOYSA-N 1 0 291.778 3.734 20 10 CHCDRO Cc1cc(Br)cc(C[NH2+][C@@H](C)C2(C)CC2)c1O ZINC000776068217 1123052689 /nfs/dbraw/zinc/05/26/89/1123052689.db2.gz HEYNVVCDAWEHAI-JTQLQIEISA-N 1 0 298.224 3.741 20 10 CHCDRO COc1cccc(Cl)c1C[NH2+]Cc1cc(C)ccc1O ZINC000188280246 1123056630 /nfs/dbraw/zinc/05/66/30/1123056630.db2.gz RDBDTNZBPKSOMF-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO Cc1ccc2c(CC[NH2+]Cc3cccc(C)c3O)c[nH]c2c1 ZINC000776151464 1123084480 /nfs/dbraw/zinc/08/44/80/1123084480.db2.gz PAFIGIXCNSCRND-UHFFFAOYSA-N 1 0 294.398 3.823 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+][C@H]2CCc3ccc(C)cc32)c1 ZINC000776174353 1123102660 /nfs/dbraw/zinc/10/26/60/1123102660.db2.gz JSLBABMSNRQORV-SFHVURJKSA-N 1 0 297.398 3.876 20 10 CHCDRO CC[C@H](C)C[N@@H+]1CCc2c(c3cc(OC)ccc3n2C)C1 ZINC001201511337 1123113831 /nfs/dbraw/zinc/11/38/31/1123113831.db2.gz JIELUBMRVDDWHH-ZDUSSCGKSA-N 1 0 286.419 3.591 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000846108293 1123146723 /nfs/dbraw/zinc/14/67/23/1123146723.db2.gz OHZLJXOEWGRYEP-CYBMUJFWSA-N 1 0 287.737 3.667 20 10 CHCDRO Cc1cc(Br)cc(C[NH2+]CCC2CCC2)c1O ZINC000776251770 1123179729 /nfs/dbraw/zinc/17/97/29/1123179729.db2.gz ZOLCPMOMZFIFNL-UHFFFAOYSA-N 1 0 298.224 3.743 20 10 CHCDRO C[C@H]1CC[C@H](C[NH2+]Cc2cc(F)c(N(C)C)cc2F)C1 ZINC001202251577 1123190344 /nfs/dbraw/zinc/19/03/44/1123190344.db2.gz SINODEPRDJGXRD-RYUDHWBXSA-N 1 0 282.378 3.557 20 10 CHCDRO CC(F)(F)C(C)(C)C[NH2+]Cc1cc(Cl)ccc1O ZINC000696588086 1123216455 /nfs/dbraw/zinc/21/64/55/1123216455.db2.gz XFVARQRHSCAOMT-UHFFFAOYSA-N 1 0 277.742 3.817 20 10 CHCDRO COc1cc(C[NH2+][C@@H]2C[C@H]3C[C@H]3C2)c(O)c(C(C)(C)C)c1 ZINC000850334801 1123253965 /nfs/dbraw/zinc/25/39/65/1123253965.db2.gz NDULISSWRQVJHL-DABQJJPHSA-N 1 0 289.419 3.586 20 10 CHCDRO COc1cc(C[NH2+][C@@H]2C=CCC2)c(O)c(C(C)(C)C)c1 ZINC000850359895 1123256889 /nfs/dbraw/zinc/25/68/89/1123256889.db2.gz VPFCRPPQBBKKEH-CYBMUJFWSA-N 1 0 275.392 3.507 20 10 CHCDRO COCc1csc(C[NH2+]Cc2cc(C)c(C)cc2O)c1 ZINC000850377830 1123260499 /nfs/dbraw/zinc/26/04/99/1123260499.db2.gz PUTCPWGKEVQTCM-UHFFFAOYSA-N 1 0 291.416 3.507 20 10 CHCDRO c1cc(CC[NH2+]Cc2ccc(N3CCCCC3)cc2)co1 ZINC000850376528 1123260569 /nfs/dbraw/zinc/26/05/69/1123260569.db2.gz JFLFEUOAOQJIEK-UHFFFAOYSA-N 1 0 284.403 3.602 20 10 CHCDRO CCCC(C)(C)[NH2+]Cc1cc(Cl)cc(OC)c1O ZINC000169086560 1123264619 /nfs/dbraw/zinc/26/46/19/1123264619.db2.gz BSQOGASOAFWNSQ-UHFFFAOYSA-N 1 0 271.788 3.723 20 10 CHCDRO Cc1cccc2c1CCC[C@@H]2[NH2+]Cc1ccccc1O ZINC000850411684 1123264697 /nfs/dbraw/zinc/26/46/97/1123264697.db2.gz IGMWPDFRSHBHOV-KRWDZBQOSA-N 1 0 267.372 3.868 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cc2cnccc2o1 ZINC000850422672 1123265381 /nfs/dbraw/zinc/26/53/81/1123265381.db2.gz ZECGKORTTCRSIF-ZDUSSCGKSA-N 1 0 295.386 3.745 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cc2cnccc2o1 ZINC000850422671 1123265539 /nfs/dbraw/zinc/26/55/39/1123265539.db2.gz ZECGKORTTCRSIF-CYBMUJFWSA-N 1 0 295.386 3.745 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cc2cnccc2o1 ZINC000850431086 1123266009 /nfs/dbraw/zinc/26/60/09/1123266009.db2.gz YTXYDBWTSNQTKU-LBPRGKRZSA-N 1 0 294.354 3.614 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](C)c2ccccn2)c(O)c1C ZINC000850482021 1123273546 /nfs/dbraw/zinc/27/35/46/1123273546.db2.gz MAIZCGBUWFTVBX-UKRRQHHQSA-N 1 0 284.403 3.858 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@H]2CCN2C(C)(C)C)c(O)c1 ZINC000850482852 1123274562 /nfs/dbraw/zinc/27/45/62/1123274562.db2.gz VGUXKGVUTZFDTE-HUUCEWRRSA-N 1 0 290.451 3.532 20 10 CHCDRO CCC(O)(CC)C(C)(C)C[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000850501861 1123275321 /nfs/dbraw/zinc/27/53/21/1123275321.db2.gz QIQNEGOCHFUPJT-AWEZNQCLSA-N 1 0 293.451 3.929 20 10 CHCDRO C[C@H]([NH2+]CCCOC(C)(C)C)c1cc(Cl)ccc1O ZINC000850526946 1123282059 /nfs/dbraw/zinc/28/20/59/1123282059.db2.gz UBQVJZQBVBYWDX-NSHDSACASA-N 1 0 285.815 3.901 20 10 CHCDRO CC[C@@H]([NH2+]CCCOC(C)(C)C)c1ccc(C)cc1O ZINC000850527475 1123282730 /nfs/dbraw/zinc/28/27/30/1123282730.db2.gz XTSOTUGXDSEFJB-OAHLLOKOSA-N 1 0 279.424 3.947 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCC[C@@H](C)O1)c1ccc(Cl)cc1O ZINC000850534041 1123285878 /nfs/dbraw/zinc/28/58/78/1123285878.db2.gz FSZRHRKZCGTOOB-MDZLAQPJSA-N 1 0 283.799 3.654 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCC[C@H](C)O1)c1ccc(C)cc1O ZINC000850535017 1123286018 /nfs/dbraw/zinc/28/60/18/1123286018.db2.gz PQYKJGHNNSGSSF-DZKIICNBSA-N 1 0 277.408 3.699 20 10 CHCDRO COCc1csc(C[NH2+][C@@H](C)c2ccc(C)cc2O)c1 ZINC000850533340 1123286403 /nfs/dbraw/zinc/28/64/03/1123286403.db2.gz WEKCIBBABLBZNH-LBPRGKRZSA-N 1 0 291.416 3.759 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+]C[C@]2(C)CC2(F)F)c2c1c(F)ccc2O ZINC000850536505 1123286907 /nfs/dbraw/zinc/28/69/07/1123286907.db2.gz KQRKDTWTGOFUOB-YACGNSKGSA-N 1 0 285.309 3.715 20 10 CHCDRO C[C@H]1C[C@H]([NH2+]C[C@H]2CCC[C@@H](C)O2)c2c1c(F)ccc2O ZINC000850535691 1123287342 /nfs/dbraw/zinc/28/73/42/1123287342.db2.gz ZHMZGIAWAPVMPB-SFTQSGBHSA-N 1 0 293.382 3.627 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1C(C)(C)C1(F)F)c1ccc(Cl)cc1O ZINC000850553199 1123290042 /nfs/dbraw/zinc/29/00/42/1123290042.db2.gz TZJMQSLDDJEHIC-PELKAZGASA-N 1 0 289.753 3.988 20 10 CHCDRO CC[C@@H]([NH2+]CC1SCCS1)c1ccc(N(C)C)cc1 ZINC000850559767 1123291626 /nfs/dbraw/zinc/29/16/26/1123291626.db2.gz GCWTWOITQDZCRK-CQSZACIVSA-N 1 0 296.505 3.599 20 10 CHCDRO C[C@@H]([NH2+]CC1SCCS1)c1cc(Cl)ccc1O ZINC000850560215 1123291737 /nfs/dbraw/zinc/29/17/37/1123291737.db2.gz JQNZOQJAORAPGT-MRVPVSSYSA-N 1 0 289.853 3.502 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@H]2CCOC2(C)C)c1O ZINC000850570410 1123294325 /nfs/dbraw/zinc/29/43/25/1123294325.db2.gz GYLIRWZCUDAAAC-NWDGAFQWSA-N 1 0 297.826 3.820 20 10 CHCDRO Oc1ccc(-c2ccccc2)cc1C[NH2+][C@@H]1CCCOCC1 ZINC000776498223 1123305290 /nfs/dbraw/zinc/30/52/90/1123305290.db2.gz OCHFXENBEXUYGA-GOSISDBHSA-N 1 0 297.398 3.718 20 10 CHCDRO CC(C)C[N@H+](Cc1cc2c(cc1O)OCO2)C1CCCC1 ZINC000110362239 1123395258 /nfs/dbraw/zinc/39/52/58/1123395258.db2.gz VCTXTUDMHLSPNL-UHFFFAOYSA-N 1 0 291.391 3.522 20 10 CHCDRO COc1cccc(C[NH2+][C@@]2(c3ccccc3)CC2(C)C)c1O ZINC000853091209 1123424166 /nfs/dbraw/zinc/42/41/66/1123424166.db2.gz ANMAPJFRMSYHMP-LJQANCHMSA-N 1 0 297.398 3.816 20 10 CHCDRO COc1cccc(C[C@@H](C)[NH2+][C@H](C)c2ccccc2O)c1 ZINC000783521095 1123470135 /nfs/dbraw/zinc/47/01/35/1123470135.db2.gz DTRMFCIBIJBMAS-ZIAGYGMSSA-N 1 0 285.387 3.683 20 10 CHCDRO CCC(CC)[C@H](CC[NH2+][C@@H](C)c1ccccc1O)OC ZINC000783519322 1123470308 /nfs/dbraw/zinc/47/03/08/1123470308.db2.gz RLSZAXGZBUUYSB-GUYCJALGSA-N 1 0 279.424 3.884 20 10 CHCDRO CCN1CCC([NH2+][C@H](C)c2ccc3ccccc3c2O)CC1 ZINC000273440200 1129125820 /nfs/dbraw/zinc/12/58/20/1129125820.db2.gz YHGWRJCCBPZMBT-CQSZACIVSA-N 1 0 298.430 3.680 20 10 CHCDRO CC[C@H]1COCC[N@@H+]1Cc1cc(C)cc(C(C)(C)C)c1O ZINC000738084048 1123518199 /nfs/dbraw/zinc/51/81/99/1123518199.db2.gz JTGDMTKJTTWKLK-HNNXBMFYSA-N 1 0 291.435 3.609 20 10 CHCDRO CC[C@@H]([NH2+]CCOC(C)(C)C)c1ccc(N(C)C)cc1 ZINC000776889959 1123564023 /nfs/dbraw/zinc/56/40/23/1123564023.db2.gz NXINAEISHCYATH-MRXNPFEDSA-N 1 0 278.440 3.608 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H](C(F)(F)F)C2)cc1 ZINC000194155225 1129130856 /nfs/dbraw/zinc/13/08/56/1129130856.db2.gz WFMYSGLJMLICFC-CYBMUJFWSA-N 1 0 286.341 3.527 20 10 CHCDRO COc1ccc(F)c(C[NH2+][C@H](C)c2ccc(C)cc2O)c1 ZINC000857082000 1123585968 /nfs/dbraw/zinc/58/59/68/1123585968.db2.gz SGKYCUQNROMBRB-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CC(C)(C)CCOC)cc1 ZINC000183940674 1129132438 /nfs/dbraw/zinc/13/24/38/1129132438.db2.gz YUYSLCHKRLORLS-OAHLLOKOSA-N 1 0 292.467 3.856 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1cc(F)ccc1F ZINC000115629236 1123619864 /nfs/dbraw/zinc/61/98/64/1123619864.db2.gz UUKPAMLCSLZBOM-UHFFFAOYSA-N 1 0 290.357 3.629 20 10 CHCDRO Cc1ccc(C)c(C[NH2+]Cc2cc(C)ccc2O)c1 ZINC000858237830 1123639060 /nfs/dbraw/zinc/63/90/60/1123639060.db2.gz QUHODTZVMXNPLQ-UHFFFAOYSA-N 1 0 255.361 3.607 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2ccc(C)c(Cl)c2)c1 ZINC000858238937 1123639405 /nfs/dbraw/zinc/63/94/05/1123639405.db2.gz FHVJREVZJJPKLM-UHFFFAOYSA-N 1 0 275.779 3.952 20 10 CHCDRO C[C@H]([NH2+][C@H]1CO[C@H](C2CC2)C1)c1ccc2ccccc2c1O ZINC000858548963 1123661676 /nfs/dbraw/zinc/66/16/76/1123661676.db2.gz YCUWOITWIIHLAO-PNPHSEOMSA-N 1 0 297.398 3.764 20 10 CHCDRO C[C@H]([NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F)c1ccns1 ZINC000858576478 1123664540 /nfs/dbraw/zinc/66/45/40/1123664540.db2.gz KXHPPLUUAYRLAX-YWVKMMECSA-N 1 0 292.379 3.887 20 10 CHCDRO CO[C@H]1C[C@H]([NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)C1 ZINC000858587093 1123665407 /nfs/dbraw/zinc/66/54/07/1123665407.db2.gz ZYACNOPKHLHOGQ-QGPMSJSTSA-N 1 0 288.435 3.505 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]C[C@@H]1CCC2(CCCC2)O1 ZINC000691828604 1123694471 /nfs/dbraw/zinc/69/44/71/1123694471.db2.gz AOKYUNSZQLFIMI-AWEZNQCLSA-N 1 0 295.810 3.627 20 10 CHCDRO CCCN(Cc1ccsc1)c1ccc(C[NH3+])cc1 ZINC000194981586 1129140293 /nfs/dbraw/zinc/14/02/93/1129140293.db2.gz RVHVLSVRAZNIRF-UHFFFAOYSA-N 1 0 260.406 3.623 20 10 CHCDRO CCCN(Cc1cccc(C)c1O)c1ccc(C[NH3+])cc1 ZINC000194981543 1129140832 /nfs/dbraw/zinc/14/08/32/1129140832.db2.gz OLPBVACCJVJHQB-UHFFFAOYSA-N 1 0 284.403 3.576 20 10 CHCDRO COc1cccc(C[N@@H+]2CCc3c(C)cc(C)cc3C2)c1O ZINC000777220427 1123785570 /nfs/dbraw/zinc/78/55/70/1123785570.db2.gz QYQPDLCBCVOKOJ-UHFFFAOYSA-N 1 0 297.398 3.576 20 10 CHCDRO C[C@H](CCCc1cccnc1)[NH2+][C@H](C)c1ccccc1O ZINC000840772482 1123789736 /nfs/dbraw/zinc/78/97/36/1123789736.db2.gz UPZJMJBJUGXCCH-HUUCEWRRSA-N 1 0 284.403 3.849 20 10 CHCDRO Cc1ncc(C[NH2+]Cc2ccc(N3CCC(C)CC3)cc2)o1 ZINC000862276803 1123797211 /nfs/dbraw/zinc/79/72/11/1123797211.db2.gz DXSRIONWUKCLJE-UHFFFAOYSA-N 1 0 299.418 3.509 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH+]2CC(Cc3ccco3)C2)cc1 ZINC000862487157 1123813853 /nfs/dbraw/zinc/81/38/53/1123813853.db2.gz NNCPCZFUAIJKCA-HWKANZROSA-N 1 0 296.414 3.533 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]C[C@]2(C)C[C@H]3C[C@H]3C2)c1O ZINC000862527779 1123815540 /nfs/dbraw/zinc/81/55/40/1123815540.db2.gz GGYJUPQUFZKDNC-CULMDFNYSA-N 1 0 295.810 3.580 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CC[C@@H](c3ccc(O)cc3)C2)cc1C ZINC000862540819 1123817804 /nfs/dbraw/zinc/81/78/04/1123817804.db2.gz KOJWCEPTDBEEHW-MRXNPFEDSA-N 1 0 297.398 3.704 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCC[C@@H]2C[C@@H]21)c1ccc(C)cc1O ZINC000840819125 1123827944 /nfs/dbraw/zinc/82/79/44/1123827944.db2.gz FDJPVAWDBGYCRH-OEAJRASXSA-N 1 0 259.393 3.930 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccn(C)n1)c1ccc2ccccc2c1O ZINC000840818791 1123828029 /nfs/dbraw/zinc/82/80/29/1123828029.db2.gz ZQLLANPEGMAJGC-OLZOCXBDSA-N 1 0 295.386 3.691 20 10 CHCDRO CC[C@H]([NH2+]CCCCSC)c1ccccc1O ZINC000119186770 1123835189 /nfs/dbraw/zinc/83/51/89/1123835189.db2.gz HXYUDUWATIWWEW-ZDUSSCGKSA-N 1 0 253.411 3.576 20 10 CHCDRO Cc1cc(C)c(O)c(C[NH+]2C[C@@H](C)C(F)(F)[C@H](C)C2)c1 ZINC000863274028 1123857418 /nfs/dbraw/zinc/85/74/18/1123857418.db2.gz GYNJFEUEYLVXCA-CHWSQXEVSA-N 1 0 283.362 3.732 20 10 CHCDRO C[C@@H](C[NH2+]Cc1c(O)cccc1Cl)c1ccccc1 ZINC000083551386 1129150119 /nfs/dbraw/zinc/15/01/19/1129150119.db2.gz QPXYQKCDVYLZEM-LBPRGKRZSA-N 1 0 275.779 3.939 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CC(C)(C)OCC2CC2)c1 ZINC000840875474 1123888265 /nfs/dbraw/zinc/88/82/65/1123888265.db2.gz FOYXUHGYSHAWLI-ZDUSSCGKSA-N 1 0 277.408 3.556 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@H+]2CC[C@@H](C(F)(F)F)[C@@H]2C)c1 ZINC000794654507 1123925027 /nfs/dbraw/zinc/92/50/27/1123925027.db2.gz CSDUHSSWUPNHKO-WCQYABFASA-N 1 0 287.325 3.782 20 10 CHCDRO Oc1cc2c(cc1C[NH+]1CCC(F)(F)CC1)CCCC2 ZINC000794687161 1123927457 /nfs/dbraw/zinc/92/74/57/1123927457.db2.gz VUPINUCESPZIOH-UHFFFAOYSA-N 1 0 281.346 3.502 20 10 CHCDRO CC[C@@H]([NH2+]CCc1nc(C)cs1)c1ccc(C)cc1O ZINC000794793739 1123951821 /nfs/dbraw/zinc/95/18/21/1123951821.db2.gz BPEFGLFQKNTQDS-CQSZACIVSA-N 1 0 290.432 3.749 20 10 CHCDRO CC[C@H]([NH2+]C[C@]1(C)CCCC[C@H]1O)c1ccc(C)cc1O ZINC000794806279 1123955380 /nfs/dbraw/zinc/95/53/80/1123955380.db2.gz ZSUJAZFQANNXRN-JQHSSLGASA-N 1 0 291.435 3.683 20 10 CHCDRO CC[C@@H]([NH2+]C[C@](C)(O)c1ccccc1)c1ccc(C)cc1O ZINC000794807842 1123956493 /nfs/dbraw/zinc/95/64/93/1123956493.db2.gz MBYBKNIVYVBEMV-MJGOQNOKSA-N 1 0 299.414 3.649 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1C[C@@H](OC)C1(C)C)c1ccc(C)cc1O ZINC000794811599 1123956503 /nfs/dbraw/zinc/95/65/03/1123956503.db2.gz RYQZJEBRNGMCRG-NUEKZKHPSA-N 1 0 277.408 3.555 20 10 CHCDRO CC[C@H]([NH2+]CCc1cnc(C)s1)c1ccc(C)cc1O ZINC000794814039 1123957507 /nfs/dbraw/zinc/95/75/07/1123957507.db2.gz GNQFNDCBTZGZSX-HNNXBMFYSA-N 1 0 290.432 3.749 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCC[C@@H]1OC)c1ccc(C)cc1O ZINC000794815172 1123957797 /nfs/dbraw/zinc/95/77/97/1123957797.db2.gz HYFDIRIPYBHGFN-KMFMINBZSA-N 1 0 277.408 3.556 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCCS1)c1ccc(C)cc1O ZINC000794812539 1123959065 /nfs/dbraw/zinc/95/90/65/1123959065.db2.gz XCPIDPKFDAHLGN-OCCSQVGLSA-N 1 0 265.422 3.637 20 10 CHCDRO C[C@H]1CC2(CCC2)C[N@@H+]1Cc1c(O)cccc1Cl ZINC000763646852 1129156183 /nfs/dbraw/zinc/15/61/83/1129156183.db2.gz KVQUSRQEDAUHMV-NSHDSACASA-N 1 0 265.784 3.810 20 10 CHCDRO Cc1cc(NCc2ccc(N3CCSCC3)cc2)cc[nH+]1 ZINC000302222800 1123962607 /nfs/dbraw/zinc/96/26/07/1123962607.db2.gz PBGDHYAADCXDEK-UHFFFAOYSA-N 1 0 299.443 3.555 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cccnc1F)c1cc(Cl)ccc1O ZINC000794832711 1123970081 /nfs/dbraw/zinc/97/00/81/1123970081.db2.gz DCIUWIFRBXHMFV-CYBMUJFWSA-N 1 0 294.757 3.821 20 10 CHCDRO COc1ccc(O)c(C[NH2+]Cc2cccc3ccccc32)c1 ZINC000120489582 1123971366 /nfs/dbraw/zinc/97/13/66/1123971366.db2.gz JQSYGOHWPMKQSC-UHFFFAOYSA-N 1 0 293.366 3.844 20 10 CHCDRO COc1ccc(O)c(C[NH2+]Cc2cccc(Cl)c2C)c1 ZINC000865464333 1123986137 /nfs/dbraw/zinc/98/61/37/1123986137.db2.gz YBSDLFLPIDFLQC-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO C[C@H]([NH2+]CCCc1ccccc1F)c1ccccc1O ZINC000794840487 1123988107 /nfs/dbraw/zinc/98/81/07/1123988107.db2.gz IXYGMEVHIYHNRX-ZDUSSCGKSA-N 1 0 273.351 3.815 20 10 CHCDRO COc1ccccc1[C@@H](C)[NH2+]Cc1cc(C)c(C)cc1O ZINC000865821003 1124017287 /nfs/dbraw/zinc/01/72/87/1124017287.db2.gz IKOLAYWSQCDRHY-CQSZACIVSA-N 1 0 285.387 3.868 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H](CF)c2ccc(F)cc2)cc1C ZINC000865823083 1124017852 /nfs/dbraw/zinc/01/78/52/1124017852.db2.gz RLQFQXRDIKGYOL-MRXNPFEDSA-N 1 0 291.341 3.949 20 10 CHCDRO C[C@@H]([NH2+]CC(C)(C)F)c1ccc2ccccc2c1O ZINC000866408152 1124063492 /nfs/dbraw/zinc/06/34/92/1124063492.db2.gz HACXBEAUGVYMSO-LLVKDONJSA-N 1 0 261.340 3.944 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)c2cc(Cl)ccc2O)o1 ZINC000866478785 1124069912 /nfs/dbraw/zinc/06/99/12/1124069912.db2.gz MNNLMIOQFZRSIL-SNVBAGLBSA-N 1 0 265.740 3.798 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCC12CCOCC2)c1ccccc1O ZINC000866528949 1124078383 /nfs/dbraw/zinc/07/83/83/1124078383.db2.gz KVBGSSJPSRJZDH-HOCLYGCPSA-N 1 0 289.419 3.640 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@@H]1CC=CC[C@H]1C(F)(F)F)CC2 ZINC000866609308 1124087778 /nfs/dbraw/zinc/08/77/78/1124087778.db2.gz LGIKZEXHRVYMMW-JHJVBQTASA-N 1 0 297.320 3.866 20 10 CHCDRO COc1cccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)c1 ZINC000037680555 1129165578 /nfs/dbraw/zinc/16/55/78/1129165578.db2.gz CGIFWIFALYFTLE-CQSZACIVSA-N 1 0 284.403 3.612 20 10 CHCDRO C[C@@H]([NH2+]C1([C@H]2CCCCO2)CCC1)c1cc(F)ccc1O ZINC000866622541 1124091353 /nfs/dbraw/zinc/09/13/53/1124091353.db2.gz GEWGYLKUBMUYKH-MLGOLLRUSA-N 1 0 293.382 3.674 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]C2CCC=CCC2)c1 ZINC000718083054 1129171473 /nfs/dbraw/zinc/17/14/73/1129171473.db2.gz PRQSAMMDMXZZNZ-GFCCVEGCSA-N 1 0 261.365 3.550 20 10 CHCDRO c1csc(SCCC[NH2+]C[C@H]2CC=CCC2)n1 ZINC000123363314 1124589331 /nfs/dbraw/zinc/58/93/31/1124589331.db2.gz QJDJLITUALOKAG-LBPRGKRZSA-N 1 0 268.451 3.571 20 10 CHCDRO CC[N@H+](Cc1ccc(N)cc1)[C@@H](C)c1ccc(F)cc1 ZINC001120370775 1131274316 /nfs/dbraw/zinc/27/43/16/1131274316.db2.gz DYGCXEDXHSADSW-ZDUSSCGKSA-N 1 0 272.367 3.991 20 10 CHCDRO COCC(C)(C)CC[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000872105050 1124683812 /nfs/dbraw/zinc/68/38/12/1124683812.db2.gz ZPMBQGWOTRWJSW-CQSZACIVSA-N 1 0 279.424 3.722 20 10 CHCDRO CC[C@H]([NH2+][C@@H](CC)[C@@H](O)c1ccccc1)c1ccccc1O ZINC000872133524 1124692358 /nfs/dbraw/zinc/69/23/58/1124692358.db2.gz QOEUUTXYIRUSSI-LNLFQRSKSA-N 1 0 299.414 3.945 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H](C)c2nccnc2C)cc1 ZINC000872133191 1124692521 /nfs/dbraw/zinc/69/25/21/1124692521.db2.gz LLUBFNSDTKJVQP-UKRRQHHQSA-N 1 0 298.434 3.653 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H](C)c2nccnc2C)cc1 ZINC000872133189 1124692834 /nfs/dbraw/zinc/69/28/34/1124692834.db2.gz LLUBFNSDTKJVQP-DZGCQCFKSA-N 1 0 298.434 3.653 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]C2(C)CC(F)(F)C2)cc1 ZINC000873197591 1124751721 /nfs/dbraw/zinc/75/17/21/1124751721.db2.gz IXRONWWIGLILRV-PLNGDYQASA-N 1 0 280.362 3.543 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC[C@@H]2CNc3ccccc32)c(O)c1 ZINC000873236417 1124752719 /nfs/dbraw/zinc/75/27/19/1124752719.db2.gz HBSKRNXTQWRKNL-HUUCEWRRSA-N 1 0 296.414 3.951 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CC[C@@H]2CNc3ccccc32)c1 ZINC000873237913 1124754779 /nfs/dbraw/zinc/75/47/79/1124754779.db2.gz VMLDOBULAXWCNN-HUUCEWRRSA-N 1 0 296.414 3.951 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2cc(N)cc(F)c2)c(O)c1 ZINC000873288425 1124762171 /nfs/dbraw/zinc/76/21/71/1124762171.db2.gz FLNVKZSSILOJAL-LBPRGKRZSA-N 1 0 288.366 3.581 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCc2ccc(F)cc2)c(O)c1 ZINC000020087388 1124805477 /nfs/dbraw/zinc/80/54/77/1124805477.db2.gz WJQSXQLTLHAUFC-ZDUSSCGKSA-N 1 0 273.351 3.733 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)CCC(C)C)c1 ZINC000020560537 1124852725 /nfs/dbraw/zinc/85/27/25/1124852725.db2.gz UYWBCQBAQFRXEK-STQMWFEESA-N 1 0 265.397 3.876 20 10 CHCDRO CC[C@@H]([NH2+]CCCN(C)c1ccccc1)c1ccccc1O ZINC000020826819 1124878387 /nfs/dbraw/zinc/87/83/87/1124878387.db2.gz XFDUZFXGUNGOMD-GOSISDBHSA-N 1 0 298.430 3.959 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(C)cc1O)c1ccccc1OC ZINC000876927958 1124991317 /nfs/dbraw/zinc/99/13/17/1124991317.db2.gz POFAQZJVMOORSJ-MRXNPFEDSA-N 1 0 285.387 3.950 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H]2CCc3c2cccc3F)c(O)c1 ZINC000876973883 1124992822 /nfs/dbraw/zinc/99/28/22/1124992822.db2.gz RGQFVYQGVZXVOF-MRXNPFEDSA-N 1 0 271.335 3.617 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]Cc1ccccc1OC1CCC1 ZINC000877037185 1125000757 /nfs/dbraw/zinc/00/07/57/1125000757.db2.gz WHTGSMVWZAHPCY-UHFFFAOYSA-N 1 0 297.398 3.922 20 10 CHCDRO CCC(CC)c1cc(C[NH2+]Cc2ccc(C)cc2O)on1 ZINC000877063188 1125002766 /nfs/dbraw/zinc/00/27/66/1125002766.db2.gz GCZIEPWNRWJWAG-UHFFFAOYSA-N 1 0 288.391 3.882 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H]2COc3ccc(Cl)cc32)c(O)c1 ZINC000877090650 1125008952 /nfs/dbraw/zinc/00/89/52/1125008952.db2.gz WTWSUUNFMFLIRF-CQSZACIVSA-N 1 0 289.762 3.577 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CCC2(F)CCC2)cc1Cl ZINC000825935490 1125012655 /nfs/dbraw/zinc/01/26/55/1125012655.db2.gz VVPTUQCOPPWPPM-UHFFFAOYSA-N 1 0 271.763 3.726 20 10 CHCDRO CCc1cnccc1[C@@H](C)[NH2+]Cc1ccc(C)cc1O ZINC000877134553 1125012922 /nfs/dbraw/zinc/01/29/22/1125012922.db2.gz SZWZGYXFCZRAKP-CYBMUJFWSA-N 1 0 270.376 3.509 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+](C)C1CCC(F)(F)CC1 ZINC000877533647 1125041226 /nfs/dbraw/zinc/04/12/26/1125041226.db2.gz UUVIHAUGHCDXRI-UHFFFAOYSA-N 1 0 269.335 3.710 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+]1CC(C)(C)[C@H]1c1cccnc1 ZINC000877547074 1125042399 /nfs/dbraw/zinc/04/23/99/1125042399.db2.gz WLLAHJZTQNJWPJ-QGZVFWFLSA-N 1 0 282.387 3.679 20 10 CHCDRO C[N@H+](Cc1ccccc1O)C1CC(OCc2ccccc2)C1 ZINC000821391554 1131327549 /nfs/dbraw/zinc/32/75/49/1131327549.db2.gz OBZWJBNAPPFLDA-UHFFFAOYSA-N 1 0 297.398 3.572 20 10 CHCDRO CC[C@H](C[NH2+]Cc1c(C)cccc1O)CC(F)(F)F ZINC000877589503 1125049626 /nfs/dbraw/zinc/04/96/26/1125049626.db2.gz PGRIYRPGLJUNDC-NSHDSACASA-N 1 0 275.314 3.769 20 10 CHCDRO Cc1ccc(C[NH2+]C2(c3ccccc3C)CC2)c(O)c1 ZINC000877604104 1125052882 /nfs/dbraw/zinc/05/28/82/1125052882.db2.gz IFLABQFXZPHBDU-UHFFFAOYSA-N 1 0 267.372 3.788 20 10 CHCDRO Oc1c(C[NH2+]CC[C@@H]2CCSC2)ccc2ccccc21 ZINC000877662186 1125058881 /nfs/dbraw/zinc/05/88/81/1125058881.db2.gz NERKUKCQCPPMNW-CYBMUJFWSA-N 1 0 287.428 3.778 20 10 CHCDRO CSC1CC[NH+](Cc2ccc3ccccc3c2O)CC1 ZINC000877663590 1125061079 /nfs/dbraw/zinc/06/10/79/1125061079.db2.gz VQXGNFLRMDWKGS-UHFFFAOYSA-N 1 0 287.428 3.873 20 10 CHCDRO Oc1cccc2c1C[N@H+](Cc1ccc(OC(F)F)cc1)C2 ZINC000877704006 1125066136 /nfs/dbraw/zinc/06/61/36/1125066136.db2.gz VYXLZRHKILSRNT-UHFFFAOYSA-N 1 0 291.297 3.509 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)c2ccccc2O)c(Cl)c1 ZINC000877756345 1125072549 /nfs/dbraw/zinc/07/25/49/1125072549.db2.gz ICXXQISUGXOLBT-LLVKDONJSA-N 1 0 291.778 3.905 20 10 CHCDRO CO[C@@H](c1ccccc1)[C@H](C)[NH2+][C@H](C)c1ccccc1O ZINC000877757634 1125073943 /nfs/dbraw/zinc/07/39/43/1125073943.db2.gz PBHIDNUGCHXHRW-QWQRMKEZSA-N 1 0 285.387 3.819 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCC2)c1ccccc1O ZINC000877756570 1125075150 /nfs/dbraw/zinc/07/51/50/1125075150.db2.gz UAKXQIAOVMUNLY-CYBMUJFWSA-N 1 0 267.372 3.732 20 10 CHCDRO CCc1cccc(C[NH2+][C@@H](CF)c2ccc(F)cc2)c1O ZINC000877758471 1125075676 /nfs/dbraw/zinc/07/56/76/1125075676.db2.gz CEMVJHAIUBEORU-INIZCTEOSA-N 1 0 291.341 3.894 20 10 CHCDRO C[C@@H]([NH2+]Cc1cccc2cccnc21)c1ccccc1O ZINC000127658329 1125209113 /nfs/dbraw/zinc/20/91/13/1125209113.db2.gz IHDKWKLEPGHJPJ-CYBMUJFWSA-N 1 0 278.355 3.791 20 10 CHCDRO Cc1cc(C[NH2+][C@H](C)c2ccccc2O)ccc1N(C)C ZINC000879648857 1125221965 /nfs/dbraw/zinc/22/19/65/1125221965.db2.gz CRJRCPNXYSBXOM-CQSZACIVSA-N 1 0 284.403 3.617 20 10 CHCDRO CSc1cccc(C[NH2+][C@H](C)c2ccccc2O)c1 ZINC000879650133 1125222412 /nfs/dbraw/zinc/22/24/12/1125222412.db2.gz KKIHHPMJGHPQDS-GFCCVEGCSA-N 1 0 273.401 3.965 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(CF)cc1)c1ccccc1O ZINC000879650454 1125224331 /nfs/dbraw/zinc/22/43/31/1125224331.db2.gz APFGJWRLSQIAPO-LBPRGKRZSA-N 1 0 259.324 3.713 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]CC(C2CC2)C2CC2)c1O ZINC000228675700 1125251281 /nfs/dbraw/zinc/25/12/81/1125251281.db2.gz AWUHWQKNZLZYRD-UHFFFAOYSA-N 1 0 295.810 3.580 20 10 CHCDRO COc1cccc(C[N@H+](CC(C)C)C2CCCC2)c1O ZINC000211538888 1125308427 /nfs/dbraw/zinc/30/84/27/1125308427.db2.gz MIXFFJXPIWLWTA-UHFFFAOYSA-N 1 0 277.408 3.801 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)c2cc(F)ccc2O)c(Cl)n1 ZINC000883301520 1125392287 /nfs/dbraw/zinc/39/22/87/1125392287.db2.gz BLSLURNWRBLOPV-JTQLQIEISA-N 1 0 294.757 3.739 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1cc(Cl)ccc1O)[C@H]1CCCOC1 ZINC000883353585 1125400413 /nfs/dbraw/zinc/40/04/13/1125400413.db2.gz XXEWIPKXASMTEJ-HUBLWGQQSA-N 1 0 297.826 3.901 20 10 CHCDRO C[C@@H]1C[C@@H](C)C[NH+](Cc2c(O)cccc2Cl)C1 ZINC000131818847 1125410272 /nfs/dbraw/zinc/41/02/72/1125410272.db2.gz CHEPATDYEKKAMP-GHMZBOCLSA-N 1 0 253.773 3.524 20 10 CHCDRO C[C@@H]1C[C@H](C)C[N@@H+](Cc2cc(Cl)ccc2O)C1 ZINC000131805139 1125410329 /nfs/dbraw/zinc/41/03/29/1125410329.db2.gz BOROYMXAMWCWCW-PHIMTYICSA-N 1 0 253.773 3.524 20 10 CHCDRO COC[C@@H](C)[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000131950086 1125412341 /nfs/dbraw/zinc/41/23/41/1125412341.db2.gz TYNOMWQJQPAKCD-CVEARBPZSA-N 1 0 290.451 3.753 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCCSc2nccs2)o1 ZINC000132305125 1125416604 /nfs/dbraw/zinc/41/66/04/1125416604.db2.gz DMABUDDQRLZUIW-NSHDSACASA-N 1 0 282.434 3.878 20 10 CHCDRO CC[C@@H]([NH2+]CCCSC)c1ccc(N(C)C)cc1 ZINC000132510224 1125419305 /nfs/dbraw/zinc/41/93/05/1125419305.db2.gz VGSKYOFEKCUXAR-OAHLLOKOSA-N 1 0 266.454 3.546 20 10 CHCDRO Oc1cc2c(cc1C[N@@H+]1CCc3ccsc3C1)CCC2 ZINC000132604244 1125419665 /nfs/dbraw/zinc/41/96/65/1125419665.db2.gz XQFMBEQOLHALGP-UHFFFAOYSA-N 1 0 285.412 3.501 20 10 CHCDRO C[C@@H]([NH2+]C1CC1)c1ccc(N2CCCCCC2)cc1 ZINC000132752208 1125421069 /nfs/dbraw/zinc/42/10/69/1125421069.db2.gz USINCRIQBIDMRC-CQSZACIVSA-N 1 0 258.409 3.880 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccccc1C)c1ccccc1O ZINC000037718898 1129209996 /nfs/dbraw/zinc/20/99/96/1129209996.db2.gz IGXCPNMRRFARHV-INIZCTEOSA-N 1 0 255.361 3.942 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCc2cccc(O)c21)c1cccc([N+](=O)[O-])c1 ZINC000295992118 1129220910 /nfs/dbraw/zinc/22/09/10/1129220910.db2.gz NUFDGPWWIFAWPO-ABAIWWIYSA-N 1 0 298.342 3.639 20 10 CHCDRO COc1cccc(C[N@@H+]2[C@H](C)C[C@@H]3CCCC[C@H]32)c1O ZINC000245713028 1129221179 /nfs/dbraw/zinc/22/11/79/1129221179.db2.gz GHZOTOPTAGAWBR-VNHYZAJKSA-N 1 0 275.392 3.554 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2ccc(N(C)C)cc2)Cc2ccccc2O1 ZINC000795428725 1129274178 /nfs/dbraw/zinc/27/41/78/1129274178.db2.gz BAEXMVXAMQLEQK-OAHLLOKOSA-N 1 0 296.414 3.536 20 10 CHCDRO COC1CCC([N@H+](C)Cc2c(O)ccc3ccccc32)CC1 ZINC000734475706 1129310222 /nfs/dbraw/zinc/31/02/22/1129310222.db2.gz YCZDRWYYSUEKAV-UHFFFAOYSA-N 1 0 299.414 3.935 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H](C)CCc2cccc(F)c2)c1 ZINC000734510595 1129311221 /nfs/dbraw/zinc/31/12/21/1129311221.db2.gz XYUABSWRGAXNIA-AWEZNQCLSA-N 1 0 287.378 3.951 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]C[C@@H](C)C(C)(C)C)c1 ZINC000734510717 1129311559 /nfs/dbraw/zinc/31/15/59/1129311559.db2.gz RMWWPWNTTFVQTI-GFCCVEGCSA-N 1 0 265.397 3.563 20 10 CHCDRO C[C@@H]([NH2+]CC1(C2CC2)CC1)c1ccc(N(C)C)cc1 ZINC000090772900 1129328991 /nfs/dbraw/zinc/32/89/91/1129328991.db2.gz PMYPZISNSRCIRF-CYBMUJFWSA-N 1 0 258.409 3.593 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C(C)(C)c2cccs2)cc1F ZINC000735086746 1129330890 /nfs/dbraw/zinc/33/08/90/1129330890.db2.gz RPUALNREPXTEFI-UHFFFAOYSA-N 1 0 292.423 3.978 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCCOC(C)(C)C2)cc1C(C)C ZINC000735298399 1129339107 /nfs/dbraw/zinc/33/91/07/1129339107.db2.gz RLWUFZCWQDEBPK-UHFFFAOYSA-N 1 0 291.435 3.825 20 10 CHCDRO C[C@@H]([NH2+]Cc1nc2c(s1)CCCC2)c1ccccc1O ZINC000719528189 1129342656 /nfs/dbraw/zinc/34/26/56/1129342656.db2.gz QREPXMMJPRWCNT-LLVKDONJSA-N 1 0 288.416 3.578 20 10 CHCDRO Cc1csc(C[NH2+][C@@H](C)c2cc(C)ccc2O)c1 ZINC000379295549 1129358800 /nfs/dbraw/zinc/35/88/00/1129358800.db2.gz XDYGTJDCCFLSAG-LBPRGKRZSA-N 1 0 261.390 3.921 20 10 CHCDRO CCC[C@@](C)(CO)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000735926150 1129361146 /nfs/dbraw/zinc/36/11/46/1129361146.db2.gz KIQBZYKBQURZTL-IBGZPJMESA-N 1 0 299.414 3.700 20 10 CHCDRO CCn1cc(C[N@H+](Cc2ccccc2O)C2CCCC2)cn1 ZINC000093319228 1129420999 /nfs/dbraw/zinc/42/09/99/1129420999.db2.gz XTLYRPRJEGGMHV-UHFFFAOYSA-N 1 0 299.418 3.553 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](C)[C@@H](CCO)c2ccccc2)cc1C ZINC000093442494 1129424029 /nfs/dbraw/zinc/42/40/29/1129424029.db2.gz PQIHTQRLYRWRTI-SFHVURJKSA-N 1 0 299.414 3.565 20 10 CHCDRO COc1cccc(C[N@@H+]2CC[C@@H](c3ccccc3)[C@@H]2C)c1O ZINC000093689636 1129426639 /nfs/dbraw/zinc/42/66/39/1129426639.db2.gz SEURTYUTNDHCMB-WMLDXEAASA-N 1 0 297.398 3.779 20 10 CHCDRO CCC(CC)[C@@H](C[NH2+][C@H](C)c1cc(F)ccc1O)N(C)C ZINC000094617001 1129448157 /nfs/dbraw/zinc/44/81/57/1129448157.db2.gz IITVNAXMBQVUSZ-MLGOLLRUSA-N 1 0 296.430 3.548 20 10 CHCDRO C[C@H]([NH2+]CC(C1CC1)C1CC1)c1cc(F)ccc1O ZINC000094618420 1129448231 /nfs/dbraw/zinc/44/82/31/1129448231.db2.gz RTGKDVAEYOEOTN-JTQLQIEISA-N 1 0 263.356 3.618 20 10 CHCDRO C[C@@H]([NH2+]CCc1cccc(F)c1)c1cc(F)ccc1O ZINC000094617112 1129448273 /nfs/dbraw/zinc/44/82/73/1129448273.db2.gz KRLUPSWTXCVDKF-LLVKDONJSA-N 1 0 277.314 3.564 20 10 CHCDRO C[C@H]([NH2+]CCC1CCCC1)c1cc(F)ccc1O ZINC000094617631 1129448322 /nfs/dbraw/zinc/44/83/22/1129448322.db2.gz AMCYMJOSEKFIDM-NSHDSACASA-N 1 0 251.345 3.762 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)Cc1ccsc1)c1cc(F)ccc1O ZINC000094617883 1129448360 /nfs/dbraw/zinc/44/83/60/1129448360.db2.gz CKBYQARLIPUVJS-WDEREUQCSA-N 1 0 279.380 3.875 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCC[C@H](C)C1 ZINC000742370954 1129474644 /nfs/dbraw/zinc/47/46/44/1129474644.db2.gz BFYPJDQGBSXDHC-XJKSGUPXSA-N 1 0 260.425 3.729 20 10 CHCDRO c1cc(C[NH2+][C@@H]2C[C@@H]2C2CCCCC2)cc2c1OCC2 ZINC000742375412 1129475533 /nfs/dbraw/zinc/47/55/33/1129475533.db2.gz MHPMXCKHLQIRHO-IAGOWNOFSA-N 1 0 271.404 3.680 20 10 CHCDRO CC[C@@H](O)CCC[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000742374112 1129475610 /nfs/dbraw/zinc/47/56/10/1129475610.db2.gz YUWWCSIRKSLWJV-GOSISDBHSA-N 1 0 299.414 3.700 20 10 CHCDRO c1cc(C[NH2+][C@@H]2CC[C@@H]3CCC[C@@H]3C2)cc2c1OCC2 ZINC000742379337 1129476015 /nfs/dbraw/zinc/47/60/15/1129476015.db2.gz VNAOUZLLABGIDP-ZMSDIMECSA-N 1 0 271.404 3.680 20 10 CHCDRO COc1cc(Cl)cc(C[N@H+](C)C2(C)CCCC2)c1O ZINC000720387844 1129526922 /nfs/dbraw/zinc/52/69/22/1129526922.db2.gz PRVNINWBWVQRTR-UHFFFAOYSA-N 1 0 283.799 3.819 20 10 CHCDRO CCC[N@H+](Cc1ccccc1O)[C@@H](C)c1ccncc1 ZINC000743870146 1129541673 /nfs/dbraw/zinc/54/16/73/1129541673.db2.gz IUHSQPSOZKLXJY-AWEZNQCLSA-N 1 0 270.376 3.760 20 10 CHCDRO C[C@H]1C[C@H]([NH2+]Cc2ccc3c(c2)CCO3)C[C@@H](C)C1 ZINC000251802850 1129542172 /nfs/dbraw/zinc/54/21/72/1129542172.db2.gz GJEFQHRUAAZIJL-VIKVFOODSA-N 1 0 259.393 3.536 20 10 CHCDRO CC[C@H](C[C@@H](C)CO)[NH2+][C@@H](C)c1ccc(N(C)CC)cc1 ZINC000766361411 1129660269 /nfs/dbraw/zinc/66/02/69/1129660269.db2.gz VQBBGWIOFZKTFP-HLLBOEOZSA-N 1 0 292.467 3.590 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@H](OC)C(C)(C)C)cc1 ZINC000766368504 1129660698 /nfs/dbraw/zinc/66/06/98/1129660698.db2.gz IESXBZPHIHGKRD-YOEHRIQHSA-N 1 0 292.467 3.854 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](OC)C(C)(C)C)c1ccc(N(C)C)cc1 ZINC000766370795 1129661028 /nfs/dbraw/zinc/66/10/28/1129661028.db2.gz VQEWMIFPYGCSJL-IRXDYDNUSA-N 1 0 292.467 3.854 20 10 CHCDRO CCCN(CC)CC[NH2+][C@@H](C)c1ccc(N(C)CC)cc1 ZINC000766402857 1129662770 /nfs/dbraw/zinc/66/27/70/1129662770.db2.gz YSXFBJMOHQMIRI-INIZCTEOSA-N 1 0 291.483 3.525 20 10 CHCDRO C[C@@H](C[NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1ccncc1 ZINC000766490982 1129669282 /nfs/dbraw/zinc/66/92/82/1129669282.db2.gz XMFNFMVDBYKEKB-GJZGRUSLSA-N 1 0 283.419 3.602 20 10 CHCDRO COC1CCC(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)CC1 ZINC000766496107 1129672442 /nfs/dbraw/zinc/67/24/42/1129672442.db2.gz RWENBLYVURIXMK-KSTDHSDQSA-N 1 0 290.451 3.608 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H](C)C[C@@H]2CCOC2)cc1 ZINC000766579921 1129693821 /nfs/dbraw/zinc/69/38/21/1129693821.db2.gz CDUYIWOZEQIWGA-PMPSAXMXSA-N 1 0 290.451 3.608 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)C[C@@H]1CCOC1)c1ccc(N(C)C)cc1 ZINC000766582277 1129697439 /nfs/dbraw/zinc/69/74/39/1129697439.db2.gz QDMJPPSLFUFFND-VKJFTORMSA-N 1 0 290.451 3.608 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CCCC(C)(C)C2)cc1 ZINC001169300989 1129717462 /nfs/dbraw/zinc/71/74/62/1129717462.db2.gz QOCLVUYLORZGQO-UHFFFAOYSA-N 1 0 260.425 3.765 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H]2CSC[C@@H]2C)cc1F ZINC000796482228 1129741872 /nfs/dbraw/zinc/74/18/72/1129741872.db2.gz LQBFSGYGLNCLCI-WFASDCNBSA-N 1 0 296.455 3.513 20 10 CHCDRO Cc1cc2cc(C[NH2+]Cc3cc(C)ccc3O)ccc2[nH]1 ZINC000796527986 1129774875 /nfs/dbraw/zinc/77/48/75/1129774875.db2.gz NJXDQDYGTGUDPW-UHFFFAOYSA-N 1 0 280.371 3.780 20 10 CHCDRO Cc1cc(O)c(C[NH2+]Cc2ccc3c(n2)CCCC3)cc1C ZINC000767728814 1129810003 /nfs/dbraw/zinc/81/00/03/1129810003.db2.gz SUIRVOHKGOKGOX-UHFFFAOYSA-N 1 0 296.414 3.573 20 10 CHCDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]CCOC1CCC1 ZINC000742385622 1129817693 /nfs/dbraw/zinc/81/76/93/1129817693.db2.gz MABNLQBXQBDTNJ-UHFFFAOYSA-N 1 0 297.398 3.718 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CCCC[C@@H]2CC)c1 ZINC000768137500 1129835289 /nfs/dbraw/zinc/83/52/89/1129835289.db2.gz DIAAGRAIYDZEGR-AWEZNQCLSA-N 1 0 263.381 3.555 20 10 CHCDRO Cc1ccc(O)c(C[N@H+](C)Cc2ccccc2Cl)c1 ZINC000768170730 1129839298 /nfs/dbraw/zinc/83/92/98/1129839298.db2.gz VDNGEABLJNYHAJ-UHFFFAOYSA-N 1 0 275.779 3.986 20 10 CHCDRO COc1cccc(O)c1C[N@H+](C)[C@@H]1CCCc2ccccc21 ZINC000768192864 1129843030 /nfs/dbraw/zinc/84/30/30/1129843030.db2.gz GBYFGFWHZLNCDH-QGZVFWFLSA-N 1 0 297.398 3.910 20 10 CHCDRO Cc1cncc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)c1 ZINC000768222606 1129843992 /nfs/dbraw/zinc/84/39/92/1129843992.db2.gz HBTBXGYIYGORTO-OAHLLOKOSA-N 1 0 283.419 3.615 20 10 CHCDRO C[C@@H]([NH2+]CC[C@H]1CC1(Cl)Cl)c1ccccc1O ZINC000822812693 1131401289 /nfs/dbraw/zinc/40/12/89/1131401289.db2.gz KOOYSADABAENAR-ZJUUUORDSA-N 1 0 274.191 3.627 20 10 CHCDRO CCc1cccc(C[NH2+][C@H](C)c2nc(C)cs2)c1O ZINC000691444587 1129846348 /nfs/dbraw/zinc/84/63/48/1129846348.db2.gz JQZZQJDTUKVITJ-LLVKDONJSA-N 1 0 276.405 3.570 20 10 CHCDRO CCc1cccc(C[NH2+]C2CCC(F)(F)CC2)c1O ZINC000691444514 1129847246 /nfs/dbraw/zinc/84/72/46/1129847246.db2.gz JJFPNEVHWVGEBL-UHFFFAOYSA-N 1 0 269.335 3.622 20 10 CHCDRO CCOc1ccc(C[N@H+](C)[C@@H]2CCC[C@@H](C)C2)c(O)c1 ZINC000768263579 1129848627 /nfs/dbraw/zinc/84/86/27/1129848627.db2.gz VCHOFLNPIBZLTP-UKRRQHHQSA-N 1 0 277.408 3.801 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)[C@@H]2CCSC2)cc1F ZINC000768263619 1129848998 /nfs/dbraw/zinc/84/89/98/1129848998.db2.gz VWLZOICLKWPPAS-CQSZACIVSA-N 1 0 296.455 3.609 20 10 CHCDRO CCOc1ccc(C[N@H+](C)[C@H](C)c2ccco2)c(O)c1 ZINC000768261310 1129849297 /nfs/dbraw/zinc/84/92/97/1129849297.db2.gz AWFJHXDMNRNZLL-GFCCVEGCSA-N 1 0 275.348 3.577 20 10 CHCDRO CO[C@@H](C[NH2+][C@H](C)c1ccc2ccccc2c1O)C(C)C ZINC000381772515 1129849516 /nfs/dbraw/zinc/84/95/16/1129849516.db2.gz JSJFABCDZQQAGY-DYVFJYSZSA-N 1 0 287.403 3.867 20 10 CHCDRO CCCC[N@H+](Cc1cc(Cl)ccc1O)C1CC1 ZINC000768290254 1129849870 /nfs/dbraw/zinc/84/98/70/1129849870.db2.gz DBPAUXRKJZMNGR-UHFFFAOYSA-N 1 0 253.773 3.810 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccccc1O)[C@@H]1CC2CCC1CC2 ZINC000381987313 1129853285 /nfs/dbraw/zinc/85/32/85/1129853285.db2.gz XBLKXEAFJJSWKV-WOICTCIZSA-N 1 0 259.393 3.697 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC[C@@H](Cc3ccccc3)C2)c1 ZINC000768364651 1129854515 /nfs/dbraw/zinc/85/45/15/1129854515.db2.gz LWWFOIZRKGQWPU-KRWDZBQOSA-N 1 0 281.399 3.765 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)[C@H](C)C2CC2)cc1 ZINC000768421642 1129855751 /nfs/dbraw/zinc/85/57/51/1129855751.db2.gz NHCCJGAIRPEGTC-CQSZACIVSA-N 1 0 260.425 3.763 20 10 CHCDRO COc1cc(C[N@H+](C)[C@H](C)C(C)(C)C)c(O)cc1C ZINC000768442736 1129857709 /nfs/dbraw/zinc/85/77/09/1129857709.db2.gz ZWMBVVIRFDQFOD-GFCCVEGCSA-N 1 0 265.397 3.576 20 10 CHCDRO COc1cc(C[N@H+](C)C[C@@H](C)c2ccccc2)c(O)cc1C ZINC000768452725 1129858395 /nfs/dbraw/zinc/85/83/95/1129858395.db2.gz RTKDYISGIVSYBE-OAHLLOKOSA-N 1 0 299.414 3.945 20 10 CHCDRO CC1([NH2+]Cc2cc(Cl)ccc2O)Cc2ccccc2C1 ZINC000768656868 1129867599 /nfs/dbraw/zinc/86/75/99/1129867599.db2.gz QJIGPUHZEFRNKX-UHFFFAOYSA-N 1 0 287.790 3.693 20 10 CHCDRO CC[N@H+](CCc1ccccn1)Cc1cc(Cl)ccc1O ZINC000769033673 1129886099 /nfs/dbraw/zinc/88/60/99/1129886099.db2.gz LOWAXVDWUJCVOV-UHFFFAOYSA-N 1 0 290.794 3.505 20 10 CHCDRO CC[C@H](C)[C@@H](C)[N@H+](Cc1cc2c(cc1O)OCO2)C1CC1 ZINC000769339604 1129903705 /nfs/dbraw/zinc/90/37/05/1129903705.db2.gz TVOCMBYRTWNOOB-NWDGAFQWSA-N 1 0 291.391 3.520 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CC[C@H](c2ccco2)C1 ZINC000769388799 1129905302 /nfs/dbraw/zinc/90/53/02/1129905302.db2.gz HUJCVRZQUFLFMU-NSHDSACASA-N 1 0 277.751 3.628 20 10 CHCDRO CC[C@H]1[C@@H](C)CC[N@@H+]1Cc1cc(Cl)cc(OC)c1O ZINC000384283159 1129905755 /nfs/dbraw/zinc/90/57/55/1129905755.db2.gz OTRASADWMMJYME-GWCFXTLKSA-N 1 0 283.799 3.675 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CC[C@H](c2ccco2)C1 ZINC000769389693 1129906275 /nfs/dbraw/zinc/90/62/75/1129906275.db2.gz NGIRKFWJDGUECV-NSHDSACASA-N 1 0 277.751 3.628 20 10 CHCDRO COc1cccc(O)c1C[N@@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000769426051 1129907703 /nfs/dbraw/zinc/90/77/03/1129907703.db2.gz BHISOHMDBCKZMX-GOSISDBHSA-N 1 0 287.403 3.723 20 10 CHCDRO C[C@@H]1C[C@H](C)[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000769470966 1129912772 /nfs/dbraw/zinc/91/27/72/1129912772.db2.gz PJASNOMUHAWEBT-CVEARBPZSA-N 1 0 272.436 3.907 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCCC23CCCCC3)c1 ZINC000769506505 1129914989 /nfs/dbraw/zinc/91/49/89/1129914989.db2.gz VIGDGHSIPSZPDO-UHFFFAOYSA-N 1 0 259.393 3.999 20 10 CHCDRO COc1cccc(O)c1C[N@@H+]1C[C@@H](C)[C@@H]1c1ccccc1 ZINC000769542061 1129916325 /nfs/dbraw/zinc/91/63/25/1129916325.db2.gz ZBHKIUAKEUHDQL-FZKQIMNGSA-N 1 0 283.371 3.594 20 10 CHCDRO Cc1ccc(O)c(C[N@H+]2C[C@H](C)[C@H]2c2ccccc2)c1 ZINC000769541984 1129916665 /nfs/dbraw/zinc/91/66/65/1129916665.db2.gz XXKGMBZWBFCETR-KSSFIOAISA-N 1 0 267.372 3.894 20 10 CHCDRO CCc1ccccc1CC[NH2+][C@@H](C)c1cc(OC)ccc1O ZINC000769785968 1129924828 /nfs/dbraw/zinc/92/48/28/1129924828.db2.gz HVJUXVZJEIQAHV-AWEZNQCLSA-N 1 0 299.414 3.857 20 10 CHCDRO CCCC[N@H+](CC[C@H]1CCCCO1)Cc1ccccc1O ZINC000801594653 1129930977 /nfs/dbraw/zinc/93/09/77/1129930977.db2.gz JFEQLSARJZIKHU-QGZVFWFLSA-N 1 0 291.435 3.954 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCC[C@@H]1Cc1cccc(F)c1 ZINC000770508585 1129948094 /nfs/dbraw/zinc/94/80/94/1129948094.db2.gz AGMXYQNIUGQOBN-QGZVFWFLSA-N 1 0 285.362 3.738 20 10 CHCDRO CC[C@H]1c2ccsc2CC[N@H+]1Cc1ccccc1O ZINC000770509824 1129949001 /nfs/dbraw/zinc/94/90/01/1129949001.db2.gz UNJCLUYGYFCXMP-AWEZNQCLSA-N 1 0 273.401 3.963 20 10 CHCDRO CC1CCC([N@H+](Cc2ccccc2O)C2CC2)CC1 ZINC000770509329 1129949049 /nfs/dbraw/zinc/94/90/49/1129949049.db2.gz LJLGEWOFPZQPLJ-UHFFFAOYSA-N 1 0 259.393 3.935 20 10 CHCDRO COc1cc(C)cc(C[N@@H+]2CC[C@H](C)C3(CCC3)C2)c1O ZINC000770672022 1129955058 /nfs/dbraw/zinc/95/50/58/1129955058.db2.gz WPHKANIVXZODIR-AWEZNQCLSA-N 1 0 289.419 3.721 20 10 CHCDRO Oc1ccccc1C[NH2+][C@H]1CC[C@@H](c2ccccc2)C1 ZINC000770739531 1129957530 /nfs/dbraw/zinc/95/75/30/1129957530.db2.gz CRSQIHHETOSGGZ-WBVHZDCISA-N 1 0 267.372 3.818 20 10 CHCDRO C[N@H+](Cc1ccccc1O)[C@@H]1CCc2cccc(F)c2C1 ZINC001171005900 1131413233 /nfs/dbraw/zinc/41/32/33/1131413233.db2.gz SDZOWPRQFACJMK-OAHLLOKOSA-N 1 0 285.362 3.521 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)[C@@H]1C[C@H]1c1ccccc1 ZINC000802300881 1129990245 /nfs/dbraw/zinc/99/02/45/1129990245.db2.gz CZNFQNWPYAAFQM-CCKFTAQKSA-N 1 0 293.410 3.903 20 10 CHCDRO CCc1ccc(C[N@H+](C)Cc2ccc(N(C)C)cc2)o1 ZINC000771935188 1129996934 /nfs/dbraw/zinc/99/69/34/1129996934.db2.gz NMSAVYZWZAEFDP-UHFFFAOYSA-N 1 0 272.392 3.540 20 10 CHCDRO CNc1ccc(C)cc1C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000902489667 1130016702 /nfs/dbraw/zinc/01/67/02/1130016702.db2.gz KGMAUODAISXJKS-HNNXBMFYSA-N 1 0 297.446 3.954 20 10 CHCDRO CCCC[NH+](Cc1ccccc1O)Cc1ccccc1O ZINC000802657736 1130027842 /nfs/dbraw/zinc/02/78/42/1130027842.db2.gz PLCMMWRPDBXRKT-UHFFFAOYSA-N 1 0 285.387 3.900 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CC[C@@](F)(c2ccccc2)C1 ZINC000802657254 1130028365 /nfs/dbraw/zinc/02/83/65/1130028365.db2.gz XNYIVBKDJDPANW-KRWDZBQOSA-N 1 0 289.325 3.602 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCC2(CCCCC2)O1)c1ccccc1O ZINC000786431602 1130094136 /nfs/dbraw/zinc/09/41/36/1130094136.db2.gz ROZQWNAZRIALGN-LSDHHAIUSA-N 1 0 289.419 3.925 20 10 CHCDRO Cc1c(C)c(N(C)C(C)(C)C[NH3+])ccc1OCC(C)C ZINC001170060891 1130109304 /nfs/dbraw/zinc/10/93/04/1130109304.db2.gz WKVPODYQDHGRFC-UHFFFAOYSA-N 1 0 278.440 3.512 20 10 CHCDRO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)C[C@H]1CCSC1 ZINC000787091556 1130130476 /nfs/dbraw/zinc/13/04/76/1130130476.db2.gz UBDKFKSDYNRWBB-MRXNPFEDSA-N 1 0 292.492 3.716 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@H]2CCSC(C)(C)C2)c1O ZINC000903280458 1130144224 /nfs/dbraw/zinc/14/42/24/1130144224.db2.gz BORAPIKRJSOJFV-NEPJUHHUSA-N 1 0 295.448 3.726 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2c(C)cc(CO)cc2C)c(O)c1 ZINC000903307784 1130149993 /nfs/dbraw/zinc/14/99/93/1130149993.db2.gz KNPGHUUCISISNP-OAHLLOKOSA-N 1 0 299.414 3.661 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1cncs1)c1ccc(C)cc1O ZINC000903312725 1130151506 /nfs/dbraw/zinc/15/15/06/1130151506.db2.gz XXROKCJCXJDKMK-YPMHNXCESA-N 1 0 276.405 3.959 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1cncs1)c1ccc(C)cc1O ZINC000903312722 1130151789 /nfs/dbraw/zinc/15/17/89/1130151789.db2.gz XXROKCJCXJDKMK-DGCLKSJQSA-N 1 0 276.405 3.959 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2cncs2)c(O)c1 ZINC000903312557 1130152195 /nfs/dbraw/zinc/15/21/95/1130152195.db2.gz WQNPKOAFJZZDTO-WDEREUQCSA-N 1 0 262.378 3.569 20 10 CHCDRO C[C@H]([NH2+][C@H](c1ccccn1)C1CC1)c1ccc(N(C)C)cc1 ZINC000903341308 1130163118 /nfs/dbraw/zinc/16/31/18/1130163118.db2.gz XLAMYHDHSHAZRZ-LIRRHRJNSA-N 1 0 295.430 3.950 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCOC23CCCC3)c(O)c1C ZINC000903383043 1130169116 /nfs/dbraw/zinc/16/91/16/1130169116.db2.gz LKCLRMCBUQGDAM-GDBMZVCRSA-N 1 0 289.419 3.761 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCc2cccnc2C)c(O)c1C ZINC000903416465 1130173541 /nfs/dbraw/zinc/17/35/41/1130173541.db2.gz UCVNZKMAHBHQGF-HNNXBMFYSA-N 1 0 284.403 3.606 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CCCOCC(C)C)c(O)c1 ZINC000788507978 1130192046 /nfs/dbraw/zinc/19/20/46/1130192046.db2.gz SXCQGZGHPOFCGR-HNNXBMFYSA-N 1 0 279.424 3.722 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H](C(C)C)[C@H](O)c2ccccc2)c1 ZINC000788537965 1130193780 /nfs/dbraw/zinc/19/37/80/1130193780.db2.gz ZZCPYDLFELPTAK-RBUKOAKNSA-N 1 0 299.414 3.548 20 10 CHCDRO Cc1cccc([C@H](O)C[NH2+][C@H](C)c2c(C)cc(C)cc2O)c1 ZINC000788669443 1130202177 /nfs/dbraw/zinc/20/21/77/1130202177.db2.gz OMKYUFHMYSRCJE-CRAIPNDOSA-N 1 0 299.414 3.702 20 10 CHCDRO CCOC[C@H]([NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F)C(C)C ZINC000788985783 1130222041 /nfs/dbraw/zinc/22/20/41/1130222041.db2.gz RXMTXMLFOVTWCR-UBHSHLNASA-N 1 0 295.398 3.730 20 10 CHCDRO CC(C)C[C@@H]1CCC[N@@H+]1Cc1cc2c(cc1O)CCC2 ZINC000748790689 1130246669 /nfs/dbraw/zinc/24/66/69/1130246669.db2.gz CMNIICFSXFMFCH-KRWDZBQOSA-N 1 0 273.420 3.891 20 10 CHCDRO 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C[N@H+](Cc1ccncc1)Cc1ccc(C(C)(C)C)cc1O ZINC001235676776 1130766694 /nfs/dbraw/zinc/76/66/94/1130766694.db2.gz URLFPYFADRFHBT-UHFFFAOYSA-N 1 0 284.403 3.717 20 10 CHCDRO CO[C@H]1CC[N@H+](Cc2ccc(C(C)(C)C)cc2O)[C@H](C)C1 ZINC001235682403 1130768987 /nfs/dbraw/zinc/76/89/87/1130768987.db2.gz WTYZOFLAIUAOEV-CJNGLKHVSA-N 1 0 291.435 3.689 20 10 CHCDRO CCN(C)c1ccc(C[N@H+](C)Cc2cnc(C)s2)cc1 ZINC000773730231 1130771252 /nfs/dbraw/zinc/77/12/52/1130771252.db2.gz MNGXHLNEHNZFTN-UHFFFAOYSA-N 1 0 289.448 3.540 20 10 CHCDRO CC[C@H]([NH2+]CC(C)(C)COC)c1cc(Cl)ccc1O ZINC000813883033 1130794461 /nfs/dbraw/zinc/79/44/61/1130794461.db2.gz PIOGNXZLSNXWIL-ZDUSSCGKSA-N 1 0 285.815 3.759 20 10 CHCDRO COCC(C)(C)C[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000813883259 1130795046 /nfs/dbraw/zinc/79/50/46/1130795046.db2.gz RSSDKHZDRIZNKE-CYBMUJFWSA-N 1 0 291.435 3.594 20 10 CHCDRO Cc1cccc(C)c1OCC[NH2+][C@H](C)c1ccccc1O ZINC000783500478 1130830637 /nfs/dbraw/zinc/83/06/37/1130830637.db2.gz HJWLIUIWNNGDJO-OAHLLOKOSA-N 1 0 285.387 3.739 20 10 CHCDRO C[C@H]([NH2+][C@@H]1C[C@@H]2[C@H](C1)C2(C)C)c1ccc(N(C)C)cc1 ZINC001170728102 1130831473 /nfs/dbraw/zinc/83/14/73/1130831473.db2.gz ROXGEANYVJKTQU-ZFZWDLNGSA-N 1 0 272.436 3.838 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1COc2ccc(Cl)cc21)c1ccccc1O ZINC000783518828 1130833873 /nfs/dbraw/zinc/83/38/73/1130833873.db2.gz PBJKIDLPSJJQCH-QMTHXVAHSA-N 1 0 289.762 3.830 20 10 CHCDRO C[C@H]([NH2+][C@H]1c2ccccc2C[C@H]1C)c1ccccc1O ZINC000783522542 1130834185 /nfs/dbraw/zinc/83/41/85/1130834185.db2.gz PFRFMCZHAWJXET-FHSNZYRGSA-N 1 0 267.372 3.976 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]C[C@@H]1CCCCC(F)(F)C1 ZINC000814169202 1130837963 /nfs/dbraw/zinc/83/79/63/1130837963.db2.gz FEEDXJJPFCSHFU-LLVKDONJSA-N 1 0 287.325 3.837 20 10 CHCDRO CCOc1ccc(C[NH2+][C@H]2CC[C@H](CC)CC2)c(O)c1 ZINC000814299791 1130861938 /nfs/dbraw/zinc/86/19/38/1130861938.db2.gz CPNQIJCIBMKGRZ-CTYIDZIISA-N 1 0 277.408 3.849 20 10 CHCDRO CCOc1ccc(C[NH2+]C(C)(C)C(C)(C)C)c(O)c1 ZINC000814301025 1130862579 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CO[C@H](C[NH2+]Cc1cc(-c2ccccc2)ccc1O)C1CC1 ZINC000815153767 1130963010 /nfs/dbraw/zinc/96/30/10/1130963010.db2.gz XXHOGXKNNPTQSS-LJQANCHMSA-N 1 0 297.398 3.574 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc(-c2ccccc2)ccc1O)C(C)(C)O ZINC000815155913 1130963169 /nfs/dbraw/zinc/96/31/69/1130963169.db2.gz ZDTNWYHSATVGFM-GOSISDBHSA-N 1 0 299.414 3.698 20 10 CHCDRO COc1ccc(CC[NH2+][C@@H](C)c2c(C)cc(C)cc2O)cc1 ZINC000815553406 1130998456 /nfs/dbraw/zinc/99/84/56/1130998456.db2.gz ZHQTWYPXLAHOMK-HNNXBMFYSA-N 1 0 299.414 3.911 20 10 CHCDRO CCCCOCCC[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000815552568 1130998513 /nfs/dbraw/zinc/99/85/13/1130998513.db2.gz FATRRQFRSRADGR-HNNXBMFYSA-N 1 0 279.424 3.866 20 10 CHCDRO CO[C@@H](C[NH2+][C@@H](C)c1c(C)cc(C)cc1O)C(C)(C)C ZINC000815585222 1131004311 /nfs/dbraw/zinc/00/43/11/1131004311.db2.gz BDNCAQISDXQXQG-ZFWWWQNUSA-N 1 0 279.424 3.721 20 10 CHCDRO COCCC1(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)CCC1 ZINC000815589259 1131004820 /nfs/dbraw/zinc/00/48/20/1131004820.db2.gz NHHUFTGDZPVUMF-OAHLLOKOSA-N 1 0 291.435 3.866 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H](C)c2ccncc2)c(O)c1 ZINC000815586993 1131005324 /nfs/dbraw/zinc/00/53/24/1131005324.db2.gz WSDSFEWLVJWSML-HUUCEWRRSA-N 1 0 284.403 3.858 20 10 CHCDRO Cc1ncc(CC[NH2+][C@H](C)c2c(C)cc(C)cc2O)s1 ZINC000815596803 1131005703 /nfs/dbraw/zinc/00/57/03/1131005703.db2.gz FEFCSHLEYHBKAR-GFCCVEGCSA-N 1 0 290.432 3.667 20 10 CHCDRO CCc1ccc(C[N@@H+]2CCC[C@@H]2c2cc(C)on2)c(O)c1 ZINC001236784628 1131006492 /nfs/dbraw/zinc/00/64/92/1131006492.db2.gz XIVDQPHISNTCBP-MRXNPFEDSA-N 1 0 286.375 3.588 20 10 CHCDRO CCc1ccc(C[N@@H+]2CC[C@@H](F)C(F)(F)CC2)c(O)c1 ZINC001236783279 1131006644 /nfs/dbraw/zinc/00/66/44/1131006644.db2.gz JOFIJURIRBJKTF-CQSZACIVSA-N 1 0 287.325 3.524 20 10 CHCDRO CCc1ccc(C[N@H+](C)Cc2ccccc2C)c(O)c1 ZINC001236789642 1131006702 /nfs/dbraw/zinc/00/67/02/1131006702.db2.gz PQECALAHYAYVAL-UHFFFAOYSA-N 1 0 269.388 3.895 20 10 CHCDRO CCc1ccc(C[N@@H+]2CC[C@H]3CCCC[C@@H]3C2)c(O)c1 ZINC001236787610 1131007409 /nfs/dbraw/zinc/00/74/09/1131007409.db2.gz IQOZXSVVBPHDLR-HZPDHXFCSA-N 1 0 273.420 3.967 20 10 CHCDRO COc1ccc2ccc(O)c(C[N@@H+]3CCC=C(C)C3)c2c1 ZINC000797821750 1131007767 /nfs/dbraw/zinc/00/77/67/1131007767.db2.gz DFFJZEJJINQHNN-UHFFFAOYSA-N 1 0 283.371 3.706 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H](C)Cc2ccc(O)cc2)c(O)c1 ZINC000815576437 1131008029 /nfs/dbraw/zinc/00/80/29/1131008029.db2.gz QHXNNJRSJXABJR-GJZGRUSLSA-N 1 0 299.414 3.996 20 10 CHCDRO CCc1ccc(C[N@@H+]2CCc3ccc(F)cc3C2)c(O)c1 ZINC001236795676 1131008337 /nfs/dbraw/zinc/00/83/37/1131008337.db2.gz YUHSNLJFNGJLIW-UHFFFAOYSA-N 1 0 285.362 3.652 20 10 CHCDRO COc1cc(O)c(C[NH+]2C[C@@H]3CCCC[C@H]3C2)c(Cl)c1 ZINC001236797547 1131008672 /nfs/dbraw/zinc/00/86/72/1131008672.db2.gz GHCJWYVKYUOHKI-RYUDHWBXSA-N 1 0 295.810 3.676 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C2Cc3ccccc3C2)c(O)c1 ZINC000815616742 1131009975 /nfs/dbraw/zinc/00/99/75/1131009975.db2.gz XBWDIMUHTITBHM-AWEZNQCLSA-N 1 0 281.399 3.827 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2cnn3ccccc23)c(O)c1 ZINC000815625489 1131010320 /nfs/dbraw/zinc/01/03/20/1131010320.db2.gz FJOGYCSERXLABM-AWEZNQCLSA-N 1 0 295.386 3.508 20 10 CHCDRO COc1cc(C)c(C[N@@H+]2CCCC3(CCCC3)C2)c(O)c1 ZINC001236807658 1131012175 /nfs/dbraw/zinc/01/21/75/1131012175.db2.gz HWUVCFOFAWVUDV-UHFFFAOYSA-N 1 0 289.419 3.865 20 10 CHCDRO CC[C@H]([NH2+]CC[C@@H](C)F)c1ccc(N(C)C)cc1 ZINC000815645533 1131015021 /nfs/dbraw/zinc/01/50/21/1131015021.db2.gz IXAPVWXQNNAZHT-DOMZBBRYSA-N 1 0 252.377 3.541 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]CC[C@H](C)F)c1O ZINC000815645452 1131015314 /nfs/dbraw/zinc/01/53/14/1131015314.db2.gz FYWUYUWNKMITBP-VHSXEESVSA-N 1 0 259.752 3.753 20 10 CHCDRO CC(C)O[C@@H]1CC[N@H+](Cc2cc3ccccc3cc2O)C1 ZINC001236835042 1131018486 /nfs/dbraw/zinc/01/84/86/1131018486.db2.gz GGHOKLJCPCIQFR-QGZVFWFLSA-N 1 0 285.387 3.545 20 10 CHCDRO CCCO[C@@H]1CC[N@H+](Cc2cc3ccccc3cc2O)C1 ZINC001236833223 1131019467 /nfs/dbraw/zinc/01/94/67/1131019467.db2.gz AZKHQIZEQUQIDT-QGZVFWFLSA-N 1 0 285.387 3.546 20 10 CHCDRO Oc1cc2ccccc2cc1C[N@@H+]1CCC[C@H](CF)C1 ZINC001236839576 1131020484 /nfs/dbraw/zinc/02/04/84/1131020484.db2.gz GUCORMAUGMMUAT-CYBMUJFWSA-N 1 0 273.351 3.727 20 10 CHCDRO CCCC1CC[NH+](Cc2ccc(OCC)cc2O)CC1 ZINC001237041024 1131038463 /nfs/dbraw/zinc/03/84/63/1131038463.db2.gz ALPLGSVTAFBLFL-UHFFFAOYSA-N 1 0 277.408 3.803 20 10 CHCDRO CCOc1ccc(C[NH+](CC(C)C)CC(C)C)c(O)c1 ZINC001237043161 1131038751 /nfs/dbraw/zinc/03/87/51/1131038751.db2.gz GBRDMBLXNBCAKJ-UHFFFAOYSA-N 1 0 279.424 3.905 20 10 CHCDRO CC(C)c1ccc(C[NH+]2C[C@H]3CCC[C@@H]3C2)c(O)c1 ZINC001237045799 1131040958 /nfs/dbraw/zinc/04/09/58/1131040958.db2.gz KXLYKEPEYOKJFL-HUUCEWRRSA-N 1 0 259.393 3.748 20 10 CHCDRO CCCC[N@H+](CC)Cc1c(O)ccc(F)c1Cl ZINC001237122750 1131048333 /nfs/dbraw/zinc/04/83/33/1131048333.db2.gz XTVQHKPUAAPOLI-UHFFFAOYSA-N 1 0 259.752 3.807 20 10 CHCDRO C[N@H+](Cc1c(O)ccc(F)c1Cl)CC(C)(C)C ZINC001237122935 1131054828 /nfs/dbraw/zinc/05/48/28/1131054828.db2.gz AFPFZCXUYMDXOA-UHFFFAOYSA-N 1 0 259.752 3.663 20 10 CHCDRO Oc1ccc(F)c(Cl)c1C[N@@H+]1CCCC(F)(F)CC1 ZINC001237121213 1131055913 /nfs/dbraw/zinc/05/59/13/1131055913.db2.gz KZWYCPDUGAPKDL-UHFFFAOYSA-N 1 0 293.716 3.806 20 10 CHCDRO CCC[N@H+](CC)Cc1cc(C(F)(F)F)ccc1O ZINC001237138232 1131056562 /nfs/dbraw/zinc/05/65/62/1131056562.db2.gz WBYHXTLPLQPZRG-UHFFFAOYSA-N 1 0 261.287 3.643 20 10 CHCDRO CCC[N@H+](Cc1ccc2ccccc2c1O)C1CC1 ZINC000816485792 1131098794 /nfs/dbraw/zinc/09/87/94/1131098794.db2.gz AEXNBTIEVRCCHZ-UHFFFAOYSA-N 1 0 255.361 3.920 20 10 CHCDRO Cc1cccc(C[N@@H+](C)Cc2cc(Cl)c(F)cc2[O-])n1 ZINC000816515006 1131104162 /nfs/dbraw/zinc/10/41/62/1131104162.db2.gz MRDAACFPYKDCDC-UHFFFAOYSA-N 1 0 294.757 3.520 20 10 CHCDRO CC[N@H+](Cc1ccc(OC)cc1)Cc1c(C)cccc1O ZINC001237491044 1131104316 /nfs/dbraw/zinc/10/43/16/1131104316.db2.gz FPBLMERRNKIJPM-UHFFFAOYSA-N 1 0 285.387 3.731 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+]1CCc2cc(Cl)ccc2C1 ZINC001237488005 1131104754 /nfs/dbraw/zinc/10/47/54/1131104754.db2.gz OMGFSDUQNNCACY-UHFFFAOYSA-N 1 0 287.790 3.912 20 10 CHCDRO Oc1c(C[NH2+]CCN2CCCCCC2)ccc2ccccc21 ZINC000816532440 1131105320 /nfs/dbraw/zinc/10/53/20/1131105320.db2.gz HHLVMLNEHTUDGE-UHFFFAOYSA-N 1 0 298.430 3.511 20 10 CHCDRO CC(C)CCOCC[NH2+]Cc1ccc2ccccc2c1O ZINC000816542944 1131105607 /nfs/dbraw/zinc/10/56/07/1131105607.db2.gz IJCSSRHGGPLGFT-UHFFFAOYSA-N 1 0 287.403 3.698 20 10 CHCDRO C[C@H](C[NH2+]Cc1ccc2ccccc2c1O)C1CC1 ZINC000816538705 1131105753 /nfs/dbraw/zinc/10/57/53/1131105753.db2.gz CHWVWELINFGILX-GFCCVEGCSA-N 1 0 255.361 3.681 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H]2CCCC[C@@H]2OC)cc1 ZINC000799728774 1131106098 /nfs/dbraw/zinc/10/60/98/1131106098.db2.gz FAGHJGMNSXZKGI-WBAXXEDZSA-N 1 0 290.451 3.751 20 10 CHCDRO CC1=CC[C@H]([NH2+]CCCSc2nccs2)CC1 ZINC000816553177 1131109811 /nfs/dbraw/zinc/10/98/11/1131109811.db2.gz LPVCIAZQNBPYBR-LBPRGKRZSA-N 1 0 268.451 3.714 20 10 CHCDRO CCC1(C[NH2+]Cc2ccc3ccccc3c2O)CCOCC1 ZINC000816554082 1131110013 /nfs/dbraw/zinc/11/00/13/1131110013.db2.gz OCCYCGOEBGAHGO-UHFFFAOYSA-N 1 0 299.414 3.842 20 10 CHCDRO CC(C)OCCCC[NH2+]Cc1ccc2ccccc2c1O ZINC000816566789 1131112650 /nfs/dbraw/zinc/11/26/50/1131112650.db2.gz GRDMGIDNWZFOMV-UHFFFAOYSA-N 1 0 287.403 3.840 20 10 CHCDRO C[N@H+](Cc1ccncc1)Cc1ccc2ccccc2c1O ZINC000816569072 1131112832 /nfs/dbraw/zinc/11/28/32/1131112832.db2.gz YOOKLWFEUKJHST-UHFFFAOYSA-N 1 0 278.355 3.572 20 10 CHCDRO CSCCC[N@H+](C)Cc1ccc2ccccc2c1O ZINC000816599408 1131114544 /nfs/dbraw/zinc/11/45/44/1131114544.db2.gz LOFFWDYTPIMFPA-UHFFFAOYSA-N 1 0 275.417 3.730 20 10 CHCDRO CC[N@H+](Cc1ccncc1)Cc1ccc2ccccc2c1O ZINC000816610247 1131115805 /nfs/dbraw/zinc/11/58/05/1131115805.db2.gz DHACQGBWOIHNBZ-UHFFFAOYSA-N 1 0 292.382 3.963 20 10 CHCDRO COC1(CC[NH2+]Cc2ccc3ccccc3c2O)CCC1 ZINC000816638427 1131117636 /nfs/dbraw/zinc/11/76/36/1131117636.db2.gz MDJFPSYOVCQRCL-UHFFFAOYSA-N 1 0 285.387 3.594 20 10 CHCDRO C[N@H+](Cc1cc(-c2ccc(F)cc2)ccc1O)C1CC1 ZINC001237641720 1131124063 /nfs/dbraw/zinc/12/40/63/1131124063.db2.gz WHAHQKUPGQWDGW-UHFFFAOYSA-N 1 0 271.335 3.793 20 10 CHCDRO [O-]c1c(Cl)cc(F)cc1C[N@@H+]1CC[C@@H](C(F)(F)F)C1 ZINC001237800446 1131140365 /nfs/dbraw/zinc/14/03/65/1131140365.db2.gz YZZOQWUQJWHNAQ-MRVPVSSYSA-N 1 0 297.679 3.569 20 10 CHCDRO C[C@@H]1C[C@@H](C)CC[N@@H+]1Cc1cc(F)cc(Cl)c1[O-] ZINC001237798440 1131141176 /nfs/dbraw/zinc/14/11/76/1131141176.db2.gz FNHVHSHUHITTEJ-VHSXEESVSA-N 1 0 271.763 3.805 20 10 CHCDRO C[C@H](c1cccnc1)[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001116590488 1131156204 /nfs/dbraw/zinc/15/62/04/1131156204.db2.gz WMGLNVJVLPJLHZ-MRXNPFEDSA-N 1 0 295.430 3.875 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]Cc2cc(C)nc(C)c2)cc1 ZINC000817411461 1131160914 /nfs/dbraw/zinc/16/09/14/1131160914.db2.gz RNJDCENLUNUXHB-UHFFFAOYSA-N 1 0 297.446 3.834 20 10 CHCDRO Cc1cc(F)cc(C[N@@H+]2CCc3ccccc3[C@@H]2C)c1O ZINC001238056369 1131165399 /nfs/dbraw/zinc/16/53/99/1131165399.db2.gz HKOAHNPJGUCBFZ-ZDUSSCGKSA-N 1 0 285.362 3.959 20 10 CHCDRO Cc1cc(F)cc(C[N@H+]2Cc3ccccc3C[C@@H]2C)c1O ZINC001238069287 1131167078 /nfs/dbraw/zinc/16/70/78/1131167078.db2.gz IFNOSJCYFPHKKT-ZDUSSCGKSA-N 1 0 285.362 3.787 20 10 CHCDRO Cc1cc(F)cc(C[N@H+]2CCCCC[C@H]2C)c1O ZINC001238062140 1131167160 /nfs/dbraw/zinc/16/71/60/1131167160.db2.gz UZKSMYJJPZRVIV-GFCCVEGCSA-N 1 0 251.345 3.604 20 10 CHCDRO CO[C@H]1CCCC[C@@H]1[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2C ZINC001116925145 1131170728 /nfs/dbraw/zinc/17/07/28/1131170728.db2.gz MIFZBAZGBKFMTC-YXWQFLTLSA-N 1 0 289.419 3.796 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]C[C@H]1CC13CCSCC3)CC2 ZINC000817590629 1131175267 /nfs/dbraw/zinc/17/52/67/1131175267.db2.gz ZFXYGZBXRQYBNP-ZIAGYGMSSA-N 1 0 289.444 3.502 20 10 CHCDRO Cc1ccc([C@@H]([NH2+]CCc2ccc(N)cc2)C2CC2)cc1 ZINC000817955963 1131190391 /nfs/dbraw/zinc/19/03/91/1131190391.db2.gz MEDYVPHXQBQLSX-LJQANCHMSA-N 1 0 280.415 3.861 20 10 CHCDRO Nc1ccc(CC[NH2+][C@@H]2CCCC23CCCC3)cc1 ZINC000817956831 1131190398 /nfs/dbraw/zinc/19/03/98/1131190398.db2.gz DTTRRXGMNZOLBC-MRXNPFEDSA-N 1 0 258.409 3.514 20 10 CHCDRO CC[C@@H]1C[C@@H](C)CC[C@@H]1[NH2+]CCc1ccc(N)cc1 ZINC000817957130 1131191070 /nfs/dbraw/zinc/19/10/70/1131191070.db2.gz JJRCQWWRVABOCY-LXZKKBNFSA-N 1 0 260.425 3.616 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccc(N)cc1)c1ccsc1 ZINC000817958785 1131191080 /nfs/dbraw/zinc/19/10/80/1131191080.db2.gz YHJVNSYZRNQWIL-HNNXBMFYSA-N 1 0 260.406 3.614 20 10 CHCDRO C[C@H]([NH2+]CCc1ccc(N)cc1)c1cccc(Cl)c1 ZINC000817956175 1131191134 /nfs/dbraw/zinc/19/11/34/1131191134.db2.gz SPPFGAVLNULKAN-LBPRGKRZSA-N 1 0 274.795 3.816 20 10 CHCDRO Cc1cccc(C[C@H]([NH2+]CCc2ccc(N)cc2)C2CC2)c1 ZINC000817956402 1131191178 /nfs/dbraw/zinc/19/11/78/1131191178.db2.gz YHGNRHXEXGMQHR-FQEVSTJZSA-N 1 0 294.442 3.731 20 10 CHCDRO CC1(C)Cc2occc2[C@H]([NH2+]CCc2ccc(N)cc2)C1 ZINC000817956456 1131191422 /nfs/dbraw/zinc/19/14/22/1131191422.db2.gz ZKWJXSHEEJPXDQ-MRXNPFEDSA-N 1 0 284.403 3.708 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]C/C=C\C2CC2)c1O ZINC001117712577 1131193541 /nfs/dbraw/zinc/19/35/41/1131193541.db2.gz IONZZEULGNRRNF-DLRQAJBASA-N 1 0 265.784 3.971 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H](CN)C2CCCC2)c1O ZINC000817981430 1131195324 /nfs/dbraw/zinc/19/53/24/1131195324.db2.gz JHMWOXYRISLVQX-ABAIWWIYSA-N 1 0 296.842 3.522 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(C)cc(N)c1)c1ccc(C)cc1O ZINC000817980408 1131195467 /nfs/dbraw/zinc/19/54/67/1131195467.db2.gz LCULTPXNFQJJCM-KRWDZBQOSA-N 1 0 284.403 3.832 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCC(C)(C)C1)c1cc(F)ccc1O ZINC000168861916 1131203112 /nfs/dbraw/zinc/20/31/12/1131203112.db2.gz QICPOAXNPOPSIX-ZYHUDNBSSA-N 1 0 251.345 3.761 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1C[C@H]1C1CCC1)c1cc(F)ccc1O ZINC000818344856 1131209746 /nfs/dbraw/zinc/20/97/46/1131209746.db2.gz HKCFGINRKPLGAW-GMXABZIVSA-N 1 0 263.356 3.618 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CCC[C@@H](F)C2)c(O)c1 ZINC001118177623 1131214254 /nfs/dbraw/zinc/21/42/54/1131214254.db2.gz VFQFPQKWGQIURP-BFHYXJOUSA-N 1 0 265.372 3.940 20 10 CHCDRO Cc1cc(C[NH+]2CC(C(F)F)C2)c(C)n1-c1ccccc1 ZINC001137859404 1131424733 /nfs/dbraw/zinc/42/47/33/1131424733.db2.gz WUUKDJCXMCVSNJ-UHFFFAOYSA-N 1 0 290.357 3.791 20 10 CHCDRO CN(Cc1cccs1)c1ccc(C[NH2+]CCCF)cc1 ZINC000824002375 1131449570 /nfs/dbraw/zinc/44/95/70/1131449570.db2.gz LGUSLXXIISLKAA-UHFFFAOYSA-N 1 0 292.423 3.834 20 10 CHCDRO COc1cccc(C[NH2+]CC[C@H]2CCc3ccccc32)c1O ZINC000824548961 1131473192 /nfs/dbraw/zinc/47/31/92/1131473192.db2.gz UFDRALDYNDDPLT-OAHLLOKOSA-N 1 0 297.398 3.611 20 10 CHCDRO CCOc1ccc(C[N@H+](C)Cc2ccccc2O)c(C)c1 ZINC000824593937 1131476305 /nfs/dbraw/zinc/47/63/05/1131476305.db2.gz VSRSOPUIAIOINF-UHFFFAOYSA-N 1 0 285.387 3.731 20 10 CHCDRO CC[C@@H](C)[C@@H](C[NH2+]Cc1ccc2ccccc2c1O)OC ZINC000824597661 1131476649 /nfs/dbraw/zinc/47/66/49/1131476649.db2.gz WEWVXVCKGXWSAG-CXAGYDPISA-N 1 0 287.403 3.696 20 10 CHCDRO C[N@H+](Cc1ccc(N2CCCCC2)cc1)C1CC(F)(F)C1 ZINC001138213824 1131478061 /nfs/dbraw/zinc/47/80/61/1131478061.db2.gz AZZYCDUVYGHLHB-UHFFFAOYSA-N 1 0 294.389 3.906 20 10 CHCDRO CC1(C)C[NH+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC001138214242 1131478205 /nfs/dbraw/zinc/47/82/05/1131478205.db2.gz ZCMBFHPRBKHXGV-UHFFFAOYSA-N 1 0 258.409 3.519 20 10 CHCDRO F[C@@H]1C[C@@H]2C[C@H]1C[N@@H+]2Cc1ccc(N2CCCCC2)cc1 ZINC001138218920 1131478539 /nfs/dbraw/zinc/47/85/39/1131478539.db2.gz YGSGLPCFHLNCEY-RYQLBKOJSA-N 1 0 288.410 3.609 20 10 CHCDRO F[C@H]1C[C@@H]2C[C@H]1C[N@@H+]2Cc1ccc(N2CCCCC2)cc1 ZINC001138221047 1131478871 /nfs/dbraw/zinc/47/88/71/1131478871.db2.gz YGSGLPCFHLNCEY-SZMVWBNQSA-N 1 0 288.410 3.609 20 10 CHCDRO Cc1ccc(O)c(C[N@H+]2CC[C@@H](C(F)(F)F)C[C@@H]2C)c1 ZINC000824714793 1131480768 /nfs/dbraw/zinc/48/07/68/1131480768.db2.gz GIWFOCNJRMTSAU-WCQYABFASA-N 1 0 287.325 3.863 20 10 CHCDRO Cc1c(C[N@@H+]2CCC3(CCC3)C2)c2ccccc2n1C ZINC001138258262 1131483060 /nfs/dbraw/zinc/48/30/60/1131483060.db2.gz NOFJVLZREIBDJQ-UHFFFAOYSA-N 1 0 268.404 3.863 20 10 CHCDRO CN1CCCc2cc(C[NH+]3CCC(C(F)F)CC3)ccc21 ZINC001138356611 1131494286 /nfs/dbraw/zinc/49/42/86/1131494286.db2.gz RXLYVCQKPNRAEI-UHFFFAOYSA-N 1 0 294.389 3.546 20 10 CHCDRO C[C@H]1C[C@@H]([NH2+]Cc2ccc3ccccc3c2O)c2nccn21 ZINC000825016886 1131494711 /nfs/dbraw/zinc/49/47/11/1131494711.db2.gz ITYNWAIGYWEBLK-BLLLJJGKSA-N 1 0 293.370 3.538 20 10 CHCDRO C[C@H]1C[C@H]([NH2+]Cc2ccc3ccccc3c2O)c2nccn21 ZINC000825016889 1131494820 /nfs/dbraw/zinc/49/48/20/1131494820.db2.gz ITYNWAIGYWEBLK-LRDDRELGSA-N 1 0 293.370 3.538 20 10 CHCDRO CCCc1ncc(C[NH2+][C@H](CC)c2ccccc2O)o1 ZINC000825085457 1131499127 /nfs/dbraw/zinc/49/91/27/1131499127.db2.gz KVVFKHHXEHCMGH-CQSZACIVSA-N 1 0 274.364 3.574 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CCC[C@]2(CCOC2)C1 ZINC000825134450 1131499880 /nfs/dbraw/zinc/49/98/80/1131499880.db2.gz ZJWDWWBCOHJXBM-IBGZPJMESA-N 1 0 297.398 3.548 20 10 CHCDRO CCCc1ccc(C[N@@H+]2CCc3cccc(O)c3C2)s1 ZINC001138527091 1131516353 /nfs/dbraw/zinc/51/63/53/1131516353.db2.gz DPHWYTUKBFMLFA-UHFFFAOYSA-N 1 0 287.428 3.965 20 10 CHCDRO Cc1c(F)cc(F)cc1C[N@@H+]1CCc2cccc(O)c2C1 ZINC001143767997 1131531161 /nfs/dbraw/zinc/53/11/61/1131531161.db2.gz UNMDHNSDPFGWCE-UHFFFAOYSA-N 1 0 289.325 3.537 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc2c(c1)CCCO2)[C@@H]1CC1(C)C ZINC001202870776 1131555779 /nfs/dbraw/zinc/55/57/79/1131555779.db2.gz WYUVZEHNYMEWAL-HOTGVXAUSA-N 1 0 273.420 3.926 20 10 CHCDRO C[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000035275581 1131558784 /nfs/dbraw/zinc/55/87/84/1131558784.db2.gz AYDXSPPKCJYZIC-QAPCUYQASA-N 1 0 272.436 3.955 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CNc3ccccc3C2)c(O)c1C ZINC000844921603 1131608035 /nfs/dbraw/zinc/60/80/35/1131608035.db2.gz QCRXOYOIIJFIES-ZBFHGGJFSA-N 1 0 296.414 3.696 20 10 CHCDRO Cc1ccc(CC[N@@H+](C)Cc2cc(F)ccc2O)cc1 ZINC001140055413 1131659594 /nfs/dbraw/zinc/65/95/94/1131659594.db2.gz WUVQDQLRWZDZOV-UHFFFAOYSA-N 1 0 273.351 3.514 20 10 CHCDRO Cc1ccc(C)c(C[N@H+](C)Cc2cnc(Cl)s2)c1O ZINC001140178728 1131672909 /nfs/dbraw/zinc/67/29/09/1131672909.db2.gz VUVVLFUJQPGXMI-UHFFFAOYSA-N 1 0 296.823 3.751 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[C@H]2C2CCC2)c1 ZINC000845972180 1131674013 /nfs/dbraw/zinc/67/40/13/1131674013.db2.gz PILSNVXCPIQLEL-HZUKXOBISA-N 1 0 275.392 3.630 20 10 CHCDRO Cc1ccc(C)c(C[NH+]2CCC(C(C)C)CC2)c1O ZINC001140184406 1131674239 /nfs/dbraw/zinc/67/42/39/1131674239.db2.gz SDBMYRIVWJNOMQ-UHFFFAOYSA-N 1 0 261.409 3.877 20 10 CHCDRO Cc1ccc(C)c(C[N@H+]2Cc3ccccc3C[C@@H]2C)c1O ZINC001140184388 1131674509 /nfs/dbraw/zinc/67/45/09/1131674509.db2.gz RMPWJPBKXKFKDI-HNNXBMFYSA-N 1 0 281.399 3.956 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](COC)CC(C)(C)C)c1ccccc1O ZINC000845993348 1131679303 /nfs/dbraw/zinc/67/93/03/1131679303.db2.gz YGPOALJTIORNFW-UKRRQHHQSA-N 1 0 279.424 3.884 20 10 CHCDRO C[C@@H]1C[C@@H]1c1ccc(C[NH2+][C@@H]2CCc3cccc(O)c32)o1 ZINC000834518165 1131680915 /nfs/dbraw/zinc/68/09/15/1131680915.db2.gz DYAWEPAUVMCXLD-BYCMXARLSA-N 1 0 283.371 3.886 20 10 CHCDRO C[C@@H]1C[C@@H]1c1ccc(C[NH2+][C@H]2CCc3cccc(O)c32)o1 ZINC000834518168 1131681194 /nfs/dbraw/zinc/68/11/94/1131681194.db2.gz DYAWEPAUVMCXLD-UGFHNGPFSA-N 1 0 283.371 3.886 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)[C@@](C)(O)c1ccccc1)c1ccccc1O ZINC000846044042 1131683745 /nfs/dbraw/zinc/68/37/45/1131683745.db2.gz NKUKJLGRTLLUSH-UCLAIMLFSA-N 1 0 299.414 3.729 20 10 CHCDRO CCC[C@@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1ccccn1 ZINC000834566960 1131683967 /nfs/dbraw/zinc/68/39/67/1131683967.db2.gz WBHNYAPSQBTTAK-HZPDHXFCSA-N 1 0 282.387 3.906 20 10 CHCDRO COc1cc(CC[NH2+][C@@H]2CCc3cccc(O)c32)ccc1C ZINC000834598066 1131686230 /nfs/dbraw/zinc/68/62/30/1131686230.db2.gz MNUQNBKZKPAITC-MRXNPFEDSA-N 1 0 297.398 3.529 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2CC[C@]3(CC3(F)F)C2)c1O ZINC000846118674 1131688452 /nfs/dbraw/zinc/68/84/52/1131688452.db2.gz YIOQPEHLLXWGDM-ZDUSSCGKSA-N 1 0 287.737 3.585 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]C[C@H](C)C(C)(C)C)c1O ZINC000846148433 1131691054 /nfs/dbraw/zinc/69/10/54/1131691054.db2.gz ZIGOHEVVVGOOSO-RYUDHWBXSA-N 1 0 265.397 3.734 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]CCc1cc3ccccc3o1)CC2 ZINC000834663997 1131691813 /nfs/dbraw/zinc/69/18/13/1131691813.db2.gz LRNAFJGKKDNRKQ-MRXNPFEDSA-N 1 0 293.366 3.958 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CC23CCC(CC2)C3)c1O ZINC000846156568 1131692158 /nfs/dbraw/zinc/69/21/58/1131692158.db2.gz GAGPLBXNDDKXFT-POZPTJLLSA-N 1 0 275.392 3.632 20 10 CHCDRO C=Cc1ccc(CC[NH2+][C@@H](C)c2cccc(OC)c2O)cc1 ZINC000846168703 1131692835 /nfs/dbraw/zinc/69/28/35/1131692835.db2.gz CSOQPHLNUAOJSR-AWEZNQCLSA-N 1 0 297.398 3.937 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@H]2C[C@H](c3ccccc3)C2)c1O ZINC000846166996 1131692983 /nfs/dbraw/zinc/69/29/83/1131692983.db2.gz FWSYLQATJHKWDS-FVQBIDKESA-N 1 0 297.398 3.998 20 10 CHCDRO Cc1cccc(C)c1C[NH2+][C@H]1CCc2cccc(O)c21 ZINC000834685146 1131693497 /nfs/dbraw/zinc/69/34/97/1131693497.db2.gz JHYCJZPZKCEKNS-INIZCTEOSA-N 1 0 267.372 3.786 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H](C)c2ccsc2)c1O ZINC000846169283 1131693722 /nfs/dbraw/zinc/69/37/22/1131693722.db2.gz ZQQSKAMBQTYYOZ-MNOVXSKESA-N 1 0 277.389 3.874 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]Cc2ccc(Cl)cc2)c1O ZINC000846135540 1131693747 /nfs/dbraw/zinc/69/37/47/1131693747.db2.gz DMORBWTZTUWXOY-LLVKDONJSA-N 1 0 291.778 3.905 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H](C)Cc2ccccc2C)c1O ZINC000846141322 1131694927 /nfs/dbraw/zinc/69/49/27/1131694927.db2.gz HSHSFUOFSJMNAQ-GJZGRUSLSA-N 1 0 299.414 3.991 20 10 CHCDRO CCc1cccc(C[NH2+][C@H](C)c2cccc(OC)c2O)c1 ZINC000846208941 1131695728 /nfs/dbraw/zinc/69/57/28/1131695728.db2.gz MVHBBEVVDCSROJ-CYBMUJFWSA-N 1 0 285.387 3.814 20 10 CHCDRO CCC[C@H](C)[C@@H](CO)[NH2+][C@H](CC)c1ccc(C)cc1O ZINC000846183996 1131696908 /nfs/dbraw/zinc/69/69/08/1131696908.db2.gz LLPPMKUDFJFFQF-NUEKZKHPSA-N 1 0 279.424 3.538 20 10 CHCDRO CC[C@@H](CC(F)(F)F)[NH2+][C@H]1CCc2cccc(O)c21 ZINC000834765454 1131703304 /nfs/dbraw/zinc/70/33/04/1131703304.db2.gz MJKRQBOTBZWNRI-QWRGUYRKSA-N 1 0 273.298 3.700 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@H]1C[C@H](c3ccccc3)C1)CC2 ZINC000834790728 1131705186 /nfs/dbraw/zinc/70/51/86/1131705186.db2.gz VDEFTRSLHISLCA-ULQDDVLXSA-N 1 0 279.383 3.915 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCOC1(C)C)c1cc(Cl)ccc1O ZINC000834875795 1131715807 /nfs/dbraw/zinc/71/58/07/1131715807.db2.gz UMCLNSXXVCXAQJ-GXTWGEPZSA-N 1 0 283.799 3.654 20 10 CHCDRO CC[C@@](C)(C[NH2+][C@H](C)c1cc(Cl)ccc1O)OC ZINC000834883165 1131717429 /nfs/dbraw/zinc/71/74/29/1131717429.db2.gz ZOWPICLAQJKAPE-YGRLFVJLSA-N 1 0 271.788 3.511 20 10 CHCDRO C[C@]1(C[NH2+][C@@H]2CCc3cccc(O)c32)CC1(Cl)Cl ZINC000834884052 1131717988 /nfs/dbraw/zinc/71/79/88/1131717988.db2.gz IRVJOGHYFHNFAC-ZWNOBZJWSA-N 1 0 286.202 3.553 20 10 CHCDRO CC[C@H]([NH2+]Cc1cnccc1C)c1ccc(N(C)C)cc1 ZINC000834887105 1131719209 /nfs/dbraw/zinc/71/92/09/1131719209.db2.gz HNQYJQDTZFGQMI-SFHVURJKSA-N 1 0 283.419 3.697 20 10 CHCDRO CC[C@H]([NH2+][C@H]1C[C@H](C)n2ccnc21)c1ccc(C)cc1O ZINC000834895822 1131720748 /nfs/dbraw/zinc/72/07/48/1131720748.db2.gz RVIDWFLDJIOEBP-QEJZJMRPSA-N 1 0 285.391 3.644 20 10 CHCDRO CC[C@H]([NH2+][C@H]1C[C@H](C)n2ccnc21)c1ccc(N(C)C)cc1 ZINC000834897579 1131722242 /nfs/dbraw/zinc/72/22/42/1131722242.db2.gz UQFYEPDNMQAGCR-JQFCIGGWSA-N 1 0 298.434 3.696 20 10 CHCDRO CCc1ncc(C[NH2+][C@H](C)c2ccc(N(C)CC)cc2)o1 ZINC000834900435 1131723196 /nfs/dbraw/zinc/72/31/96/1131723196.db2.gz PUURUWCJQJTCAX-CYBMUJFWSA-N 1 0 287.407 3.544 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H]2C[C@H]2C2CC2)c(O)c1 ZINC000834906139 1131728979 /nfs/dbraw/zinc/72/89/79/1131728979.db2.gz NCGSFXHZFHNVJF-QEJZJMRPSA-N 1 0 259.393 3.706 20 10 CHCDRO C[C@@H]([NH2+]CCC1CC(F)(F)C1)c1cc(F)ccc1O ZINC000834908973 1131730066 /nfs/dbraw/zinc/73/00/66/1131730066.db2.gz NVUDOIHXNDFIFA-SECBINFHSA-N 1 0 273.298 3.617 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCOC(C)(C)C2)c(O)c1C ZINC000834910335 1131730811 /nfs/dbraw/zinc/73/08/11/1131730811.db2.gz OEFGBMQIGUOEHV-GJZGRUSLSA-N 1 0 291.435 3.865 20 10 CHCDRO CCO[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000834911178 1131731952 /nfs/dbraw/zinc/73/19/52/1131731952.db2.gz HLFSKEJNNXDOCO-BMGDILEWSA-N 1 0 290.451 3.751 20 10 CHCDRO CC[C@@H]1CCC[N@H+](Cc2ccc(Cl)cc2O)C1 ZINC001140465662 1131751249 /nfs/dbraw/zinc/75/12/49/1131751249.db2.gz QIIHWYQDJXFZQB-LLVKDONJSA-N 1 0 253.773 3.668 20 10 CHCDRO Cc1cccc(C[N@@H+](C)C/C=C/c2ccc(N(C)C)cc2)n1 ZINC000835026577 1131760044 /nfs/dbraw/zinc/76/00/44/1131760044.db2.gz VTRQQIRJRWMGJO-SOFGYWHQSA-N 1 0 295.430 3.601 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]CCc2cccs2)cc1 ZINC000835033659 1131760459 /nfs/dbraw/zinc/76/04/59/1131760459.db2.gz ILVYLRXFFQEOMD-HWKANZROSA-N 1 0 286.444 3.660 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CC[C@@H](c3ccncc3)C2)cc1 ZINC000846907815 1131760749 /nfs/dbraw/zinc/76/07/49/1131760749.db2.gz KDUBEDJCWIGEEE-GOSISDBHSA-N 1 0 295.430 3.527 20 10 CHCDRO C[C@@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)c1cccc(O)c1 ZINC000835037360 1131760945 /nfs/dbraw/zinc/76/09/45/1131760945.db2.gz JOSLACMSESLQPK-LLYBFZRZSA-N 1 0 296.414 3.822 20 10 CHCDRO C[C@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)c1cccnc1 ZINC000835036711 1131761417 /nfs/dbraw/zinc/76/14/17/1131761417.db2.gz QMLDXOOEVKCNNM-DRDHIDPGSA-N 1 0 281.403 3.512 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]C[C@]2(C)CCCS2)cc1 ZINC000835041447 1131762179 /nfs/dbraw/zinc/76/21/79/1131762179.db2.gz CHFLKWKKOKEPPH-YXMMZVCTSA-N 1 0 290.476 3.641 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+][C@@H]2CCC(F)(F)C2)cc1 ZINC000835042913 1131762307 /nfs/dbraw/zinc/76/23/07/1131762307.db2.gz LVOINSAXMLNDPH-VQTKUKTRSA-N 1 0 280.362 3.543 20 10 CHCDRO C[C@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)c1cncc(F)c1 ZINC000835048171 1131764869 /nfs/dbraw/zinc/76/48/69/1131764869.db2.gz MNVWYVMCEYJVLH-WSNITJDQSA-N 1 0 299.393 3.651 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CCC2CC(F)(F)C2)cc1C ZINC000835061993 1131767863 /nfs/dbraw/zinc/76/78/63/1131767863.db2.gz WNXYALUYJJEMJI-UHFFFAOYSA-N 1 0 269.335 3.534 20 10 CHCDRO CC1(C)C[C@@H](C[NH2+]Cc2ccc3ccccc3c2O)CCO1 ZINC000835061417 1131767878 /nfs/dbraw/zinc/76/78/78/1131767878.db2.gz ZEBHSUBDGHQHEP-AWEZNQCLSA-N 1 0 299.414 3.840 20 10 CHCDRO CC1(C)C[N@H+](Cc2c([O-])cc(F)cc2F)CCC1(F)F ZINC001140582082 1131808055 /nfs/dbraw/zinc/80/80/55/1131808055.db2.gz BWNFSUWQNABAMG-UHFFFAOYSA-N 1 0 291.288 3.538 20 10 CHCDRO C[C@H]1CC[C@H]([N@H+](C)Cc2c([O-])cc(F)cc2F)CC1 ZINC001140585211 1131810084 /nfs/dbraw/zinc/81/00/84/1131810084.db2.gz ZNJBTZUBMAZNBX-UMSPYCQHSA-N 1 0 269.335 3.681 20 10 CHCDRO CC[N@H+](Cc1cccc(F)c1)Cc1cc(C)ccc1O ZINC001140623568 1131833348 /nfs/dbraw/zinc/83/33/48/1131833348.db2.gz VVHSGDYAEOMRQN-UHFFFAOYSA-N 1 0 273.351 3.862 20 10 CHCDRO Cc1c(O)ccc(C[N@@H+]2CCC[C@@H]3CCCC[C@H]32)c1O ZINC001140749130 1131906301 /nfs/dbraw/zinc/90/63/01/1131906301.db2.gz QUCDOJHEZKCANS-DZGCQCFKSA-N 1 0 275.392 3.561 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CC=CCC2)cc1 ZINC000772999041 1131910265 /nfs/dbraw/zinc/91/02/65/1131910265.db2.gz HVSIBKLBLDUEKK-GOEBONIOSA-N 1 0 258.409 3.902 20 10 CHCDRO Cc1cc(F)ccc1C[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC001140780615 1131913918 /nfs/dbraw/zinc/91/39/18/1131913918.db2.gz FZROOVPNBZFKJB-UHFFFAOYSA-N 1 0 286.394 3.832 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H](C)C2CCC2)cc1 ZINC000773105792 1131945606 /nfs/dbraw/zinc/94/56/06/1131945606.db2.gz QWRJYDOHXWKIFQ-ZIAGYGMSSA-N 1 0 260.425 3.982 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCCC[C@@H](F)C2)c(O)c1 ZINC001140851015 1131948016 /nfs/dbraw/zinc/94/80/16/1131948016.db2.gz YJONHSMRHSFGAJ-OAHLLOKOSA-N 1 0 294.414 3.562 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CC[C@@H](C)C[C@H]2C)c(O)c1 ZINC001140856345 1131948503 /nfs/dbraw/zinc/94/85/03/1131948503.db2.gz YNPDZGGLYAEWFX-HUUCEWRRSA-N 1 0 290.451 3.859 20 10 CHCDRO CCC(CC)[N@H+](C)Cc1ccc(N(CC)CC)cc1O ZINC001140855707 1131948616 /nfs/dbraw/zinc/94/86/16/1131948616.db2.gz JEWSCPOYIYUNQX-UHFFFAOYSA-N 1 0 278.440 3.859 20 10 CHCDRO CSC1CC[NH+](Cc2ccc(N(C)C)cc2Cl)CC1 ZINC001140925133 1131964719 /nfs/dbraw/zinc/96/47/19/1131964719.db2.gz OLLFXCKVUWWLOS-UHFFFAOYSA-N 1 0 298.883 3.733 20 10 CHCDRO Cc1ccc(C[N@@H+]2CCc3ccccc3[C@@H]2C)c(O)c1 ZINC001140948056 1131969118 /nfs/dbraw/zinc/96/91/18/1131969118.db2.gz RBIUYRBEBWMLBV-AWEZNQCLSA-N 1 0 267.372 3.820 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCc2c(F)cccc2C1)c1ccccc1O ZINC001171404112 1131970103 /nfs/dbraw/zinc/97/01/03/1131970103.db2.gz FPHQRZAMGKXTJS-TZMCWYRMSA-N 1 0 285.362 3.739 20 10 CHCDRO Cc1ccc(C[NH+]2CCC3(CC[C@H](F)C3)CC2)c(O)c1 ZINC001140957738 1131974317 /nfs/dbraw/zinc/97/43/17/1131974317.db2.gz MDGQOMVPXCFSGF-HNNXBMFYSA-N 1 0 277.383 3.805 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)Cc1ccco1)c1ccccc1O ZINC000036993587 1131985595 /nfs/dbraw/zinc/98/55/95/1131985595.db2.gz WUNCNCKKLKQFEO-WFASDCNBSA-N 1 0 259.349 3.657 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H](C)Cc2ccco2)c(O)c1 ZINC000036993359 1131986450 /nfs/dbraw/zinc/98/64/50/1131986450.db2.gz MAGZFBCGIFBTTF-OLZOCXBDSA-N 1 0 259.349 3.575 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)Cc2ccco2)c1 ZINC000036994204 1131986689 /nfs/dbraw/zinc/98/66/89/1131986689.db2.gz ZKHAOBYBTYHTKW-STQMWFEESA-N 1 0 259.349 3.575 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCC[C@H](C)[C@H]2C)c1 ZINC000037021699 1131989119 /nfs/dbraw/zinc/98/91/19/1131989119.db2.gz RTYOOPIAZDHRTK-RSUWNVLCSA-N 1 0 277.408 3.876 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CC[C@H]2CCCS2)c1 ZINC000715700266 1131990035 /nfs/dbraw/zinc/99/00/35/1131990035.db2.gz XWDUTNBMDOUBKP-QWHCGFSZSA-N 1 0 265.422 3.637 20 10 CHCDRO CC1CC[NH+](Cc2cc3c4c(c2)CCCN4CCC3)CC1 ZINC001141074868 1132006231 /nfs/dbraw/zinc/00/62/31/1132006231.db2.gz VNVSHGSTTXVIAX-UHFFFAOYSA-N 1 0 284.447 3.617 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(F)cc1)c1ccc(N(C)C)cc1 ZINC000037211077 1132021664 /nfs/dbraw/zinc/02/16/64/1132021664.db2.gz BACRCZURTLZASS-ZDUSSCGKSA-N 1 0 272.367 3.743 20 10 CHCDRO C[C@@H]([NH2+]C(C1CC1)C1CC1)c1ccc(N(C)C)cc1 ZINC000037230168 1132023018 /nfs/dbraw/zinc/02/30/18/1132023018.db2.gz RILJKECYJAXOOE-GFCCVEGCSA-N 1 0 258.409 3.592 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)C1CCCCC1 ZINC000037233608 1132023381 /nfs/dbraw/zinc/02/33/81/1132023381.db2.gz NRMIGYQKTSDROJ-CQSZACIVSA-N 1 0 260.425 3.811 20 10 CHCDRO C[C@H](Cc1ccco1)[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000037291938 1132027748 /nfs/dbraw/zinc/02/77/48/1132027748.db2.gz FUNQDJWVAZLHRU-ZIAGYGMSSA-N 1 0 272.392 3.627 20 10 CHCDRO Oc1ccc(O)c(C[N@@H+]2CCC[C@H](c3ccccc3)CC2)c1 ZINC001141161186 1132031719 /nfs/dbraw/zinc/03/17/19/1132031719.db2.gz OFSAMVQHNUQFGZ-INIZCTEOSA-N 1 0 297.398 3.868 20 10 CHCDRO Cc1cccc2c1CC[C@@H]([N@@H+]1CCc3cccc(O)c3C1)C2 ZINC001171572194 1132058608 /nfs/dbraw/zinc/05/86/08/1132058608.db2.gz ABTMTTNVWGLVKX-QGZVFWFLSA-N 1 0 293.410 3.616 20 10 CHCDRO CC[C@H](C)OCC[C@@H](C)[NH2+]Cc1ccc(OC)c(C)c1 ZINC001172322195 1132160019 /nfs/dbraw/zinc/16/00/19/1132160019.db2.gz ARYXDEHGUBATRW-CABCVRRESA-N 1 0 279.424 3.687 20 10 CHCDRO CC[C@@H](C)OCC[C@H](C)[NH2+][C@H](C)c1ccccc1O ZINC001172343475 1132178002 /nfs/dbraw/zinc/17/80/02/1132178002.db2.gz QFMXGXDHTJRTLG-BFHYXJOUSA-N 1 0 265.397 3.637 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]C2(C3CCC3)CCC2)c1 ZINC000839186972 1132187772 /nfs/dbraw/zinc/18/77/72/1132187772.db2.gz RDRPPGDHLOFULT-GFCCVEGCSA-N 1 0 275.392 3.774 20 10 CHCDRO C[N@H+](Cc1ccccc1O)Cc1cc2cccnc2cc1F ZINC001141634591 1132217992 /nfs/dbraw/zinc/21/79/92/1132217992.db2.gz KCBWVERABNQITR-UHFFFAOYSA-N 1 0 296.345 3.712 20 10 CHCDRO C[C@@H]([NH2+]CC[C@H](O)c1ccccc1)c1ccc(N(C)C)cc1 ZINC000839563845 1132223840 /nfs/dbraw/zinc/22/38/40/1132223840.db2.gz PEBVMBGJJWIHPA-BEFAXECRSA-N 1 0 298.430 3.527 20 10 CHCDRO CO[C@@H]1C[C@@H]([NH2+][C@H](C)c2ccc(C)c(C)c2O)C12CCC2 ZINC000840806492 1132289056 /nfs/dbraw/zinc/28/90/56/1132289056.db2.gz HUGUJAHEFOILTP-FVQBIDKESA-N 1 0 289.419 3.617 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CCO[C@H]1CC)c1cc(Cl)ccc1O ZINC000840820017 1132290762 /nfs/dbraw/zinc/29/07/62/1132290762.db2.gz FKMFHEZWIFJFMN-NFAWXSAZSA-N 1 0 283.799 3.654 20 10 CHCDRO CO[C@@](C)([C@@H](C)[NH2+][C@@H](C)c1ccc(N(C)C)cc1)C1CC1 ZINC000840861369 1132297036 /nfs/dbraw/zinc/29/70/36/1132297036.db2.gz VGHFJGGGKDGDEN-IYOUNJFTSA-N 1 0 290.451 3.607 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1C[C@@H](C)O[C@@H]1C)c1cc(Cl)ccc1O ZINC000840871915 1132298819 /nfs/dbraw/zinc/29/88/19/1132298819.db2.gz ICDBPFDSTWLQQD-DDHJBXDOSA-N 1 0 283.799 3.510 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)C1(OC)CCC1)c1ccc(N(C)C)cc1 ZINC000840883712 1132302167 /nfs/dbraw/zinc/30/21/67/1132302167.db2.gz HOMBKQOIZSHWLT-WMLDXEAASA-N 1 0 290.451 3.751 20 10 CHCDRO CSc1ccc(C[N@@H+]2CCc3cccc(O)c3C2)s1 ZINC001142029095 1132302747 /nfs/dbraw/zinc/30/27/47/1132302747.db2.gz KEKAINFJPSPHEU-UHFFFAOYSA-N 1 0 291.441 3.734 20 10 CHCDRO Cc1nc(C)c(C[NH2+]Cc2c(O)cc(C)cc2Cl)s1 ZINC000840904915 1132307433 /nfs/dbraw/zinc/30/74/33/1132307433.db2.gz PHKMMVRDTFYNEP-UHFFFAOYSA-N 1 0 296.823 3.717 20 10 CHCDRO CCOC[C@H]1CCC[N@H+](Cc2c(O)cc(C)cc2Cl)C1 ZINC000840914759 1132308967 /nfs/dbraw/zinc/30/89/67/1132308967.db2.gz FUWBTAULMUBLRO-ZDUSSCGKSA-N 1 0 297.826 3.603 20 10 CHCDRO CCc1ccc(C[N@@H+]2CCc3cccc(O)c3C2)s1 ZINC001231502376 1132309140 /nfs/dbraw/zinc/30/91/40/1132309140.db2.gz BQBMMVIFAVFEJB-UHFFFAOYSA-N 1 0 273.401 3.574 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CC[C@H](c2ccco2)C1 ZINC000840918021 1132309848 /nfs/dbraw/zinc/30/98/48/1132309848.db2.gz OCFGHIMLGNYIPY-INIZCTEOSA-N 1 0 284.403 3.644 20 10 CHCDRO CSCCCCC[NH2+]Cc1ccc(N(C)C)cc1C ZINC000840939117 1132310268 /nfs/dbraw/zinc/31/02/68/1132310268.db2.gz UMZKVQKCQDCYFA-UHFFFAOYSA-N 1 0 280.481 3.684 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+](C)[C@@H](C)c1cccc(O)c1 ZINC000840918458 1132310443 /nfs/dbraw/zinc/31/04/43/1132310443.db2.gz UDFFULFFMQBHEE-HNNXBMFYSA-N 1 0 298.430 3.960 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CC[C@@H](c2ccco2)C1 ZINC000840918022 1132310587 /nfs/dbraw/zinc/31/05/87/1132310587.db2.gz OCFGHIMLGNYIPY-MRXNPFEDSA-N 1 0 284.403 3.644 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](c1ccccn1)C(C)C ZINC000840934749 1132310735 /nfs/dbraw/zinc/31/07/35/1132310735.db2.gz WWDHLIZYKPNBKU-IBGZPJMESA-N 1 0 297.446 3.943 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H](C)[C@H]2CC2(F)F)cc1 ZINC000840965299 1132314062 /nfs/dbraw/zinc/31/40/62/1132314062.db2.gz BRXOLHJSLBIEMS-IUODEOHRSA-N 1 0 282.378 3.666 20 10 CHCDRO Cc1cc(O)c(C[NH2+]Cc2cnccc2C(C)(C)C)cc1C ZINC000840959923 1132314439 /nfs/dbraw/zinc/31/44/39/1132314439.db2.gz YGRZNRRTBKNFMV-UHFFFAOYSA-N 1 0 298.430 3.991 20 10 CHCDRO CC(C)OCC(C)(C)[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC000840973195 1132315695 /nfs/dbraw/zinc/31/56/95/1132315695.db2.gz FNJBCFLTQWRJIR-BQYQJAHWSA-N 1 0 290.451 3.559 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CCC[C@H](F)CC1 ZINC001231588817 1132317317 /nfs/dbraw/zinc/31/73/17/1132317317.db2.gz VLEDFCGDWCZFRD-AWEZNQCLSA-N 1 0 273.351 3.869 20 10 CHCDRO C[C@]1(F)CC[N@H+](Cc2c(O)ccc3ccccc32)C[C@@H]1F ZINC001231587627 1132319323 /nfs/dbraw/zinc/31/93/23/1132319323.db2.gz WSISTPCOUCEPBE-IRXDYDNUSA-N 1 0 291.341 3.817 20 10 CHCDRO Cc1cccc(C[NH+]2CCC3(CCC(C)(C)O3)CC2)c1O ZINC001231595318 1132321208 /nfs/dbraw/zinc/32/12/08/1132321208.db2.gz WONUSWMNNNQLIC-UHFFFAOYSA-N 1 0 289.419 3.624 20 10 CHCDRO Nc1ccc(CC[NH2+][C@@H]2CCC[C@H]2c2ccccc2)cc1 ZINC000841034070 1132321150 /nfs/dbraw/zinc/32/11/50/1132321150.db2.gz GEQDQDVKPBXLNI-RBUKOAKNSA-N 1 0 280.415 3.737 20 10 CHCDRO CC[N@H+](Cc1cccc(F)c1)Cc1cccc(C)c1O ZINC001231594185 1132321304 /nfs/dbraw/zinc/32/13/04/1132321304.db2.gz VSZZDBXLHGQLQF-UHFFFAOYSA-N 1 0 273.351 3.862 20 10 CHCDRO C[C@@H]1[C@@H]([NH2+]CCc2ccc(N)cc2)C[C@@H]1c1ccccc1 ZINC000841037135 1132322670 /nfs/dbraw/zinc/32/26/70/1132322670.db2.gz YLUYCNXIGDYYIB-JVPBZIDWSA-N 1 0 280.415 3.593 20 10 CHCDRO C[NH2+]Cc1cccc(NC/C=C\c2ccc(N(C)C)cc2)c1 ZINC000841043805 1132324020 /nfs/dbraw/zinc/32/40/20/1132324020.db2.gz WPIQINYMLNAMIV-ALCCZGGFSA-N 1 0 295.430 3.597 20 10 CHCDRO CCCCC1CC[NH+](Cc2cc(OC)c(O)cc2O)CC1 ZINC001231633669 1132332115 /nfs/dbraw/zinc/33/21/15/1132332115.db2.gz RYVDTXDLKVIYHG-UHFFFAOYSA-N 1 0 293.407 3.509 20 10 CHCDRO Cc1ccc2c(c1)C[C@H]([N@@H+]1CCc3cccc(O)c3C1)CC2 ZINC001172844361 1132335847 /nfs/dbraw/zinc/33/58/47/1132335847.db2.gz RPEZLCJMYFTFSZ-GOSISDBHSA-N 1 0 293.410 3.616 20 10 CHCDRO COc1cccc2c1C[N@H+](Cc1c(C)cc(C)cc1O)CC2 ZINC001231842500 1132376101 /nfs/dbraw/zinc/37/61/01/1132376101.db2.gz NNTDCGCKQVMPDZ-UHFFFAOYSA-N 1 0 297.398 3.576 20 10 CHCDRO Cc1cc(C)c(C[N@H+]2C[C@@H]3CCCC[C@@H]3C2)c(O)c1 ZINC001231842580 1132376894 /nfs/dbraw/zinc/37/68/94/1132376894.db2.gz OTSGATUJFREGPB-GASCZTMLSA-N 1 0 259.393 3.631 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCC[C@@H](C(F)(F)F)C2)c(O)c1 ZINC001231845930 1132379513 /nfs/dbraw/zinc/37/95/13/1132379513.db2.gz VGLBWQNPNNKPJR-GFCCVEGCSA-N 1 0 287.325 3.783 20 10 CHCDRO COc1cc(N(C)C)ccc1C[N@@H+]1CCC12CCCCC2 ZINC001231852266 1132379561 /nfs/dbraw/zinc/37/95/61/1132379561.db2.gz STCFDHLNVSZEBY-UHFFFAOYSA-N 1 0 288.435 3.670 20 10 CHCDRO CCC[N@@H+](Cc1ccc(N(C)C)cc1OC)CC(C)C ZINC001231854314 1132379623 /nfs/dbraw/zinc/37/96/23/1132379623.db2.gz CKXQJHQUZYTOSN-UHFFFAOYSA-N 1 0 278.440 3.629 20 10 CHCDRO Cc1cc(O)c(C[NH+]2CCCCCC2)cc1Cl ZINC001231866373 1132381735 /nfs/dbraw/zinc/38/17/35/1132381735.db2.gz FNJFDUWVPXQSLI-UHFFFAOYSA-N 1 0 253.773 3.730 20 10 CHCDRO CCOCC1CC[NH+](Cc2cc(Cl)c(C)cc2O)CC1 ZINC001231870003 1132384324 /nfs/dbraw/zinc/38/43/24/1132384324.db2.gz FOEBOESYXNPDTO-UHFFFAOYSA-N 1 0 297.826 3.603 20 10 CHCDRO Cc1cc(O)c(C[NH+]2CC3CCC(CC3)C2)cc1Cl ZINC001231869972 1132385717 /nfs/dbraw/zinc/38/57/17/1132385717.db2.gz CRDFEODVSJDKLY-UHFFFAOYSA-N 1 0 279.811 3.976 20 10 CHCDRO C[C@@H]([NH2+][C@@H](CO)C1CCCCC1)c1ccc(Cl)cc1O ZINC000841751190 1132389048 /nfs/dbraw/zinc/38/90/48/1132389048.db2.gz MILRQXZGGSHEHP-ABAIWWIYSA-N 1 0 297.826 3.637 20 10 CHCDRO Oc1c(C[N@H+]2C[C@H]3[C@H](CC3(F)F)C2)ccc2ccccc21 ZINC001231879359 1132389335 /nfs/dbraw/zinc/38/93/35/1132389335.db2.gz CLTHLDPGQOKVGS-HIFRSBDPSA-N 1 0 289.325 3.632 20 10 CHCDRO Oc1c(C[N@@H+]2CC[C@H]3CCCO[C@@H]3C2)ccc2ccccc21 ZINC001231879346 1132390304 /nfs/dbraw/zinc/39/03/04/1132390304.db2.gz CGPTXAFTCKNZNF-CRAIPNDOSA-N 1 0 297.398 3.546 20 10 CHCDRO C[C@H]([NH2+]CCOC1CCCC1)c1ccc(Cl)cc1O ZINC000841748686 1132390453 /nfs/dbraw/zinc/39/04/53/1132390453.db2.gz YDTFVSUMUCOLRA-NSHDSACASA-N 1 0 283.799 3.655 20 10 CHCDRO Oc1c(C[N@H+](CC2CC2)C2CC2)ccc2ccccc21 ZINC001231883328 1132391458 /nfs/dbraw/zinc/39/14/58/1132391458.db2.gz OJDKDTYDOUDZEX-UHFFFAOYSA-N 1 0 267.372 3.920 20 10 CHCDRO CO[C@@](C)([C@H](C)[NH2+][C@H](C)c1ccc(Cl)cc1O)C1CC1 ZINC000841756510 1132392041 /nfs/dbraw/zinc/39/20/41/1132392041.db2.gz WNNVADQODZLWHW-GDLVEWKHSA-N 1 0 297.826 3.900 20 10 CHCDRO CO[C@@H](C[NH2+][C@@H](C)c1ccc(C)c(C)c1O)CC(C)C ZINC000841754766 1132392472 /nfs/dbraw/zinc/39/24/72/1132392472.db2.gz DIUFOCPJQXXFLI-LSDHHAIUSA-N 1 0 279.424 3.721 20 10 CHCDRO C[C@H]([NH2+][C@@H]1C[C@H](C)n2ccnc21)c1ccc(Cl)cc1O ZINC000841759245 1132393268 /nfs/dbraw/zinc/39/32/68/1132393268.db2.gz XSDTWPFEIRBTOC-OUJBWJOFSA-N 1 0 291.782 3.599 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](CO)CC2CCCCC2)c(O)c1 ZINC000841760980 1132396148 /nfs/dbraw/zinc/39/61/48/1132396148.db2.gz HLJFXZKJRWYVIW-GOEBONIOSA-N 1 0 291.435 3.683 20 10 CHCDRO C[C@@H]([NH2+][C@H]1COCc2ccccc21)c1ccc(N(C)C)cc1 ZINC000841762357 1132397164 /nfs/dbraw/zinc/39/71/64/1132397164.db2.gz WNLZVJPYKYALCN-KUHUBIRLSA-N 1 0 296.414 3.675 20 10 CHCDRO Oc1cccc(Cl)c1C[NH+]1CCC(OC2CCC2)CC1 ZINC000841889067 1132401939 /nfs/dbraw/zinc/40/19/39/1132401939.db2.gz ZMHURZZSIKBFDW-UHFFFAOYSA-N 1 0 295.810 3.579 20 10 CHCDRO C[N@H+](Cc1ccnc(C(C)(C)C)c1)Cc1ccccc1O ZINC001232220186 1132438906 /nfs/dbraw/zinc/43/89/06/1132438906.db2.gz GJJLCTYUSPFXFB-UHFFFAOYSA-N 1 0 284.403 3.717 20 10 CHCDRO CCc1ccc(C[C@H](C)[NH2+]Cc2cccc(C)c2O)cc1 ZINC001173241998 1132441771 /nfs/dbraw/zinc/44/17/71/1132441771.db2.gz RTJJYFQIYYEUKX-HNNXBMFYSA-N 1 0 283.415 3.984 20 10 CHCDRO CC[C@H]1CC[C@@H]([N@H+](C)Cc2ccc(N(C)C)cc2)C1 ZINC001173297192 1132445326 /nfs/dbraw/zinc/44/53/26/1132445326.db2.gz XJWFQEVVYIGLPU-WMLDXEAASA-N 1 0 260.425 3.763 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CCC[C@H](C)[C@H]2C)cc1Cl ZINC001232264949 1132446609 /nfs/dbraw/zinc/44/66/09/1132446609.db2.gz PDNGOFVVJKSUEY-WDEREUQCSA-N 1 0 283.799 3.675 20 10 CHCDRO C[C@@H](C[NH2+]C/C=C\c1ccc(N(C)C)cc1)CC(F)F ZINC000842730399 1132455610 /nfs/dbraw/zinc/45/56/10/1132455610.db2.gz XWZIHSJOIXXTJZ-DSYXLKISSA-N 1 0 282.378 3.647 20 10 CHCDRO COc1cccc(C[NH2+]C2(c3ccc(C)cc3)CCC2)c1O ZINC000842773662 1132460868 /nfs/dbraw/zinc/46/08/68/1132460868.db2.gz KCPSPDAOFXKPRZ-UHFFFAOYSA-N 1 0 297.398 3.878 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]C[C@H]1C[C@@H]1c1ccccc1)CC2 ZINC000842903839 1132474278 /nfs/dbraw/zinc/47/42/78/1132474278.db2.gz YUXLIZPAFGFEDC-ZACQAIPSSA-N 1 0 279.383 3.773 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+][C@@H]2CCS[C@@H]2C)c2c1c(F)ccc2O ZINC000842929958 1132477250 /nfs/dbraw/zinc/47/72/50/1132477250.db2.gz RAWMUMAXUZVUIW-IQIPOGNMSA-N 1 0 281.396 3.563 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCS[C@H]2C)c(O)c1C ZINC000842927934 1132477453 /nfs/dbraw/zinc/47/74/53/1132477453.db2.gz HNNQPQWPSFHBJX-SGMGOOAPSA-N 1 0 265.422 3.554 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCS[C@@H]2C)c(O)c1C ZINC000842927930 1132477527 /nfs/dbraw/zinc/47/75/27/1132477527.db2.gz HNNQPQWPSFHBJX-OUCADQQQSA-N 1 0 265.422 3.554 20 10 CHCDRO CC[C@H]([NH2+]CC1CCC(F)CC1)c1ccccc1O ZINC000842930682 1132477907 /nfs/dbraw/zinc/47/79/07/1132477907.db2.gz ZKUQHLBDLNQFRZ-PIMMBPRGSA-N 1 0 265.372 3.961 20 10 CHCDRO CO[C@H]1CC[N@H+](Cc2cccc(C(C)(C)C)c2O)[C@@H](C)C1 ZINC001143117059 1132504130 /nfs/dbraw/zinc/50/41/30/1132504130.db2.gz RAPMIYMVUNJDBL-ZFWWWQNUSA-N 1 0 291.435 3.689 20 10 CHCDRO CC(C)(C)c1cccc(C[N@H+]2C[C@@H]3[C@H](C2)C3(C)C)c1O ZINC001143111867 1132504310 /nfs/dbraw/zinc/50/43/10/1132504310.db2.gz GXRORHQPTBKBJF-GASCZTMLSA-N 1 0 273.420 3.778 20 10 CHCDRO COc1cc(C)cc(C[N@H+](C)Cc2ccc(N(C)C)cc2)c1 ZINC001143159345 1132510668 /nfs/dbraw/zinc/51/06/68/1132510668.db2.gz ATOBZKMTKMOHRZ-UHFFFAOYSA-N 1 0 298.430 3.702 20 10 CHCDRO Oc1cccc2c1C[N@H+](Cc1cccc3ncsc31)CC2 ZINC001232735726 1132512880 /nfs/dbraw/zinc/51/28/80/1132512880.db2.gz AKBJRXRUWZZOPP-UHFFFAOYSA-N 1 0 296.395 3.560 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)C1CCC(F)(F)CC1 ZINC000843406172 1132527896 /nfs/dbraw/zinc/52/78/96/1132527896.db2.gz LOSRCTYRBSWPHE-UHFFFAOYSA-N 1 0 282.378 3.940 20 10 CHCDRO CN(C)c1ccc(C[N@H+](Cc2ccccc2)C2CC2)c(O)c1 ZINC001232840210 1132528869 /nfs/dbraw/zinc/52/88/69/1132528869.db2.gz PKJVCDMMVOAQMA-UHFFFAOYSA-N 1 0 296.414 3.623 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC3(C2)CCCCC3)c(O)c1 ZINC001232841578 1132529237 /nfs/dbraw/zinc/52/92/37/1132529237.db2.gz KLSDEJYAYMZAJE-UHFFFAOYSA-N 1 0 288.435 3.614 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CC[C@@H]3CCCC[C@@H]32)c(O)c1 ZINC000843416458 1132531055 /nfs/dbraw/zinc/53/10/55/1132531055.db2.gz SDLJIBDLYLDQRF-BBRMVZONSA-N 1 0 275.392 3.555 20 10 CHCDRO CC1(CC(F)F)C[NH+](Cc2c(O)cccc2Cl)C1 ZINC000843425103 1132532186 /nfs/dbraw/zinc/53/21/86/1132532186.db2.gz WDOBHKHELQOTQU-UHFFFAOYSA-N 1 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/nfs/dbraw/zinc/35/29/71/1133352971.db2.gz BXWSJXBUAQAZQH-UHFFFAOYSA-N 1 0 297.398 3.956 20 10 CHCDRO COc1ccc(C[NH2+]CC(C)(C)C2CCOCC2)cc1C ZINC001203855376 1133376116 /nfs/dbraw/zinc/37/61/16/1133376116.db2.gz BNVYHDHHHQAVLR-UHFFFAOYSA-N 1 0 291.435 3.546 20 10 CHCDRO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1ccc(O)c(O)c1 ZINC001203880455 1133378164 /nfs/dbraw/zinc/37/81/64/1133378164.db2.gz SFDQIJLSKGNLPI-MRXNPFEDSA-N 1 0 283.371 3.607 20 10 CHCDRO C[C@@H](c1ccc(Cl)cc1)[N@H+](C)Cc1ccc(O)c(O)c1 ZINC001203879959 1133378355 /nfs/dbraw/zinc/37/83/55/1133378355.db2.gz KWGJXACMQVVZFX-NSHDSACASA-N 1 0 291.778 3.944 20 10 CHCDRO CCN(CC)c1ccc(C[NH+]2C[C@H]3CCC[C@@H]3C2)cc1 ZINC001203936240 1133386015 /nfs/dbraw/zinc/38/60/15/1133386015.db2.gz KVZVKJAKTKJOQX-IAGOWNOFSA-N 1 0 272.436 3.765 20 10 CHCDRO CC[N@H+](Cc1ccc(C)s1)Cc1ccccc1O ZINC001204033593 1133401655 /nfs/dbraw/zinc/40/16/55/1133401655.db2.gz JDGVJMUTCABVSN-UHFFFAOYSA-N 1 0 261.390 3.784 20 10 CHCDRO C[C@@H]1CC[C@H](C)[N@H+](Cc2ccc(Cl)cc2O)C1 ZINC001204164131 1133411603 /nfs/dbraw/zinc/41/16/03/1133411603.db2.gz YNCPEHMOBPNXPL-MNOVXSKESA-N 1 0 253.773 3.666 20 10 CHCDRO CN(C)c1ccc(C[NH+]2CC3CC(C3)C2)c2ccccc21 ZINC001204239691 1133424381 /nfs/dbraw/zinc/42/43/81/1133424381.db2.gz CMVBLMWCHZBRGL-UHFFFAOYSA-N 1 0 280.415 3.748 20 10 CHCDRO CC[C@H](c1ccccc1)[N@H+](C)Cc1ccc(O)cc1O ZINC001204281616 1133428396 /nfs/dbraw/zinc/42/83/96/1133428396.db2.gz XGFULBUOECYOGY-MRXNPFEDSA-N 1 0 271.360 3.681 20 10 CHCDRO CC[N@H+](Cc1cn(C)c2ccccc12)Cc1ccccc1O ZINC001204318826 1133436910 /nfs/dbraw/zinc/43/69/10/1133436910.db2.gz CPCANHJWFCIALH-UHFFFAOYSA-N 1 0 294.398 3.906 20 10 CHCDRO c1ccc(C2C[NH+](Cc3ccc(N4CCCC4)cc3)C2)cc1 ZINC001204320932 1133436939 /nfs/dbraw/zinc/43/69/39/1133436939.db2.gz DWFBBEQTBNSRIQ-UHFFFAOYSA-N 1 0 292.426 3.886 20 10 CHCDRO CN(c1ccc(N)cc1)c1ccc(C[NH2+]C(C)(C)C)cc1 ZINC001204706489 1133477139 /nfs/dbraw/zinc/47/71/39/1133477139.db2.gz WFEIOMVQCWSVRT-UHFFFAOYSA-N 1 0 283.419 3.925 20 10 CHCDRO Cc1ccc(C[N@@H+]2CC[C@H](COc3ccccc3)C2)c(O)c1 ZINC001204960502 1133508432 /nfs/dbraw/zinc/50/84/32/1133508432.db2.gz BKWKRMORVLXZSM-INIZCTEOSA-N 1 0 297.398 3.602 20 10 CHCDRO COC1(C[NH2+]Cc2cc(Cl)c(C)cc2O)CCCCC1 ZINC001205443242 1133578100 /nfs/dbraw/zinc/57/81/00/1133578100.db2.gz ZGGRZCDZZBMNPT-UHFFFAOYSA-N 1 0 297.826 3.793 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCC(C)=C(C)C1 ZINC001205560511 1133588540 /nfs/dbraw/zinc/58/85/40/1133588540.db2.gz BMZNEKGJKCBALS-UHFFFAOYSA-N 1 0 258.409 3.603 20 10 CHCDRO COc1cc(C)c(C[NH+]2CC(C3CCCCC3)C2)c(O)c1 ZINC001206180192 1133668283 /nfs/dbraw/zinc/66/82/83/1133668283.db2.gz HFOJOXZJQUYQSM-UHFFFAOYSA-N 1 0 289.419 3.721 20 10 CHCDRO CC(C)C[C@@H]1C[C@H]1[NH2+]Cc1ccc(Cl)cc1O ZINC001206224976 1133672717 /nfs/dbraw/zinc/67/27/17/1133672717.db2.gz XOMYWTSOGQGCBJ-DGCLKSJQSA-N 1 0 253.773 3.570 20 10 CHCDRO Cc1cccc(C[NH2+]Cc2cc(Cl)ccc2O)c1F ZINC001206517343 1133713338 /nfs/dbraw/zinc/71/33/38/1133713338.db2.gz REWGPEMJQGZVSS-UHFFFAOYSA-N 1 0 279.742 3.783 20 10 CHCDRO COc1cc(Cl)cc(C[N@H+](C)C[C@H]2CC2(C)C)c1O ZINC001206809788 1133751420 /nfs/dbraw/zinc/75/14/20/1133751420.db2.gz MFAJTXYPYVOGEI-LLVKDONJSA-N 1 0 283.799 3.532 20 10 CHCDRO Oc1cccc2c1C[N@H+](Cc1cccc(C(F)F)c1)CC2 ZINC001207131871 1133770389 /nfs/dbraw/zinc/77/03/89/1133770389.db2.gz MTZCZNSNRMSEDT-UHFFFAOYSA-N 1 0 289.325 3.888 20 10 CHCDRO C[N@@H+](Cc1ccc(N2CCCC2)cc1)C[C@@H]1C[C@H]2C=C[C@@H]1C2 ZINC001207626754 1133832824 /nfs/dbraw/zinc/83/28/24/1133832824.db2.gz KZSPEFAPBJYXPB-OTWHNJEPSA-N 1 0 296.458 3.931 20 10 CHCDRO CC[N@H+](CCc1cccc(F)c1)Cc1ccccc1O ZINC001208198532 1133905688 /nfs/dbraw/zinc/90/56/88/1133905688.db2.gz JXUMFPGUUYSPSA-UHFFFAOYSA-N 1 0 273.351 3.596 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@@H](C)c2cccc(C)c2)c1 ZINC000089726325 1133916769 /nfs/dbraw/zinc/91/67/69/1133916769.db2.gz SLXMHXXCQLDGGR-ZDUSSCGKSA-N 1 0 271.360 3.560 20 10 CHCDRO COC[C@H]1CC[N@H+](Cc2ccc(-n3c(C)ccc3C)cc2)C1 ZINC001209516137 1134033388 /nfs/dbraw/zinc/03/33/88/1134033388.db2.gz ARMINCKOYMCUHP-SFHVURJKSA-N 1 0 298.430 3.562 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(C[N@@H+](C)C(C)C)cc1 ZINC001209519452 1134034830 /nfs/dbraw/zinc/03/48/30/1134034830.db2.gz VAWPUHWXDOXUTB-UHFFFAOYSA-N 1 0 256.393 3.934 20 10 CHCDRO Cc1cc(Nc2ccc(F)cc2O)c2ccccc2[nH+]1 ZINC001210013992 1134122721 /nfs/dbraw/zinc/12/27/21/1134122721.db2.gz ASTBKQJJAARDSF-UHFFFAOYSA-N 1 0 268.291 3.553 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2cc(C)c(C)cc2O)cc1 ZINC000301398928 1134472010 /nfs/dbraw/zinc/47/20/10/1134472010.db2.gz LLTIYZWCTJQVSR-UHFFFAOYSA-N 1 0 269.388 3.949 20 10 CHCDRO CC[C@@H](C[NH2+]Cc1cccc(C)c1O)CC(F)(F)F ZINC000402550503 1134659833 /nfs/dbraw/zinc/65/98/33/1134659833.db2.gz DWGQNNYRDMNKPY-LLVKDONJSA-N 1 0 275.314 3.769 20 10 CHCDRO CC[C@H](C[NH2+]Cc1ccc2c(c1)CCO2)CC(F)(F)F ZINC000402659511 1134669600 /nfs/dbraw/zinc/66/96/00/1134669600.db2.gz KFELCNDLXOBLCD-NSHDSACASA-N 1 0 287.325 3.690 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CC[C@H](CC(C)C)C2)c1O ZINC000307778486 1134947377 /nfs/dbraw/zinc/94/73/77/1134947377.db2.gz RDQGNVFRJIZQDY-GFCCVEGCSA-N 1 0 297.826 3.922 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2cc(F)ccc2O)CCc2ccccc21 ZINC000404789707 1134949474 /nfs/dbraw/zinc/94/94/74/1134949474.db2.gz NOXKOGMAILICOW-CYBMUJFWSA-N 1 0 285.362 3.693 20 10 CHCDRO C[NH2+][C@H]1C[C@@H](Oc2ccccc2NN=C2C=CC=CC2=O)C1 ZINC001217955527 1135030697 /nfs/dbraw/zinc/03/06/97/1135030697.db2.gz DDDMDZYYUKIXIG-SSCMRRTOSA-N 1 0 297.358 3.937 20 10 CHCDRO C[C@@H](Oc1ccc(NN=C2C=CC(=O)C=C2)cc1)C1C[NH2+]C1 ZINC001218198314 1135068244 /nfs/dbraw/zinc/06/82/44/1135068244.db2.gz HGHOQBPSTQTLPZ-GFCCVEGCSA-N 1 0 297.358 3.794 20 10 CHCDRO CC(C)CCC[C@H](C)Oc1ccc(N2CC[NH2+]CC2)cc1 ZINC001218311650 1135085449 /nfs/dbraw/zinc/08/54/49/1135085449.db2.gz RNNSUDQXVKUHCB-INIZCTEOSA-N 1 0 290.451 3.690 20 10 CHCDRO COc1ccc(C[NH2+]CCCN(C)c2ccccc2)cc1C ZINC000315511489 1135155692 /nfs/dbraw/zinc/15/56/92/1135155692.db2.gz SZWFAYVUKOQIBY-UHFFFAOYSA-N 1 0 298.430 3.620 20 10 CHCDRO Cc1cc(F)ccc1CC[NH2+][C@H]1CCc2cccc(O)c21 ZINC000315550533 1135156709 /nfs/dbraw/zinc/15/67/09/1135156709.db2.gz QJCNYVQAWFCRIE-INIZCTEOSA-N 1 0 285.362 3.659 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1ccccn1)c1ccccc1O ZINC000020123559 171004823 /nfs/dbraw/zinc/00/48/23/171004823.db2.gz ZJASMSCGSHPGGK-TZMCWYRMSA-N 1 0 256.349 3.589 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCc3ccccc32)c1 ZINC000020129851 171019170 /nfs/dbraw/zinc/01/91/70/171019170.db2.gz MYPSNNIXSKSHCD-SJKOYZFVSA-N 1 0 283.371 3.739 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cccc(C)c2)c1 ZINC000020134176 171021753 /nfs/dbraw/zinc/02/17/53/171021753.db2.gz IFMVTRPDDOCXPS-CYBMUJFWSA-N 1 0 271.360 3.560 20 10 CHCDRO COc1cccc(C[NH2+][C@@H](C)CCCC(C)C)c1O ZINC000020138721 171026171 /nfs/dbraw/zinc/02/61/71/171026171.db2.gz RSAMJIOZDYZYKN-ZDUSSCGKSA-N 1 0 265.397 3.705 20 10 CHCDRO COc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2)cc1 ZINC000020146068 171032148 /nfs/dbraw/zinc/03/21/48/171032148.db2.gz XQMNENCFWNKABT-AWEZNQCLSA-N 1 0 284.403 3.612 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)c1ccccc1O)c1cccc(F)c1 ZINC000020147845 171035128 /nfs/dbraw/zinc/03/51/28/171035128.db2.gz KFKFKPMWWUOILU-RYUDHWBXSA-N 1 0 259.324 3.943 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2cccc(F)c2)c1 ZINC000020147928 171035392 /nfs/dbraw/zinc/03/53/92/171035392.db2.gz VAZVUEIAJBPOMY-VXGBXAGGSA-N 1 0 289.350 3.952 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2cccc(F)c2)c(O)c1 ZINC000020473295 171216734 /nfs/dbraw/zinc/21/67/34/171216734.db2.gz KXUUEIZCRUVQSA-LBPRGKRZSA-N 1 0 259.324 3.691 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)C1CC1)c1ccc2ccccc2c1O ZINC000035733329 172384469 /nfs/dbraw/zinc/38/44/69/172384469.db2.gz KISHOLLKQCIINH-VXGBXAGGSA-N 1 0 255.361 3.995 20 10 CHCDRO C[C@H]([NH2+]CC1CCC1)c1ccc2ccccc2c1O ZINC000037180090 173013016 /nfs/dbraw/zinc/01/30/16/173013016.db2.gz TURCJEWSAQXDKR-LBPRGKRZSA-N 1 0 255.361 3.996 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)cc1 ZINC000037199087 260074077 /nfs/dbraw/zinc/07/40/77/260074077.db2.gz PRVFYNJUHLYSEC-AWEZNQCLSA-N 1 0 284.403 3.612 20 10 CHCDRO COc1ccc([C@H](C)[NH2+]Cc2cc(C)ccc2O)cc1 ZINC000078638556 260168369 /nfs/dbraw/zinc/16/83/69/260168369.db2.gz NLRNWEPITSOWEI-ZDUSSCGKSA-N 1 0 271.360 3.560 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccc(OC)cc1 ZINC000126986254 260360214 /nfs/dbraw/zinc/36/02/14/260360214.db2.gz KSQSOZXGNWPNLR-SFHVURJKSA-N 1 0 297.398 3.871 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1ccccn1)c1ccc(N(C)C)cc1 ZINC000152369806 261063601 /nfs/dbraw/zinc/06/36/01/261063601.db2.gz CVCJYTOBDVULRH-WMLDXEAASA-N 1 0 283.419 3.950 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](OC)c1ccccc1)c1ccccc1O ZINC000155259512 261099834 /nfs/dbraw/zinc/09/98/34/261099834.db2.gz XFVTUFBZVOBTMR-SJLPKXTDSA-N 1 0 285.387 3.821 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCc2c1cccc2O)c1ccccc1O ZINC000155696638 261105830 /nfs/dbraw/zinc/10/58/30/261105830.db2.gz SMQOYOFOKPKQDN-HOTGVXAUSA-N 1 0 283.371 3.826 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(F)cc(OC)c1)c1ccccc1O ZINC000157008648 261137382 /nfs/dbraw/zinc/13/73/82/261137382.db2.gz AARBDKWHNSSHAO-INIZCTEOSA-N 1 0 289.350 3.781 20 10 CHCDRO CCC[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cccnc1 ZINC000184894674 262032677 /nfs/dbraw/zinc/03/26/77/262032677.db2.gz PGGYPGRCGOSHTE-GOSISDBHSA-N 1 0 283.419 3.779 20 10 CHCDRO CCOCCCC[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000185070883 262040482 /nfs/dbraw/zinc/04/04/82/262040482.db2.gz MFFYNIDSLKJDEL-LLVKDONJSA-N 1 0 271.788 3.513 20 10 CHCDRO CCc1nc([C@@H](C)[NH2+][C@H](C)c2cc(F)ccc2O)cs1 ZINC000185427179 262053794 /nfs/dbraw/zinc/05/37/94/262053794.db2.gz NRBKNZBDTTVXBA-NXEZZACHSA-N 1 0 294.395 3.962 20 10 CHCDRO CC[C@H](C)[C@@H](O)C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000185438926 262054066 /nfs/dbraw/zinc/05/40/66/262054066.db2.gz DDRSNLBTGONYTA-DCGLDWPTSA-N 1 0 287.403 3.603 20 10 CHCDRO Cc1noc(C)c1C[C@H](C)[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000185501267 262056833 /nfs/dbraw/zinc/05/68/33/262056833.db2.gz YVHMUEKIMIWALI-RYUDHWBXSA-N 1 0 288.391 3.587 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](CCCO)c2ccccc2)c(O)c1 ZINC000185532611 262058633 /nfs/dbraw/zinc/05/86/33/262058633.db2.gz ADPXLEZRADDGSH-YJBOKZPZSA-N 1 0 299.414 3.865 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](CCCO)c2ccccc2)c1 ZINC000185532143 262058675 /nfs/dbraw/zinc/05/86/75/262058675.db2.gz KIUFWTGEGCQBMI-MAUKXSAKSA-N 1 0 299.414 3.865 20 10 CHCDRO COc1cc(C)ccc1C[NH2+][C@@H](C)c1ccc(F)cc1[O-] ZINC000185714674 262068135 /nfs/dbraw/zinc/06/81/35/262068135.db2.gz JXRJCMALENCVGX-LBPRGKRZSA-N 1 0 289.350 3.699 20 10 CHCDRO COC[C@H]([NH2+][C@H](C)c1cc(F)ccc1O)c1ccccc1 ZINC000186035476 262076546 /nfs/dbraw/zinc/07/65/46/262076546.db2.gz NHEBICJCAPTJRV-WBMJQRKESA-N 1 0 289.350 3.570 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCOC3(CCCC3)C2)c(O)c1 ZINC000186129757 262081116 /nfs/dbraw/zinc/08/11/16/262081116.db2.gz YJIVNXFTHZRFDI-GJZGRUSLSA-N 1 0 289.419 3.843 20 10 CHCDRO COCCC1(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)CC1 ZINC000186133890 262081289 /nfs/dbraw/zinc/08/12/89/262081289.db2.gz PESLXTRHDXQREW-NSHDSACASA-N 1 0 283.799 3.513 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)[C@@H](c1ccccc1)N(C)C)c1ccccc1O ZINC000186319941 262088765 /nfs/dbraw/zinc/08/87/65/262088765.db2.gz AKYNZHLOOOEVAO-CLCXKQKWSA-N 1 0 298.430 3.734 20 10 CHCDRO CCc1noc(C)c1C[NH2+][C@H](CC)c1ccc(C)cc1O ZINC000293868002 263151426 /nfs/dbraw/zinc/15/14/26/263151426.db2.gz ZKBOJNIZKBUAOQ-OAHLLOKOSA-N 1 0 288.391 3.800 20 10 CHCDRO Cc1ccc2c(c1)[C@H]([NH2+][C@@H](C)c1cc(F)ccc1O)CO2 ZINC000373266541 267658484 /nfs/dbraw/zinc/65/84/84/267658484.db2.gz NENCDEBYYPDPKP-XHDPSFHLSA-N 1 0 287.334 3.624 20 10 CHCDRO COc1cccc(C[NH2+]C2(c3ccccc3)CCC2)c1O ZINC000171129220 327751828 /nfs/dbraw/zinc/75/18/28/327751828.db2.gz TUSFMAKDZNBLOQ-UHFFFAOYSA-N 1 0 283.371 3.570 20 10 CHCDRO Oc1ccccc1C[NH2+]C1(c2ccccc2)CCC1 ZINC000171129256 327752116 /nfs/dbraw/zinc/75/21/16/327752116.db2.gz GNQPVFAOQOGLQX-UHFFFAOYSA-N 1 0 253.345 3.561 20 10 CHCDRO C[C@H](C[NH2+][C@@H](C)c1ccccc1O)Oc1ccccc1F ZINC000183534714 327820492 /nfs/dbraw/zinc/82/04/92/327820492.db2.gz XOEPOMDZRLNLRS-OLZOCXBDSA-N 1 0 289.350 3.649 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H]2CCOC3(CCCCC3)C2)c1O ZINC000271866085 328198595 /nfs/dbraw/zinc/19/85/95/328198595.db2.gz WGHHWMWWDMFOHL-MRXNPFEDSA-N 1 0 289.419 3.672 20 10 CHCDRO COc1cccc(C[NH2+]Cc2ccc(C)c(Cl)c2)c1O ZINC000289561986 328255435 /nfs/dbraw/zinc/25/54/35/328255435.db2.gz YRTRIIKWWAUXNI-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO CCOc1cccc(C[NH2+]CC[C@H]2CC=CCC2)c1O ZINC000527789695 326868289 /nfs/dbraw/zinc/86/82/89/326868289.db2.gz NJPQNAWJSMXTIY-AWEZNQCLSA-N 1 0 275.392 3.627 20 10 CHCDRO Cc1cccc([C@H]2CCC[N@@H+]2Cc2cc(F)ccc2O)n1 ZINC000180162941 329218278 /nfs/dbraw/zinc/21/82/78/329218278.db2.gz RKUFFXUZOCJKFJ-MRXNPFEDSA-N 1 0 286.350 3.572 20 10 CHCDRO Cc1ncccc1C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000527989352 330299085 /nfs/dbraw/zinc/29/90/85/330299085.db2.gz YBBAQZIGQAGBHX-YGRLFVJLSA-N 1 0 286.350 3.573 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]Cc2ccncc2C)cc1 ZINC000229661166 333307292 /nfs/dbraw/zinc/30/72/92/333307292.db2.gz UUUBHJKDNUJCKY-UHFFFAOYSA-N 1 0 283.419 3.526 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCSC1)c1ccc2ccccc2c1O ZINC000230667643 333320355 /nfs/dbraw/zinc/32/03/55/333320355.db2.gz CRXMAJSUWQSBDJ-WCQYABFASA-N 1 0 273.401 3.702 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H]1CCC12CCOCC2 ZINC000548792178 334174385 /nfs/dbraw/zinc/17/43/85/334174385.db2.gz FNUPTTDVXJNZNW-SFHVURJKSA-N 1 0 298.430 3.536 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCO[C@H](C)C1)c1ccc2ccccc2c1O ZINC000273534653 334766706 /nfs/dbraw/zinc/76/67/06/334766706.db2.gz XECQLVUGNYPRIW-VNHYZAJKSA-N 1 0 285.387 3.764 20 10 CHCDRO CCOCc1ccccc1C[NH2+][C@H](C)c1ccccc1O ZINC000037762243 520216792 /nfs/dbraw/zinc/21/67/92/520216792.db2.gz JYRPRXBMCYTLET-CQSZACIVSA-N 1 0 285.387 3.780 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](CO)c2ccccc2)cc1 ZINC000269046795 520288295 /nfs/dbraw/zinc/28/82/95/520288295.db2.gz YOXNOSVVQSGVNY-BEFAXECRSA-N 1 0 298.430 3.527 20 10 CHCDRO CCOC1CC(CC[NH2+][C@@H](CC)c2ccc(C)cc2O)C1 ZINC000280138338 521646057 /nfs/dbraw/zinc/64/60/57/521646057.db2.gz POAJWGRVPSCGBT-DQPZFDDXSA-N 1 0 291.435 3.947 20 10 CHCDRO CCSCC[C@H](C)[NH2+][C@H]1CCc2cccc(O)c21 ZINC000297909350 521716728 /nfs/dbraw/zinc/71/67/28/521716728.db2.gz WPELOYYUNPNNMW-AAEUAGOBSA-N 1 0 265.422 3.501 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](CO)c1ccccc1)c1ccc(C)cc1O ZINC000280105878 522610479 /nfs/dbraw/zinc/61/04/79/522610479.db2.gz NIWWFYHUXOKBOL-WMZOPIPTSA-N 1 0 299.414 3.517 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(Cl)nc1)c1ccc(C)cc1O ZINC000280235183 522645380 /nfs/dbraw/zinc/64/53/80/522645380.db2.gz VMMUWUDDIAZZME-AWEZNQCLSA-N 1 0 290.794 3.990 20 10 CHCDRO CC[C@H]([NH2+][C@@H](CCOC)c1ccco1)c1ccccc1O ZINC000274741730 522705713 /nfs/dbraw/zinc/70/57/13/522705713.db2.gz FLXBZCYUGZSUGU-GJZGRUSLSA-N 1 0 289.375 3.804 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCOC2(CCC2)C1)c1ccc(C)cc1O ZINC000280274254 522720110 /nfs/dbraw/zinc/72/01/10/522720110.db2.gz YATCFJANFWAJCD-ZBFHGGJFSA-N 1 0 289.419 3.843 20 10 CHCDRO CC[C@@H]([NH2+]CC(C)(C)C[C@@H](C)O)c1ccc(C)cc1O ZINC000279999756 522818514 /nfs/dbraw/zinc/81/85/14/522818514.db2.gz FWHCILWAJXAJMX-UKRRQHHQSA-N 1 0 279.424 3.538 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cnc(C)s1)c1ccc(C)cc1O ZINC000280191538 522888187 /nfs/dbraw/zinc/88/81/87/522888187.db2.gz SGDSEXFMYXZNMG-CQSZACIVSA-N 1 0 276.405 3.706 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CCOC(C)(C)C1)c1ccc(C)cc1O ZINC000280075626 522951948 /nfs/dbraw/zinc/95/19/48/522951948.db2.gz LJMHBNUNYGGRNA-DZGCQCFKSA-N 1 0 277.408 3.699 20 10 CHCDRO COCc1cccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)c1 ZINC000121426738 523055859 /nfs/dbraw/zinc/05/58/59/523055859.db2.gz IQBUNQYSHXSEKD-HNNXBMFYSA-N 1 0 298.430 3.750 20 10 CHCDRO COCCCC[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000263733653 523174646 /nfs/dbraw/zinc/17/46/46/523174646.db2.gz YNGJTOHSZDGDCR-UHFFFAOYSA-N 1 0 285.387 3.575 20 10 CHCDRO CC[C@H]1C[N@H+](Cc2c(O)ccc3ccccc32)CCCO1 ZINC000281106056 523282870 /nfs/dbraw/zinc/28/28/70/523282870.db2.gz AVDUXTWIUZEHEU-HNNXBMFYSA-N 1 0 285.387 3.546 20 10 CHCDRO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000079249401 523852758 /nfs/dbraw/zinc/85/27/58/523852758.db2.gz STEITIMCBVELDM-CQSZACIVSA-N 1 0 297.398 3.789 20 10 CHCDRO C[C@H](CCc1ccc(O)cc1)[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000297568305 524234948 /nfs/dbraw/zinc/23/49/48/524234948.db2.gz GLCZFRJFGSRMHU-CXAGYDPISA-N 1 0 297.398 3.696 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2cc(Cl)ccc2O)s1 ZINC000050225166 524584025 /nfs/dbraw/zinc/58/40/25/524584025.db2.gz HJZCQOAEKYMVCC-UHFFFAOYSA-N 1 0 267.781 3.705 20 10 CHCDRO C[C@H]1COCC[C@H]1[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000277252217 524732714 /nfs/dbraw/zinc/73/27/14/524732714.db2.gz AHOJEAGKOMCLCQ-KBXCAEBGSA-N 1 0 297.398 3.574 20 10 CHCDRO COc1ccc(O)c(C[NH2+]C[C@H]2CCCCC(F)(F)C2)c1 ZINC000292705914 524752104 /nfs/dbraw/zinc/75/21/04/524752104.db2.gz CUZQIPKFRPVMEH-LBPRGKRZSA-N 1 0 299.361 3.706 20 10 CHCDRO C[C@H](Cc1cccs1)[NH2+][C@H](C)c1ccccc1O ZINC000036993105 524756249 /nfs/dbraw/zinc/75/62/49/524756249.db2.gz MTBDAUBWCHPXFY-VXGBXAGGSA-N 1 0 261.390 3.736 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1COc2ccccc21)c1ccc(N(C)C)cc1 ZINC000289824640 525423140 /nfs/dbraw/zinc/42/31/40/525423140.db2.gz AIVDGJZDVZVQTE-HOCLYGCPSA-N 1 0 296.414 3.579 20 10 CHCDRO C[C@H]([NH2+]Cc1cc(-c2ccccc2)ccc1O)[C@H]1CCOC1 ZINC000266149690 525428985 /nfs/dbraw/zinc/42/89/85/525428985.db2.gz JZRHMFVKZXNGGZ-YOEHRIQHSA-N 1 0 297.398 3.574 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(F)cc2F)c(O)c1 ZINC000051016670 525926987 /nfs/dbraw/zinc/92/69/87/525926987.db2.gz HOCBPLKZVUMGMJ-NSHDSACASA-N 1 0 277.314 3.830 20 10 CHCDRO Oc1ccccc1C[NH2+][C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000037141686 526374271 /nfs/dbraw/zinc/37/42/71/526374271.db2.gz SVSPKHMHTROQBZ-NEPJUHHUSA-N 1 0 273.298 3.603 20 10 CHCDRO Cc1nc(C(C)C)ccc1C[N@H+](C)Cc1ccccc1O ZINC000292819642 526667403 /nfs/dbraw/zinc/66/74/03/526667403.db2.gz NWYXIHCDKWHEMJ-UHFFFAOYSA-N 1 0 284.403 3.851 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CC[C@@H](C)F)cc1 ZINC000815646012 1118127849 /nfs/dbraw/zinc/12/78/49/1118127849.db2.gz XANBXTZKRGXFGP-CHWSQXEVSA-N 1 0 252.377 3.541 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]CCCC(C)(C)C)c1 ZINC000313262949 1120696993 /nfs/dbraw/zinc/69/69/93/1120696993.db2.gz CNTDDMFISLBOEB-GFCCVEGCSA-N 1 0 265.397 3.878 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH+]1C2CCCC1CCC2 ZINC000707157534 1121450268 /nfs/dbraw/zinc/45/02/68/1121450268.db2.gz XPNNNBAJDVZDHE-UHFFFAOYSA-N 1 0 265.784 3.953 20 10 CHCDRO CC(C)[C@@H]1CC[N@H+](Cc2ccc(Cl)cc2O)C1 ZINC001179974144 1121932901 /nfs/dbraw/zinc/93/29/01/1121932901.db2.gz KIFNRMAJLXERPS-LLVKDONJSA-N 1 0 253.773 3.524 20 10 CHCDRO C[C@H]1CC[N@H+](Cc2cc(Cl)ccc2O)CCC1(F)F ZINC001203650915 1122414869 /nfs/dbraw/zinc/41/48/69/1122414869.db2.gz GGXNRNZVOLMGER-JTQLQIEISA-N 1 0 289.753 3.913 20 10 CHCDRO CCCC[C@H](COC)N(CCC)c1ccc(C[NH3+])cc1 ZINC000775141018 1122440334 /nfs/dbraw/zinc/44/03/34/1122440334.db2.gz TZJNYMNDHLQBRZ-QGZVFWFLSA-N 1 0 278.440 3.567 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC000877498830 1125036582 /nfs/dbraw/zinc/03/65/82/1125036582.db2.gz VHFWGBCYLJHWDH-LBPRGKRZSA-N 1 0 269.335 3.616 20 10 CHCDRO CS[C@@H](C[NH2+][C@@H]1CCc2cccc(O)c21)C(C)(C)C ZINC000834759896 1131703106 /nfs/dbraw/zinc/70/31/06/1131703106.db2.gz GPQOGVZQIJIAGS-OCCSQVGLSA-N 1 0 279.449 3.747 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]C(C)(C)C2CC2)cc1 ZINC000835039420 1131762035 /nfs/dbraw/zinc/76/20/35/1131762035.db2.gz GOXXEJAIDJFDMD-WAYWQWQTSA-N 1 0 258.409 3.544 20 10 CHCDRO CC[C@H](C)OCC[C@H](C)[N@H+](CC)Cc1ccccc1O ZINC001172356435 1132185564 /nfs/dbraw/zinc/18/55/64/1132185564.db2.gz YKXOLRLMJKCTNS-GJZGRUSLSA-N 1 0 279.424 3.808 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCS[C@@H]1C)c1cc(Cl)ccc1O ZINC000842927890 1132477286 /nfs/dbraw/zinc/47/72/86/1132477286.db2.gz GOAOHEAGTICRAJ-YGOYTEALSA-N 1 0 271.813 3.590 20 10 CHCDRO C[C@@H]1CC[C@@H]([NH2+]Cc2cc(Cl)ccc2O)C[C@H]1C ZINC000251983473 1125530571 /nfs/dbraw/zinc/53/05/71/1125530571.db2.gz YVTIHNGCIJUMQJ-JTNHKYCSSA-N 1 0 267.800 3.960 20 10 CHCDRO CC(C)(C)c1ccc(C[NH2+]Cc2ccccc2O)cc1 ZINC000134230898 1125546163 /nfs/dbraw/zinc/54/61/63/1125546163.db2.gz OOQKZGUOQJBASA-UHFFFAOYSA-N 1 0 269.388 3.980 20 10 CHCDRO CC[C@H](C)[NH2+][C@H](C)c1cc(Br)ccc1O ZINC000134906499 1125570100 /nfs/dbraw/zinc/57/01/00/1125570100.db2.gz FWDCCVOSVGASAR-DTWKUNHWSA-N 1 0 272.186 3.604 20 10 CHCDRO CCn1cc([C@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2O)cn1 ZINC000841755525 1125592479 /nfs/dbraw/zinc/59/24/79/1125592479.db2.gz IHNDGUOIAAIRLV-WDEREUQCSA-N 1 0 293.798 3.674 20 10 CHCDRO CC[C@H]1CC[C@@H](C)[N@@H+]1Cc1cc(Cl)ccc1O ZINC000136819854 1125647540 /nfs/dbraw/zinc/64/75/40/1125647540.db2.gz ANPCJPKVEYGTCG-MFKMUULPSA-N 1 0 253.773 3.809 20 10 CHCDRO C[C@@H]([NH2+]C[C@]1(C)CCOC2(CCC2)C1)c1ccccc1O ZINC000886774538 1125715615 /nfs/dbraw/zinc/71/56/15/1125715615.db2.gz PNYQOIYHCMFKNK-RHSMWYFYSA-N 1 0 289.419 3.782 20 10 CHCDRO CCCO[C@@H]1CCC[N@H+](Cc2ccc(N(C)C)cc2)CC1 ZINC000093316594 1125765749 /nfs/dbraw/zinc/76/57/49/1125765749.db2.gz BJUZTCZJXAPXSP-GOSISDBHSA-N 1 0 290.451 3.534 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CC[C@@H]1C(C)C ZINC000796769996 1129424077 /nfs/dbraw/zinc/42/40/77/1129424077.db2.gz AOGOGFYNGZQGLM-SJORKVTESA-N 1 0 260.425 3.585 20 10 CHCDRO CCC(CC)[NH2+][C@@H](C)c1ccc(N2CCOCC2)c(F)c1 ZINC000178091285 1126808417 /nfs/dbraw/zinc/80/84/17/1126808417.db2.gz SHUAXNHTYQCHND-ZDUSSCGKSA-N 1 0 294.414 3.502 20 10 CHCDRO Cc1nc(C)c([C@H](C)[N@H+](C)Cc2cccc(C)c2O)s1 ZINC000180153887 1126840384 /nfs/dbraw/zinc/84/03/84/1126840384.db2.gz RLMJADHIDHPGOC-LBPRGKRZSA-N 1 0 290.432 3.967 20 10 CHCDRO CCOc1cccc(C[NH2+]C(C)(C)CC(F)(F)F)c1O ZINC000780589034 1130685221 /nfs/dbraw/zinc/68/52/21/1130685221.db2.gz KMYLYRHEHJYSQI-UHFFFAOYSA-N 1 0 291.313 3.612 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cn2c(cccc2C)n1)c1ccccc1O ZINC000183331257 1126884819 /nfs/dbraw/zinc/88/48/19/1126884819.db2.gz HSYVKWRECFSECR-MRXNPFEDSA-N 1 0 295.386 3.589 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCOc2ccccc21)c1ccccc1O ZINC000183504709 1126888092 /nfs/dbraw/zinc/88/80/92/1126888092.db2.gz NJDYZEUBTUQLHF-KBPBESRZSA-N 1 0 283.371 3.609 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCOc2ccc(F)cc21)c1ccccc1O ZINC000183599225 1126889766 /nfs/dbraw/zinc/88/97/66/1126889766.db2.gz LBRLDGFOJGJWAR-IAQYHMDHSA-N 1 0 287.334 3.706 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2CCCc3c(O)cccc32)cc1 ZINC000191656025 1126953538 /nfs/dbraw/zinc/95/35/38/1126953538.db2.gz MMXDJFMMKXNMAB-GOSISDBHSA-N 1 0 296.414 3.625 20 10 CHCDRO CO[C@H](C)[C@H](C)[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000191647777 1126953782 /nfs/dbraw/zinc/95/37/82/1126953782.db2.gz KPUFIJGNYMBTOP-ARFHVFGLSA-N 1 0 290.451 3.751 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H]2CCCC(C)(C)C2)c1O ZINC000149617502 1127006261 /nfs/dbraw/zinc/00/62/61/1127006261.db2.gz YLHMXDAJXRDGSY-CQSZACIVSA-N 1 0 277.408 3.849 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2cncs2)cc1 ZINC000268900134 1127027677 /nfs/dbraw/zinc/02/76/77/1127027677.db2.gz WFZYTGXPQJHHLI-ZDUSSCGKSA-N 1 0 289.448 3.840 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CSC[C@H]2C)cc1 ZINC000797063269 1130957920 /nfs/dbraw/zinc/95/79/20/1130957920.db2.gz AXYJTQBHEFFNQW-DVOMOZLQSA-N 1 0 278.465 3.545 20 10 CHCDRO Cc1ccncc1C[N@@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000269582157 1127042378 /nfs/dbraw/zinc/04/23/78/1127042378.db2.gz QBFKHJKMRCKDSF-UHFFFAOYSA-N 1 0 295.430 3.621 20 10 CHCDRO C[C@H](CO)CCC[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000270248331 1127052196 /nfs/dbraw/zinc/05/21/96/1127052196.db2.gz FNIDJCNJBQKWRW-HNNXBMFYSA-N 1 0 299.414 3.557 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+]Cc2cc(-c3ccccc3)ccc2O)CCO1 ZINC000271198805 1127071878 /nfs/dbraw/zinc/07/18/78/1127071878.db2.gz AZLQSNPHHLLBCD-RDTXWAMCSA-N 1 0 297.398 3.716 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CC(C)(C)CCCO)cc1 ZINC000271352642 1127077212 /nfs/dbraw/zinc/07/72/12/1127077212.db2.gz DNZDEGIEOLNSCL-HNNXBMFYSA-N 1 0 292.467 3.592 20 10 CHCDRO C[N@H+](Cc1ccccc1)Cc1c(O)ccc2ccncc21 ZINC000028890772 1127096573 /nfs/dbraw/zinc/09/65/73/1127096573.db2.gz WKDYXUGHDSLNJQ-UHFFFAOYSA-N 1 0 278.355 3.572 20 10 CHCDRO Cc1nnc([C@@H](C)[NH2+][C@H](C)c2ccc(C)c(C)c2O)s1 ZINC000274150155 1127109938 /nfs/dbraw/zinc/10/99/38/1127109938.db2.gz FGJSIUDYEICJOF-GHMZBOCLSA-N 1 0 291.420 3.581 20 10 CHCDRO CCCN(Cc1cccc(OC)c1)c1ccc(C[NH3+])cc1 ZINC000034654597 1127117526 /nfs/dbraw/zinc/11/75/26/1127117526.db2.gz UQJJSTAEQPTJTJ-UHFFFAOYSA-N 1 0 284.403 3.571 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](C)CCSC)cc1 ZINC000151071102 1127121002 /nfs/dbraw/zinc/12/10/02/1127121002.db2.gz HPYDOBDUKPMWQQ-UONOGXRCSA-N 1 0 280.481 3.935 20 10 CHCDRO CC[C@H](CC(F)(F)F)[NH2+]Cc1cc(Cl)ccc1O ZINC000760655457 1127146365 /nfs/dbraw/zinc/14/63/65/1127146365.db2.gz YGTQEIQOBNCUFH-SNVBAGLBSA-N 1 0 281.705 3.866 20 10 CHCDRO CCc1ccc(C[NH2+]Cc2ccc(N(CC)CC)cc2)o1 ZINC000760657153 1127149830 /nfs/dbraw/zinc/14/98/30/1127149830.db2.gz PFNMCUJUMNWVKN-UHFFFAOYSA-N 1 0 286.419 3.978 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@@H+](C)Cc2cc(Cl)cn2C)c1 ZINC000164485940 1127167871 /nfs/dbraw/zinc/16/78/71/1127167871.db2.gz MXMWMCJLSVOZQT-UHFFFAOYSA-N 1 0 292.810 3.633 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CCC[C@@H]1[C@H]1CCCO1 ZINC000284016706 1127170207 /nfs/dbraw/zinc/17/02/07/1127170207.db2.gz HXVXPPMESBQCPZ-IEBWSBKVSA-N 1 0 297.398 3.689 20 10 CHCDRO Oc1c(C[NH2+]CCC(F)(F)F)ccc2ccccc21 ZINC000816554034 1131110242 /nfs/dbraw/zinc/11/02/42/1131110242.db2.gz NGQITVPILSGGAQ-UHFFFAOYSA-N 1 0 269.266 3.587 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccc([C@@H](C)O)cc2)c(O)c1 ZINC000284295394 1127179902 /nfs/dbraw/zinc/17/99/02/1127179902.db2.gz YGQXBPGZRWNLOF-HUUCEWRRSA-N 1 0 299.414 3.913 20 10 CHCDRO C[C@H]1CCC[N@H+](Cc2cc(F)cc(Cl)c2[O-])[C@H]1C ZINC001237812478 1131143141 /nfs/dbraw/zinc/14/31/41/1131143141.db2.gz HDXKEVIFHKNFRX-UWVGGRQHSA-N 1 0 271.763 3.805 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2cc(F)c(Cl)cc2[O-])[C@H](C)C1 ZINC001237936570 1131153883 /nfs/dbraw/zinc/15/38/83/1131153883.db2.gz KPBCSRGMOGNYDQ-NXEZZACHSA-N 1 0 271.763 3.805 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccccc1O)c1ccccc1F ZINC000166044100 1127258628 /nfs/dbraw/zinc/25/86/28/1127258628.db2.gz OSLNBHVXFWTSAH-HNNXBMFYSA-N 1 0 259.324 3.772 20 10 CHCDRO Cc1cc(F)cc(C[N@H+]2CCC[C@@H](C)[C@H](C)C2)c1O ZINC001238058763 1131165672 /nfs/dbraw/zinc/16/56/72/1131165672.db2.gz VKNHJNAQXLEKER-DGCLKSJQSA-N 1 0 265.372 3.708 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCCSC1)c1ccc(C)cc1O ZINC000286973795 1127277813 /nfs/dbraw/zinc/27/78/13/1127277813.db2.gz IQLGVXJTEMWDSR-ZFWWWQNUSA-N 1 0 279.449 3.885 20 10 CHCDRO C[C@@H](Cc1ccc(F)cc1)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000057993411 1127295436 /nfs/dbraw/zinc/29/54/36/1127295436.db2.gz JXAHPBKXYSBFOE-AWEZNQCLSA-N 1 0 286.394 3.613 20 10 CHCDRO CC[C@@H]1CCC[C@@H]([NH2+]Cc2cc(F)ccc2O)C1 ZINC000226611029 1127412295 /nfs/dbraw/zinc/41/22/95/1127412295.db2.gz WBYQVJGSCGGRNO-BXUZGUMPSA-N 1 0 251.345 3.590 20 10 CHCDRO COCC1(CC[NH2+][C@H](C)c2c(C)cc(C)cc2O)CCC1 ZINC000293731936 1127516680 /nfs/dbraw/zinc/51/66/80/1127516680.db2.gz OLYZJPGLFIIRCI-OAHLLOKOSA-N 1 0 291.435 3.866 20 10 CHCDRO CSCC[C@@H](C)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000076772022 1127561403 /nfs/dbraw/zinc/56/14/03/1127561403.db2.gz YGUDDEVHOQRZKE-OAHLLOKOSA-N 1 0 292.492 3.908 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H]2CCc3cc(F)ccc3C2)cc1 ZINC001168412782 1127592362 /nfs/dbraw/zinc/59/23/62/1127592362.db2.gz TZXNMKHEWMTGNB-SFHVURJKSA-N 1 0 298.405 3.539 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CCCSC2)c(O)c1 ZINC000294895844 1127606882 /nfs/dbraw/zinc/60/68/82/1127606882.db2.gz VQKBUQUBSZHJEB-QWHCGFSZSA-N 1 0 265.422 3.555 20 10 CHCDRO CCCN(Cc1csc(Cl)n1)Cc1ccccc1O ZINC000294901676 1127607024 /nfs/dbraw/zinc/60/70/24/1127607024.db2.gz HDTZWHUMQFCUEW-UHFFFAOYSA-N 1 0 296.823 3.914 20 10 CHCDRO CCCC[N@@H+](Cc1ccccc1O)CC1CCC(=O)CC1 ZINC000295411305 1127642078 /nfs/dbraw/zinc/64/20/78/1127642078.db2.gz SPTHBQGUQVLJBE-UHFFFAOYSA-N 1 0 289.419 3.754 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CCCCC[C@@H]2C)cc1Cl ZINC001232264056 1127653689 /nfs/dbraw/zinc/65/36/89/1127653689.db2.gz DPFLEONZJDKBBX-NSHDSACASA-N 1 0 283.799 3.819 20 10 CHCDRO CCOCc1ccc(C[NH2+][C@H]2CCc3cccc(O)c32)cc1 ZINC000295814288 1127653707 /nfs/dbraw/zinc/65/37/07/1127653707.db2.gz CWQZTHJKNISWRV-KRWDZBQOSA-N 1 0 297.398 3.706 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C2CCC(F)(F)CC2)cc1C ZINC000761336877 1127666729 /nfs/dbraw/zinc/66/67/29/1127666729.db2.gz LWQQMIVBVIPLME-UHFFFAOYSA-N 1 0 269.335 3.677 20 10 CHCDRO CCCC[N@H+](C)Cc1ccc(N2CCC(OC)CC2)cc1 ZINC000296556826 1127676192 /nfs/dbraw/zinc/67/61/92/1127676192.db2.gz PGMCTNQFOYVDEZ-UHFFFAOYSA-N 1 0 290.451 3.534 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CCc2ncccc2C)c(O)c1 ZINC000296575525 1127676701 /nfs/dbraw/zinc/67/67/01/1127676701.db2.gz TZFWMKZBJUTQAA-HNNXBMFYSA-N 1 0 284.403 3.606 20 10 CHCDRO COCCC1(C[NH2+][C@@H]2CCc3cccc(O)c32)CCCC1 ZINC000296854397 1127684158 /nfs/dbraw/zinc/68/41/58/1127684158.db2.gz NIBPONKBOZWBER-OAHLLOKOSA-N 1 0 289.419 3.566 20 10 CHCDRO CC(C)C[C@@H]1C[C@H]([NH2+][C@H]2CCc3cccc(O)c32)CCO1 ZINC000296800245 1127683583 /nfs/dbraw/zinc/68/35/83/1127683583.db2.gz LMSXLKQUJIULNX-OAGGEKHMSA-N 1 0 289.419 3.563 20 10 CHCDRO Cc1cc(C[NH+](C)C)cc(N[C@@H]2CCc3cccc(O)c32)c1 ZINC000297037286 1127687707 /nfs/dbraw/zinc/68/77/07/1127687707.db2.gz VAQFWNSUGAMPGJ-QGZVFWFLSA-N 1 0 296.414 3.862 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)CC(F)(F)F)c1ccccc1O ZINC000229578851 1127696528 /nfs/dbraw/zinc/69/65/28/1127696528.db2.gz JIYZDTFYWZJIDA-ONGXEEELSA-N 1 0 261.287 3.774 20 10 CHCDRO CC(C)C[C@H](O)C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000230660056 1127772005 /nfs/dbraw/zinc/77/20/05/1127772005.db2.gz SYCVKNABKBPLRG-HIFRSBDPSA-N 1 0 287.403 3.603 20 10 CHCDRO Cc1cccc(C[NH2+]C2CCC3(CCOCC3)CC2)c1O ZINC000373176972 1127827548 /nfs/dbraw/zinc/82/75/48/1127827548.db2.gz HPKWCTKETQQGTC-UHFFFAOYSA-N 1 0 289.419 3.530 20 10 CHCDRO Cc1ccc2c(c1)[C@H]([NH2+][C@H](C)c1ccc(C)cc1O)CO2 ZINC000373263967 1127831043 /nfs/dbraw/zinc/83/10/43/1127831043.db2.gz ALZQDANLCCULLR-CZUORRHYSA-N 1 0 283.371 3.793 20 10 CHCDRO C[C@H](CC(F)(F)F)[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000231790922 1127854330 /nfs/dbraw/zinc/85/43/30/1127854330.db2.gz LDRSGJIHBGMWLK-GHMZBOCLSA-N 1 0 274.330 3.744 20 10 CHCDRO C[C@@H]([NH2+][C@H]1COc2c1cccc2Cl)c1ccccc1O ZINC000374681220 1127909746 /nfs/dbraw/zinc/90/97/46/1127909746.db2.gz ULDPLWJWYYQUBZ-YGRLFVJLSA-N 1 0 289.762 3.830 20 10 CHCDRO C[C@H]([NH2+][C@H]1COc2c1cccc2Cl)c1ccccc1O ZINC000374681216 1127910063 /nfs/dbraw/zinc/91/00/63/1127910063.db2.gz ULDPLWJWYYQUBZ-HZMBPMFUSA-N 1 0 289.762 3.830 20 10 CHCDRO CCC[C@H](CCO)C[NH2+][C@H](C)c1ccc(N(C)CC)cc1 ZINC000152432430 1128123751 /nfs/dbraw/zinc/12/37/51/1128123751.db2.gz JFTFBUACDRMHOC-HZPDHXFCSA-N 1 0 292.467 3.592 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]C[C@H]1CCCCC1(F)F)CC2 ZINC000297211813 1129224958 /nfs/dbraw/zinc/22/49/58/1129224958.db2.gz GRNLYSRGFRLSDI-CHWSQXEVSA-N 1 0 281.346 3.795 20 10 CHCDRO CC1(C)[C@@H]2C[N@@H+](Cc3ccc(N4CCCCC4)cc3)C[C@@H]21 ZINC001138219851 1128145969 /nfs/dbraw/zinc/14/59/69/1128145969.db2.gz RBLDYINKKVLRSO-HDICACEKSA-N 1 0 284.447 3.765 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2CCC[C@@H]2CCCF)cc1 ZINC000800965091 1128160462 /nfs/dbraw/zinc/16/04/62/1128160462.db2.gz CHLIURNXFYKROB-NVXWUHKLSA-N 1 0 278.415 3.761 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)Cc2cccc(F)c2)cc1C ZINC001168465530 1128174336 /nfs/dbraw/zinc/17/43/36/1128174336.db2.gz SPWJTHAVDYVIKS-CQSZACIVSA-N 1 0 287.378 3.864 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CS[C@H](C(C)C)C1 ZINC000754120397 1128196597 /nfs/dbraw/zinc/19/65/97/1128196597.db2.gz HOHVIDKUNHRWFQ-RDJZCZTQSA-N 1 0 292.492 3.681 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1C[C@H]1C(F)(F)F)c1ccc(C)cc1O ZINC000926951446 1128205671 /nfs/dbraw/zinc/20/56/71/1128205671.db2.gz RDDAHRSGSAESTM-CYZMBNFOSA-N 1 0 287.325 3.940 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCS[C@H](C)C2)c(O)c1 ZINC000927032729 1128209768 /nfs/dbraw/zinc/20/97/68/1128209768.db2.gz OPYVQMQTQJJAPC-AGIUHOORSA-N 1 0 265.422 3.635 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H]2CCCc3cccnc32)c1O ZINC000927063000 1128213020 /nfs/dbraw/zinc/21/30/20/1128213020.db2.gz RJIQJWBQMUHIDR-SWLSCSKDSA-N 1 0 298.386 3.524 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CC(C)(C)OC1(C)C)c1cc(F)ccc1O ZINC000927099675 1128217341 /nfs/dbraw/zinc/21/73/41/1128217341.db2.gz DDOQSRDEQDSCCL-NEPJUHHUSA-N 1 0 295.398 3.776 20 10 CHCDRO CN(C)c1ccc(C[NH2+]CCc2cccc(Cl)c2)cc1 ZINC000032142405 1128226165 /nfs/dbraw/zinc/22/61/65/1128226165.db2.gz PFQVKVCGPIQUGR-UHFFFAOYSA-N 1 0 288.822 3.738 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2CC3(CCC3)C[C@H]2C)cc1C ZINC000762146156 1128273720 /nfs/dbraw/zinc/27/37/20/1128273720.db2.gz VEWVNZQSFPLMIL-CQSZACIVSA-N 1 0 259.393 3.774 20 10 CHCDRO CCCCCC[C@H](C)[NH2+]CCc1ccc(O)c(O)c1 ZINC001257363370 1128275462 /nfs/dbraw/zinc/27/54/62/1128275462.db2.gz RKIGNDRCIJFSSH-ZDUSSCGKSA-N 1 0 265.397 3.589 20 10 CHCDRO CCC[N@H+](CCCc1cccnc1)Cc1ccccc1O ZINC000929752886 1128285224 /nfs/dbraw/zinc/28/52/24/1128285224.db2.gz HBFGFNXHJLDQSR-UHFFFAOYSA-N 1 0 284.403 3.632 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CCc2ccc(C)o2)cc1 ZINC000915229016 1128293577 /nfs/dbraw/zinc/29/35/77/1128293577.db2.gz RFCAUQVQHRAEQC-UHFFFAOYSA-N 1 0 286.419 3.767 20 10 CHCDRO Cc1c(C[N@@H+]2CC[C@H](C(F)(F)F)C2)c2ccccc2n1C ZINC001138256810 1128303062 /nfs/dbraw/zinc/30/30/62/1128303062.db2.gz LMLMOZDSVBETCA-LBPRGKRZSA-N 1 0 296.336 3.871 20 10 CHCDRO CCCC[N@H+](Cc1[nH]c(C)nc1C)Cc1ccccc1O ZINC000930350081 1128315650 /nfs/dbraw/zinc/31/56/50/1128315650.db2.gz FJMCQFZVFSKEJV-UHFFFAOYSA-N 1 0 287.407 3.534 20 10 CHCDRO CC(C)[NH2+]Cc1ccc(N(C)Cc2cccs2)cc1 ZINC000035718041 1128330866 /nfs/dbraw/zinc/33/08/66/1128330866.db2.gz HYFQXRXXUBSOSE-UHFFFAOYSA-N 1 0 274.433 3.883 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2c(O)ccc3ccccc32)C[C@@H]1F ZINC000777970835 1128351399 /nfs/dbraw/zinc/35/13/99/1128351399.db2.gz WGQRSYNCWHOPDA-WBMJQRKESA-N 1 0 273.351 3.725 20 10 CHCDRO Cc1cccc(CCC[N@@H+](C)Cc2ccccc2O)c1 ZINC000778220194 1128451211 /nfs/dbraw/zinc/45/12/11/1128451211.db2.gz RTVPCNRBACPSQV-UHFFFAOYSA-N 1 0 269.388 3.765 20 10 CHCDRO COc1ccc(C[NH2+]CCO[C@@H]2CCCC[C@@H]2C)cc1C ZINC000916838465 1128457329 /nfs/dbraw/zinc/45/73/29/1128457329.db2.gz CVDGCXPSCNOZPH-KBXCAEBGSA-N 1 0 291.435 3.689 20 10 CHCDRO Cc1cccc(C[NH2+]C2(Cc3ccccc3)CC2)c1O ZINC000187493407 1128460519 /nfs/dbraw/zinc/46/05/19/1128460519.db2.gz XKJUDMRWXXHUDM-UHFFFAOYSA-N 1 0 267.372 3.566 20 10 CHCDRO CCOc1cccc(C[NH2+]C2(Cc3ccccc3)CC2)c1O ZINC000187494388 1128463296 /nfs/dbraw/zinc/46/32/96/1128463296.db2.gz KVJRBBMZNBUGRW-UHFFFAOYSA-N 1 0 297.398 3.656 20 10 CHCDRO CCC[C@H](C)CC[C@H](C)[NH2+]Cc1ccc(O)c(O)c1 ZINC001257472349 1128473088 /nfs/dbraw/zinc/47/30/88/1128473088.db2.gz SJCDMSAIWRXJLD-STQMWFEESA-N 1 0 265.397 3.792 20 10 CHCDRO Cc1cc(C[N@H+]2CC=CCC2)c(O)c(C(C)(C)C)c1 ZINC000778577662 1128561541 /nfs/dbraw/zinc/56/15/41/1128561541.db2.gz UMHGUPVFKDTLCZ-UHFFFAOYSA-N 1 0 259.393 3.760 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccccc1OC)c1ccccc1O ZINC000154878005 1128586644 /nfs/dbraw/zinc/58/66/44/1128586644.db2.gz KAAQRVPQTXCHOG-INIZCTEOSA-N 1 0 285.387 3.684 20 10 CHCDRO COc1cccc(C[N@H+](C)Cc2cc(C)c(C)cc2O)c1 ZINC000042910986 1128588969 /nfs/dbraw/zinc/58/89/69/1128588969.db2.gz IBHSXQVERIZBMA-UHFFFAOYSA-N 1 0 285.387 3.650 20 10 CHCDRO C[N@H+](Cc1ccco1)Cc1ccc(N2CCCCC2)cc1 ZINC000155244572 1128602968 /nfs/dbraw/zinc/60/29/68/1128602968.db2.gz HTIPNXMJFUIBND-UHFFFAOYSA-N 1 0 284.403 3.902 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@](C)(O)CCC(C)C)c1ccccc1O ZINC000155971836 1128621409 /nfs/dbraw/zinc/62/14/09/1128621409.db2.gz QEDWMQIUGNLSMH-WBVHZDCISA-N 1 0 279.424 3.620 20 10 CHCDRO Oc1cc2c(cc1C[N@@H+]1CCC[C@@H]1c1ccccn1)CCC2 ZINC000919952295 1128653634 /nfs/dbraw/zinc/65/36/34/1128653634.db2.gz TXVVVKRAANTHOY-GOSISDBHSA-N 1 0 294.398 3.613 20 10 CHCDRO Cc1cccc(C[N@@H+]2CC[C@H](c3ccccc3)C2)c1O ZINC000158027412 1128663622 /nfs/dbraw/zinc/66/36/22/1128663622.db2.gz BLTMXCTTXHQDQU-INIZCTEOSA-N 1 0 267.372 3.690 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CCC[C@@H]1Cc1ccccc1 ZINC000778994783 1128674981 /nfs/dbraw/zinc/67/49/81/1128674981.db2.gz LCTIYQQKNCGNQM-QGZVFWFLSA-N 1 0 285.362 3.738 20 10 CHCDRO C[C@H]1[C@H](c2ccccc2)CC[N@@H+]1Cc1cc(F)ccc1O ZINC000779022680 1128685132 /nfs/dbraw/zinc/68/51/32/1128685132.db2.gz FTTMQSNWRPCOEN-SUMWQHHRSA-N 1 0 285.362 3.909 20 10 CHCDRO C[N@H+](Cc1cc2ccccc2o1)Cc1cc(F)ccc1O ZINC000779023405 1128686024 /nfs/dbraw/zinc/68/60/24/1128686024.db2.gz RGVVAXFULNMKOX-UHFFFAOYSA-N 1 0 285.318 3.910 20 10 CHCDRO CC[C@@H]([NH2+]CC(C)(C)C[C@@H](C)O)c1ccc(N(C)C)cc1 ZINC000090086218 1128718570 /nfs/dbraw/zinc/71/85/70/1128718570.db2.gz JTDSZYIGUSTHQZ-RHSMWYFYSA-N 1 0 292.467 3.590 20 10 CHCDRO CCOC[C@H](C)[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000779073570 1128719697 /nfs/dbraw/zinc/71/96/97/1128719697.db2.gz OULAZEJVZUSWSO-JKSUJKDBSA-N 1 0 290.451 3.753 20 10 CHCDRO C[C@H]([NH2+]CCc1c(F)cccc1F)c1cc(F)ccc1O ZINC000185067886 1117759736 /nfs/dbraw/zinc/75/97/36/1117759736.db2.gz XIWXFXQVQFECKJ-JTQLQIEISA-N 1 0 295.304 3.703 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCOc2cccc(F)c2)c(O)c1 ZINC000185106310 1117764631 /nfs/dbraw/zinc/76/46/31/1117764631.db2.gz CRSSOUJLAZGTFP-CYBMUJFWSA-N 1 0 289.350 3.569 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(C#N)cc2F)c(O)c1 ZINC000185378051 1117813801 /nfs/dbraw/zinc/81/38/01/1117813801.db2.gz HIYAAYCXIWOBRX-GFCCVEGCSA-N 1 0 284.334 3.562 20 10 CHCDRO CCCC[C@H](COC)[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000185494653 1117829930 /nfs/dbraw/zinc/82/99/30/1117829930.db2.gz ZYCGQRNFRUQWIF-UONOGXRCSA-N 1 0 265.397 3.556 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@](C)(O)CCC(C)C)c1 ZINC000185527778 1117838986 /nfs/dbraw/zinc/83/89/86/1117838986.db2.gz MCJPFXYVFMTXDH-WMLDXEAASA-N 1 0 279.424 3.538 20 10 CHCDRO CO[C@H]1CCCC[C@@H]1[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000799728925 1117845262 /nfs/dbraw/zinc/84/52/62/1117845262.db2.gz GOWSUFYEIJDJSZ-DNVSUFBTSA-N 1 0 293.382 3.627 20 10 CHCDRO CC(C)[NH+](CCC[NH2+][C@H](C)c1ccc(F)cc1[O-])C(C)C ZINC000185626732 1117859604 /nfs/dbraw/zinc/85/96/04/1117859604.db2.gz ZDLVIKAKCFAGEC-CQSZACIVSA-N 1 0 296.430 3.691 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCc2cc(F)ccc2F)c1 ZINC000185633656 1117860854 /nfs/dbraw/zinc/86/08/54/1117860854.db2.gz KFDRPNGDJIIYRS-GFCCVEGCSA-N 1 0 291.341 3.872 20 10 CHCDRO CCOc1cccc(C[NH2+][C@H](C)Cc2ccsc2)c1O ZINC000049154599 1128746062 /nfs/dbraw/zinc/74/60/62/1128746062.db2.gz LOERPIGSEJZCTE-GFCCVEGCSA-N 1 0 291.416 3.573 20 10 CHCDRO C[C@@H](C[NH2+][C@@H](C)c1cc(F)ccc1O)Oc1ccccc1 ZINC000186041242 1117974295 /nfs/dbraw/zinc/97/42/95/1117974295.db2.gz SUEZFCDEPYAQKV-STQMWFEESA-N 1 0 289.350 3.649 20 10 CHCDRO C[C@H](C[NH2+][C@H](C)c1cc(F)ccc1O)Oc1ccccc1 ZINC000186041297 1117974732 /nfs/dbraw/zinc/97/47/32/1117974732.db2.gz SUEZFCDEPYAQKV-CHWSQXEVSA-N 1 0 289.350 3.649 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2ccc(C)c(C)c2)c1 ZINC000083411458 1118005366 /nfs/dbraw/zinc/00/53/66/1118005366.db2.gz PAVFZKSHONGMHT-UHFFFAOYSA-N 1 0 255.361 3.607 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H](C)c2ccccc2O)c1 ZINC000037771112 1118037850 /nfs/dbraw/zinc/03/78/50/1118037850.db2.gz OAOKAGQRUFATSS-QWHCGFSZSA-N 1 0 271.360 3.813 20 10 CHCDRO COCCC[N@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000179646616 1128752331 /nfs/dbraw/zinc/75/23/31/1128752331.db2.gz DSALDWSMZQOSCQ-INIZCTEOSA-N 1 0 299.414 3.992 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](C)Cc2ccc(F)cc2)c1 ZINC000179646955 1128752712 /nfs/dbraw/zinc/75/27/12/1128752712.db2.gz SOIPVGVGDGZPCJ-UHFFFAOYSA-N 1 0 289.350 3.562 20 10 CHCDRO CCCN(CCC)c1ccc(C[NH2+]Cc2ccn(C)c2)cc1 ZINC000748098423 1118055707 /nfs/dbraw/zinc/05/57/07/1118055707.db2.gz CMIBEAKMFSSSTP-UHFFFAOYSA-N 1 0 299.462 3.941 20 10 CHCDRO C[C@H]1CC[N@H+](Cc2ccc(N3CCCCC3)cc2)C[C@H]1F ZINC000779151209 1128752902 /nfs/dbraw/zinc/75/29/02/1128752902.db2.gz VSMHNPYEGFYKIQ-MAUKXSAKSA-N 1 0 290.426 3.857 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2ccc(N3CCCCC3)cc2)C[C@H]1F ZINC000779151206 1128753098 /nfs/dbraw/zinc/75/30/98/1128753098.db2.gz VSMHNPYEGFYKIQ-CRAIPNDOSA-N 1 0 290.426 3.857 20 10 CHCDRO C[C@@H]1CC[C@@H](C)[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC000211564784 1118074256 /nfs/dbraw/zinc/07/42/56/1118074256.db2.gz DIVBQGAHOYJBMM-GHMZBOCLSA-N 1 0 253.773 3.666 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+](C)[C@@H](C)c2ccccc2)c1 ZINC000179701979 1128754090 /nfs/dbraw/zinc/75/40/90/1128754090.db2.gz NXIWGCZTWXAAFN-AWEZNQCLSA-N 1 0 255.361 3.894 20 10 CHCDRO CCC[C@@H](C)[NH2+][C@@H](C)c1ccc(N2CCOCC2)c(F)c1 ZINC000764435453 1118091860 /nfs/dbraw/zinc/09/18/60/1118091860.db2.gz NGHFHPFTYZHFQJ-KGLIPLIRSA-N 1 0 294.414 3.502 20 10 CHCDRO Cc1ccc(OCC[NH2+][C@@H](C)c2ccc(N(C)C)cc2)cc1 ZINC000764591643 1118101553 /nfs/dbraw/zinc/10/15/53/1118101553.db2.gz YEGDWGSITLWOJM-INIZCTEOSA-N 1 0 298.430 3.791 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@H](C)C2CC2)cc1 ZINC000765391389 1118147590 /nfs/dbraw/zinc/14/75/90/1118147590.db2.gz DXPADKYABKGDFH-KBPBESRZSA-N 1 0 260.425 3.839 20 10 CHCDRO CCCCOCC[NH2+][C@@H](CC)c1ccc(N(C)C)cc1 ZINC000765455109 1118152855 /nfs/dbraw/zinc/15/28/55/1118152855.db2.gz UUUXPFACPJDHTR-KRWDZBQOSA-N 1 0 278.440 3.610 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]CCc1ccc(F)cc1 ZINC000083551142 1118166644 /nfs/dbraw/zinc/16/66/44/1118166644.db2.gz HEWGMKBJOSGURX-UHFFFAOYSA-N 1 0 279.742 3.517 20 10 CHCDRO CC[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(N(C)C)cc2)C1 ZINC000083639719 1118190998 /nfs/dbraw/zinc/19/09/98/1118190998.db2.gz COTCAJHEBGVDQW-GDBMZVCRSA-N 1 0 260.425 3.811 20 10 CHCDRO COc1cnccc1[C@@H](C)[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000188782292 1128765367 /nfs/dbraw/zinc/76/53/67/1128765367.db2.gz XYULIXUVXMSLIV-OLZOCXBDSA-N 1 0 286.375 3.516 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C2(c3ccccc3)CCC2)c1 ZINC000172117217 1118199398 /nfs/dbraw/zinc/19/93/98/1118199398.db2.gz SYTQACKZPHETGN-UHFFFAOYSA-N 1 0 267.372 3.870 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]CC(C)(C)C(C)C)c1 ZINC000188714126 1128764285 /nfs/dbraw/zinc/76/42/85/1128764285.db2.gz KWKJFTAEOVCDRW-LBPRGKRZSA-N 1 0 265.397 3.734 20 10 CHCDRO C[C@H]([NH2+]CCCOc1ccc(F)cc1)c1ccccc1O ZINC000179890292 1128764352 /nfs/dbraw/zinc/76/43/52/1128764352.db2.gz MMAFNWDIMPNALM-ZDUSSCGKSA-N 1 0 289.350 3.651 20 10 CHCDRO c1c(C[NH2+]Cc2ccc3c(c2)CCCO3)[nH]c2ccccc12 ZINC000921624962 1118236425 /nfs/dbraw/zinc/23/64/25/1118236425.db2.gz XYRKQBZMCZOKEL-UHFFFAOYSA-N 1 0 292.382 3.783 20 10 CHCDRO C[C@H]([NH2+]CCCOCCc1ccccc1)c1ccccc1O ZINC000179878927 1128764946 /nfs/dbraw/zinc/76/49/46/1128764946.db2.gz BTSGJSRAUIEXND-INIZCTEOSA-N 1 0 299.414 3.692 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCc3c(F)cccc3C2)c1O ZINC001140184399 1118254955 /nfs/dbraw/zinc/25/49/55/1118254955.db2.gz RUMDZLUXBIQXHA-UHFFFAOYSA-N 1 0 285.362 3.706 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+][C@@H](C)c2ccccc2)c1O ZINC000076274241 1118284551 /nfs/dbraw/zinc/28/45/51/1118284551.db2.gz FEHLZEMNIAOXHD-NSHDSACASA-N 1 0 291.778 3.905 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1cc(F)ccc1O)c1c(C)noc1C ZINC000186187633 1118291458 /nfs/dbraw/zinc/29/14/58/1118291458.db2.gz NTLVJJDHVCFSHH-YMTOWFKASA-N 1 0 292.354 3.938 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cc(F)ccc2C)c1 ZINC000189332229 1128770862 /nfs/dbraw/zinc/77/08/62/1128770862.db2.gz FINHVKNGVPILRL-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]CC(C)(C)c2cccs2)c1 ZINC000083601777 1118356004 /nfs/dbraw/zinc/35/60/04/1118356004.db2.gz ZAMZBKUQSCHQIA-UHFFFAOYSA-N 1 0 275.417 3.830 20 10 CHCDRO CCC(CC)[C@@H](C[NH2+]Cc1c(O)cccc1Cl)N(C)C ZINC000083551805 1118356589 /nfs/dbraw/zinc/35/65/89/1118356589.db2.gz CXBKKVDQXSKUEC-OAHLLOKOSA-N 1 0 298.858 3.502 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]CCc1cc(F)cc(F)c1 ZINC000083552327 1118356625 /nfs/dbraw/zinc/35/66/25/1118356625.db2.gz OUQMSINLFBUNIC-UHFFFAOYSA-N 1 0 297.732 3.656 20 10 CHCDRO CCOc1cccc(C[N@H+](C)Cc2ccccc2C)c1O ZINC000160521593 1118467742 /nfs/dbraw/zinc/46/77/42/1118467742.db2.gz VIOZMIXFCGDZQX-UHFFFAOYSA-N 1 0 285.387 3.731 20 10 CHCDRO C[C@H]([NH2+]CC1CCC(F)(F)CC1)c1ccccc1O ZINC000693335951 1118545099 /nfs/dbraw/zinc/54/50/99/1118545099.db2.gz REZYZKCLZQGZSX-NSHDSACASA-N 1 0 269.335 3.868 20 10 CHCDRO Cc1noc(C)c1[C@@H](C)[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000092326652 1118582970 /nfs/dbraw/zinc/58/29/70/1118582970.db2.gz CRDKNGBUGSOJKP-WDEREUQCSA-N 1 0 274.364 3.717 20 10 CHCDRO CC[C@H](C)[C@H](C[NH2+][C@H](C)c1ccc(C)c(C)c1O)OC ZINC000834856011 1118586308 /nfs/dbraw/zinc/58/63/08/1118586308.db2.gz KDWVZWSNDBWKDN-PEYYIBSZSA-N 1 0 279.424 3.721 20 10 CHCDRO COc1ccc(C[NH2+]C[C@H]2CCCC[C@H]2C)cc1C ZINC000109935546 1118590367 /nfs/dbraw/zinc/59/03/67/1118590367.db2.gz OELUBJZLZVIXLZ-CZUORRHYSA-N 1 0 261.409 3.920 20 10 CHCDRO CCC(C)(C)OCC[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000308687297 1118681902 /nfs/dbraw/zinc/68/19/02/1118681902.db2.gz BBAWKDFOHNARNP-CQSZACIVSA-N 1 0 278.440 3.608 20 10 CHCDRO Cc1[nH]c2ccccc2c1CC[NH2+]Cc1cc(F)ccc1O ZINC000180577132 1128799909 /nfs/dbraw/zinc/79/99/09/1128799909.db2.gz NRKBVNNLYKVOMB-UHFFFAOYSA-N 1 0 298.361 3.653 20 10 CHCDRO C[C@H](c1cccnc1)[N@H+](C)C/C=C/c1ccc(N(C)C)cc1 ZINC000835048543 1118823447 /nfs/dbraw/zinc/82/34/47/1118823447.db2.gz UJMVUKKRJVRYRS-FYCOFBDGSA-N 1 0 295.430 3.854 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+][C@H]1CCc2ccccc2C1 ZINC000051630678 1119059441 /nfs/dbraw/zinc/05/94/41/1119059441.db2.gz ZHKOWDWZKJTYIZ-INIZCTEOSA-N 1 0 287.790 3.693 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](C)c2cccnc2)cc1 ZINC000158493846 1119066039 /nfs/dbraw/zinc/06/60/39/1119066039.db2.gz QQMHXKKNJFJJEG-GJZGRUSLSA-N 1 0 283.419 3.950 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CC=CCC1)c1ccc(N(C)C)cc1 ZINC000045629130 1119074401 /nfs/dbraw/zinc/07/44/01/1119074401.db2.gz SUFXUJIXKODHGF-GJZGRUSLSA-N 1 0 258.409 3.760 20 10 CHCDRO C[C@@H]1CC[C@H]([NH2+]Cc2cc(Cl)ccc2O)[C@@H](C)C1 ZINC000226160829 1119108309 /nfs/dbraw/zinc/10/83/09/1119108309.db2.gz BUQWTCVHMQURBA-SUNKGSAMSA-N 1 0 267.800 3.960 20 10 CHCDRO C[C@H]([NH2+]Cc1cccc(N(C)C)c1)c1ccc(N(C)C)cc1 ZINC000119856630 1119223642 /nfs/dbraw/zinc/22/36/42/1119223642.db2.gz YVDJNZIYMUGHPD-HNNXBMFYSA-N 1 0 297.446 3.669 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(F)cc2F)c1 ZINC000051016751 1119361050 /nfs/dbraw/zinc/36/10/50/1119361050.db2.gz OHGQKBJDZMBOBO-LLVKDONJSA-N 1 0 277.314 3.830 20 10 CHCDRO CC(C)(C)[C@@H]1CCC[N@H+](Cc2cc(F)ccc2O)C1 ZINC000708455630 1119468549 /nfs/dbraw/zinc/46/85/49/1119468549.db2.gz XDYLXSSLERIJFR-CYBMUJFWSA-N 1 0 265.372 3.789 20 10 CHCDRO CC1CC[NH+](CCSc2ncc(Cl)s2)CC1 ZINC000850000392 1119601945 /nfs/dbraw/zinc/60/19/45/1119601945.db2.gz SYQVKOMBTGTMLZ-UHFFFAOYSA-N 1 0 276.858 3.621 20 10 CHCDRO CC(=O)c1cc(F)cc(C[NH2+][C@@H](C)c2ccccc2)c1O ZINC000181377472 1128875263 /nfs/dbraw/zinc/87/52/63/1128875263.db2.gz ULROWBWDWCJRBQ-NSHDSACASA-N 1 0 287.334 3.585 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1cscn1)c1ccc(Cl)cc1O ZINC000850512206 1119963945 /nfs/dbraw/zinc/96/39/45/1119963945.db2.gz YGEJJQOOLYLYMB-BDAKNGLRSA-N 1 0 282.796 3.914 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCCC(F)(F)C2)c1 ZINC000695123562 1120110000 /nfs/dbraw/zinc/11/00/00/1120110000.db2.gz AQDYMSVPNLJKLS-VXGBXAGGSA-N 1 0 269.335 3.929 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCCC(F)(F)C2)c(O)c1 ZINC000695125318 1120110762 /nfs/dbraw/zinc/11/07/62/1120110762.db2.gz ICGFJGDPFLDWGR-NEPJUHHUSA-N 1 0 269.335 3.929 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CCCCC[C@@H]2C)c(Cl)c1 ZINC001236797722 1128893387 /nfs/dbraw/zinc/89/33/87/1128893387.db2.gz AIXCYRHFTRZFFB-NSHDSACASA-N 1 0 283.799 3.819 20 10 CHCDRO COc1ccccc1[C@H](C)[N@H+](C)Cc1ccc(C)cc1O ZINC001140950764 1120136286 /nfs/dbraw/zinc/13/62/86/1120136286.db2.gz HEDSEPRASBPAFY-AWEZNQCLSA-N 1 0 285.387 3.902 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCOC1(C)C)c1ccc2ccccc2c1O ZINC000328416168 1120175137 /nfs/dbraw/zinc/17/51/37/1120175137.db2.gz IKSCIWPHERUZHG-WBMJQRKESA-N 1 0 285.387 3.764 20 10 CHCDRO Cc1cccc(C[N@H+](C)Cc2ccc(F)c(F)c2)c1O ZINC000179680776 1120252349 /nfs/dbraw/zinc/25/23/49/1120252349.db2.gz XCPSJNLQRAWHAQ-UHFFFAOYSA-N 1 0 277.314 3.611 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CC[C@@H](Cc2ccc(F)cc2)C1 ZINC000180162746 1120267103 /nfs/dbraw/zinc/26/71/03/1120267103.db2.gz AYWCNQIZAUQART-HNNXBMFYSA-N 1 0 285.362 3.596 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCc2ccsc2)c(O)c1C ZINC000756378907 1120281835 /nfs/dbraw/zinc/28/18/35/1120281835.db2.gz JWXATXNZBLMEBD-ZDUSSCGKSA-N 1 0 275.417 3.964 20 10 CHCDRO CSCC[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1[O-] ZINC000309883153 1120283203 /nfs/dbraw/zinc/28/32/03/1120283203.db2.gz WOILVXYYMYXAQK-SSDOTTSWSA-N 1 0 280.220 3.713 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCS[C@@H]2C)cc1 ZINC000312089294 1120293420 /nfs/dbraw/zinc/29/34/20/1120293420.db2.gz PADPFUFABFCFAK-CJNGLKHVSA-N 1 0 278.465 3.516 20 10 CHCDRO CC[C@@H](C)[NH2+][C@H](C)c1cc(Br)cc(C)c1O ZINC000309409030 1120294987 /nfs/dbraw/zinc/29/49/87/1120294987.db2.gz BKIJVLIYXKGCHA-NXEZZACHSA-N 1 0 286.213 3.912 20 10 CHCDRO CC(C)(C)c1cccc(C[N@@H+]2CCc3cnccc3C2)c1O ZINC001143104291 1120350595 /nfs/dbraw/zinc/35/05/95/1120350595.db2.gz RRZRNBJYXKBPTH-UHFFFAOYSA-N 1 0 296.414 3.643 20 10 CHCDRO Cc1cc(C)c(O)c(C[NH+]2CCC(c3ccncc3)CC2)c1 ZINC000191293126 1128913751 /nfs/dbraw/zinc/91/37/51/1128913751.db2.gz AUAPAUIWPOOLEZ-UHFFFAOYSA-N 1 0 296.414 3.784 20 10 CHCDRO C[C@@H](C[NH2+]Cc1ccc2c(c1)CCCO2)CC(F)(F)F ZINC000922187012 1120454322 /nfs/dbraw/zinc/45/43/22/1120454322.db2.gz SHLVJRRTSXFJJY-LLVKDONJSA-N 1 0 287.325 3.690 20 10 CHCDRO COc1cccc(C[NH2+][C@@H]2CCC[C@H](C(C)C)C2)c1O ZINC000728777068 1120456930 /nfs/dbraw/zinc/45/69/30/1120456930.db2.gz YAQOUPLUVLNKJD-DZGCQCFKSA-N 1 0 277.408 3.705 20 10 CHCDRO Cc1cccc(C[N@@H+]2CC[C@@H](C(F)(F)F)C2(C)C)c1O ZINC000312550712 1120466503 /nfs/dbraw/zinc/46/65/03/1120466503.db2.gz QIDMATFEWFCWNL-GFCCVEGCSA-N 1 0 287.325 3.863 20 10 CHCDRO CN(C)c1ccc(C[NH2+]Cc2ccsc2Cl)cc1 ZINC000312560741 1120480936 /nfs/dbraw/zinc/48/09/36/1120480936.db2.gz NVLOIIAHJDBBCI-UHFFFAOYSA-N 1 0 280.824 3.757 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+][C@H]2CC3CCC2CC3)c1O ZINC000312615045 1120493834 /nfs/dbraw/zinc/49/38/34/1120493834.db2.gz AOYRAQRPJADNJO-MGULZYLOSA-N 1 0 295.810 3.723 20 10 CHCDRO Cc1cccc(CC[NH2+][C@H]2CCc3cccc(O)c32)c1 ZINC000312650571 1120522527 /nfs/dbraw/zinc/52/25/27/1120522527.db2.gz FLFWIAUCIUJIFI-INIZCTEOSA-N 1 0 267.372 3.520 20 10 CHCDRO CCC(CC)C[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1 ZINC000123432363 1120545918 /nfs/dbraw/zinc/54/59/18/1120545918.db2.gz WVGSSFDTLSHXPA-OAHLLOKOSA-N 1 0 290.451 3.610 20 10 CHCDRO CCOCCC[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000019962917 1120554459 /nfs/dbraw/zinc/55/44/59/1120554459.db2.gz MAOIRKYPIGHCKS-CYBMUJFWSA-N 1 0 273.376 3.623 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H](c2ccccn2)C2CC2)cc1C ZINC000922586055 1120558516 /nfs/dbraw/zinc/55/85/16/1120558516.db2.gz JUDWPCLBCXNVSC-SFHVURJKSA-N 1 0 282.387 3.645 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+][C@H](c1ccccn1)C1CC1 ZINC000922587189 1120558903 /nfs/dbraw/zinc/55/89/03/1120558903.db2.gz YGWXKUDCZLGRRR-INIZCTEOSA-N 1 0 288.778 3.682 20 10 CHCDRO Cc1cccc(C[NH2+]C[C@H]2CC[C@@H](c3ccccc3)O2)c1O ZINC000368665642 1120564437 /nfs/dbraw/zinc/56/44/37/1120564437.db2.gz HPIKBKUNZDKEQP-MSOLQXFVSA-N 1 0 297.398 3.711 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+][C@@H](C)CCC2CC2)c1O ZINC000398082221 1120565627 /nfs/dbraw/zinc/56/56/27/1120565627.db2.gz RVLJITQXOMOMKN-JTQLQIEISA-N 1 0 283.799 3.723 20 10 CHCDRO C[C@@H]1CC[C@]2(CC[N@H+](Cc3cc(F)ccc3O)C2)C1 ZINC000781927307 1120572665 /nfs/dbraw/zinc/57/26/65/1120572665.db2.gz DJJVUXIMGUEQBO-WBMJQRKESA-N 1 0 263.356 3.543 20 10 CHCDRO c1csc(SCCC[NH2+]C2CCCCC2)n1 ZINC000053647042 1120575200 /nfs/dbraw/zinc/57/52/00/1120575200.db2.gz UTJHWQKQIPDGDP-UHFFFAOYSA-N 1 0 256.440 3.548 20 10 CHCDRO CC(C)CC[C@@](C)(O)C[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000756606151 1120595963 /nfs/dbraw/zinc/59/59/63/1120595963.db2.gz VXBMAZZACBQRHO-BLLLJJGKSA-N 1 0 299.842 3.883 20 10 CHCDRO Cc1csc([C@H](C)C[NH2+][C@H](C)c2cc(F)ccc2O)n1 ZINC000186579523 1120598608 /nfs/dbraw/zinc/59/86/08/1120598608.db2.gz NCKILWYJWLSNHJ-MWLCHTKSSA-N 1 0 294.395 3.751 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H]2CCSC3(CCC3)C2)c1 ZINC000922844949 1120612810 /nfs/dbraw/zinc/61/28/10/1120612810.db2.gz IYFZWCFYCWRCSA-CQSZACIVSA-N 1 0 277.433 3.609 20 10 CHCDRO Oc1cccc2c1C[N@@H+]([C@H]1Cc3cccc(Cl)c3C1)CC2 ZINC001168737647 1120633055 /nfs/dbraw/zinc/63/30/55/1120633055.db2.gz BQTATGUSJNYJBY-AWEZNQCLSA-N 1 0 299.801 3.571 20 10 CHCDRO CCOc1cccc(C[N@H+](C(C)C)C2CCC2)c1O ZINC000093608321 1120830748 /nfs/dbraw/zinc/83/07/48/1120830748.db2.gz RMVIFSPNKPKZRU-UHFFFAOYSA-N 1 0 263.381 3.554 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]CCc1ccc(F)cc1 ZINC000779438637 1128944382 /nfs/dbraw/zinc/94/43/82/1128944382.db2.gz LYLPYLFUUKKGFO-UHFFFAOYSA-N 1 0 286.394 3.532 20 10 CHCDRO COc1ccccc1CC[NH2+][C@H](C)c1cc(C)ccc1O ZINC000184861366 1120906317 /nfs/dbraw/zinc/90/63/17/1120906317.db2.gz UIIDLPBKARWNKU-CQSZACIVSA-N 1 0 285.387 3.603 20 10 CHCDRO COc1ccccc1CC[NH2+][C@H](C)c1ccc(C)cc1O ZINC000184861492 1120906727 /nfs/dbraw/zinc/90/67/27/1120906727.db2.gz CJFUPOMGRMEOOS-CQSZACIVSA-N 1 0 285.387 3.603 20 10 CHCDRO CC(C)CC[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000022148383 1120977972 /nfs/dbraw/zinc/97/79/72/1120977972.db2.gz YWXGSOULKIJFIN-UHFFFAOYSA-N 1 0 260.425 3.813 20 10 CHCDRO Oc1cccc2c1CC[C@@H]2[NH2+]Cc1cc(Cl)ccc1O ZINC000105486525 1120978760 /nfs/dbraw/zinc/97/87/60/1120978760.db2.gz AQBKMTUEDXNZJN-AWEZNQCLSA-N 1 0 289.762 3.528 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCc2ccccc2C)c1 ZINC000094182629 1120979754 /nfs/dbraw/zinc/97/97/54/1120979754.db2.gz CUWLGWIQSBLBAX-HNNXBMFYSA-N 1 0 269.388 3.902 20 10 CHCDRO COCC1(CC[NH2+]Cc2c(O)cc(C)cc2Cl)CCC1 ZINC000840949551 1121021002 /nfs/dbraw/zinc/02/10/02/1121021002.db2.gz XHLGWSQQNTZEFG-UHFFFAOYSA-N 1 0 297.826 3.650 20 10 CHCDRO CCCC[N@H+](Cc1ccccn1)Cc1ccccc1O ZINC000282513005 1121055779 /nfs/dbraw/zinc/05/57/79/1121055779.db2.gz SGRBGQPQBLRPIU-UHFFFAOYSA-N 1 0 270.376 3.590 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H]2C[C@H](c3ccccc3)[C@@H]2C)c1 ZINC000763518642 1128960831 /nfs/dbraw/zinc/96/08/31/1128960831.db2.gz NJDLVYMZRLOXCN-JCGIZDLHSA-N 1 0 281.399 3.982 20 10 CHCDRO CC[C@H]([NH2+]Cc1cccc(COC)c1)c1ccccc1O ZINC000038010505 1121095225 /nfs/dbraw/zinc/09/52/25/1121095225.db2.gz RLHXELWMTKSPEU-KRWDZBQOSA-N 1 0 285.387 3.780 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CC1CCSCC1 ZINC000168773828 1121143820 /nfs/dbraw/zinc/14/38/20/1121143820.db2.gz PSXOSJCXGKALKW-OCCSQVGLSA-N 1 0 291.460 3.982 20 10 CHCDRO Cc1cc(C[NH2+][C@@H]2CCO[C@@H](C)C2)c(C)n1-c1ccccc1 ZINC000318851024 1121172140 /nfs/dbraw/zinc/17/21/40/1121172140.db2.gz NTMQSTBBODYHPO-MAUKXSAKSA-N 1 0 298.430 3.751 20 10 CHCDRO COc1cccc(C[NH2+]CC[C@@H](C)c2ccccc2)c1O ZINC000060942197 1121173208 /nfs/dbraw/zinc/17/32/08/1121173208.db2.gz OFENLNDKYXZHBP-CQSZACIVSA-N 1 0 285.387 3.684 20 10 CHCDRO CCCC(O)(CCC)C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000766091500 1121219530 /nfs/dbraw/zinc/21/95/30/1121219530.db2.gz BBYWUYYDHDUGCA-OAHLLOKOSA-N 1 0 292.467 3.735 20 10 CHCDRO Cc1cc(C[NH2+][C@@H]2CCOC[C@@H]2C)c(C)n1-c1ccccc1 ZINC000319022497 1121223964 /nfs/dbraw/zinc/22/39/64/1121223964.db2.gz IDEDYTDXHDUVDE-IFXJQAMLSA-N 1 0 298.430 3.609 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+]C[C@@H]1CCC[C@H](C)O1 ZINC001203162006 1121227179 /nfs/dbraw/zinc/22/71/79/1121227179.db2.gz VBDIUTDTZFPIFL-ZFWWWQNUSA-N 1 0 286.419 3.534 20 10 CHCDRO Cc1ccsc1C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000094874726 1121236038 /nfs/dbraw/zinc/23/60/38/1121236038.db2.gz GDYUOYGVTFFKNX-CYBMUJFWSA-N 1 0 274.433 3.973 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]CCCSCC(C)C)c1 ZINC000182456870 1128972285 /nfs/dbraw/zinc/97/22/85/1128972285.db2.gz QAOBANPNXACKON-CYBMUJFWSA-N 1 0 297.464 3.831 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CSC[C@@H]1C)c1ccc(N(C)C)cc1 ZINC000797064039 1121267123 /nfs/dbraw/zinc/26/71/23/1121267123.db2.gz FPOHWMQGHGFCIF-VBNZEHGJSA-N 1 0 278.465 3.545 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CC[C@H](CC(F)(F)F)C2)cc1C ZINC000766118621 1121269862 /nfs/dbraw/zinc/26/98/62/1121269862.db2.gz NQACGLPXZITWIG-GFCCVEGCSA-N 1 0 287.325 3.783 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]Cc1cc2ccccc2[nH]1 ZINC000113330902 1121271684 /nfs/dbraw/zinc/27/16/84/1121271684.db2.gz DGSGFPQDPLBKEW-UHFFFAOYSA-N 1 0 286.762 3.817 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)Cc1cccc(F)c1OC ZINC001143537089 1121425923 /nfs/dbraw/zinc/42/59/23/1121425923.db2.gz OONXKJHREOOETE-UHFFFAOYSA-N 1 0 289.350 3.562 20 10 CHCDRO C[C@@H]1CC[C@@H](C)[NH+]1Cc1cc(Br)ccc1O ZINC000706497665 1121432368 /nfs/dbraw/zinc/43/23/68/1121432368.db2.gz DPZQPZLIWWJVKR-NXEZZACHSA-N 1 0 284.197 3.528 20 10 CHCDRO C[C@H]([NH2+]Cc1csc(C2CC2)n1)c1ccccc1O ZINC000708228056 1121464013 /nfs/dbraw/zinc/46/40/13/1121464013.db2.gz OQVHJRPLWWJWFV-JTQLQIEISA-N 1 0 274.389 3.577 20 10 CHCDRO Oc1ccccc1C[NH+]1CCC(C2CCCC2)CC1 ZINC000708798436 1121466422 /nfs/dbraw/zinc/46/64/22/1121466422.db2.gz BCEPEYLLPWWLEE-UHFFFAOYSA-N 1 0 259.393 3.794 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H](C)CCc2ccccc2)c1O ZINC000236954281 1121506918 /nfs/dbraw/zinc/50/69/18/1121506918.db2.gz GLDGQSKDROHZOB-HNNXBMFYSA-N 1 0 299.414 3.902 20 10 CHCDRO Cc1cc(Nc2c(O)ccc3ccccc32)cc(C)[nH+]1 ZINC001176055183 1121541900 /nfs/dbraw/zinc/54/19/00/1121541900.db2.gz ALXQYOLBTHKSLP-UHFFFAOYSA-N 1 0 264.328 3.723 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCc3ccccc32)c1 ZINC000182802790 1128999553 /nfs/dbraw/zinc/99/95/53/1128999553.db2.gz BNAUHLYJISEMCA-ZFWWWQNUSA-N 1 0 297.398 3.781 20 10 CHCDRO C[C@@]1(CC[NH2+]Cc2ccc(N3CCCC3)cc2)CC1(F)F ZINC001118424243 1121663843 /nfs/dbraw/zinc/66/38/43/1121663843.db2.gz VMBHQLVIEHVMOI-MRXNPFEDSA-N 1 0 294.389 3.812 20 10 CHCDRO CCc1ccc(C[N@@H+]2CCCc3cc(O)c(O)cc3C2)cc1 ZINC001204178474 1121693942 /nfs/dbraw/zinc/69/39/42/1121693942.db2.gz UJXNXUUAEHLOKF-UHFFFAOYSA-N 1 0 297.398 3.609 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CCC2CCC2)cc1 ZINC000133890693 1121704492 /nfs/dbraw/zinc/70/44/92/1121704492.db2.gz JOAYYCVPVJHGRK-UHFFFAOYSA-N 1 0 260.425 3.813 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@@H+](C)C[C@H](C)c2nccs2)c1 ZINC000182846410 1129004662 /nfs/dbraw/zinc/00/46/62/1129004662.db2.gz FDEHZTCSFZHJIL-ZDUSSCGKSA-N 1 0 290.432 3.701 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc(C)cc(OC)c1O)c1ccccc1 ZINC000894208399 1121767807 /nfs/dbraw/zinc/76/78/07/1121767807.db2.gz HSWXLJSTNBBGBQ-MRXNPFEDSA-N 1 0 285.387 3.950 20 10 CHCDRO CC(C)(C[NH2+]Cc1ccc2c(c1)CCO2)C1CCCC1 ZINC001178205915 1121771348 /nfs/dbraw/zinc/77/13/48/1121771348.db2.gz VTIVPCKZBVDLPL-UHFFFAOYSA-N 1 0 273.420 3.928 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H]1CC[C@@H](C)C1 ZINC001206321143 1121771464 /nfs/dbraw/zinc/77/14/64/1121771464.db2.gz PROKIQJTGGHKDX-UKPHBRMFSA-N 1 0 274.452 3.770 20 10 CHCDRO CCCOc1ccc(C[NH2+]CC(C)(C)OCC)cc1C ZINC001178501181 1121787644 /nfs/dbraw/zinc/78/76/44/1121787644.db2.gz QMNPTBSJIYXNHU-UHFFFAOYSA-N 1 0 279.424 3.689 20 10 CHCDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]CCCC(F)F ZINC001119542179 1121800684 /nfs/dbraw/zinc/80/06/84/1121800684.db2.gz XQDOWZRNBUZDPF-QWRGUYRKSA-N 1 0 269.335 3.884 20 10 CHCDRO Oc1cc2c(cc1C[N@@H+]1CCCc3sccc3C1)CCC2 ZINC000730454266 1121812203 /nfs/dbraw/zinc/81/22/03/1121812203.db2.gz JQQFPUAPARPPPD-UHFFFAOYSA-N 1 0 299.439 3.891 20 10 CHCDRO c1ccc2c(c1)CC[C@@H]2CC[NH2+]Cc1ccc2c(c1)CCO2 ZINC001178828295 1121821406 /nfs/dbraw/zinc/82/14/06/1121821406.db2.gz YHELLIIIULJCAT-QGZVFWFLSA-N 1 0 293.410 3.831 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C[C@H]2CCC[C@H]2C2CC2)cc1F ZINC001178950015 1121833349 /nfs/dbraw/zinc/83/33/49/1121833349.db2.gz JNMRHIOPTUYFIG-CVEARBPZSA-N 1 0 290.426 3.808 20 10 CHCDRO CN(C)c1cc(F)c(C[NH2+]C[C@@H]2C[C@H]2C2CCC2)cc1F ZINC001179002057 1121837890 /nfs/dbraw/zinc/83/78/90/1121837890.db2.gz IWEZXLAWKZCMKO-JSGCOSHPSA-N 1 0 294.389 3.557 20 10 CHCDRO CC1CCN(c2ccc(C[NH2+]Cc3ccoc3)cc2)CC1 ZINC000731041699 1121844015 /nfs/dbraw/zinc/84/40/15/1121844015.db2.gz PRUTZZRYEGMMKF-UHFFFAOYSA-N 1 0 284.403 3.806 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CC2CC=CC2)cc1F ZINC001179169154 1121856223 /nfs/dbraw/zinc/85/62/23/1121856223.db2.gz RGHJPZIPLFLTBE-UHFFFAOYSA-N 1 0 276.399 3.728 20 10 CHCDRO CCC[C@@H](C[NH2+]Cc1c(O)cc(C)cc1Cl)OCC ZINC001179248093 1121863857 /nfs/dbraw/zinc/86/38/57/1121863857.db2.gz NGLNVYABJQKOAO-LBPRGKRZSA-N 1 0 285.815 3.649 20 10 CHCDRO CCN(C)c1ccc(C[NH2+][C@@H](C)c2c(C)noc2C)cc1 ZINC000773815102 1121881523 /nfs/dbraw/zinc/88/15/23/1121881523.db2.gz YQOSKABGCZOBIF-LBPRGKRZSA-N 1 0 287.407 3.598 20 10 CHCDRO COc1cc(C)cc(C[NH2+][C@H]2CCc3c2cccc3C)c1O ZINC000894240116 1121894594 /nfs/dbraw/zinc/89/45/94/1121894594.db2.gz OZAKCVFCUVKCAN-KRWDZBQOSA-N 1 0 297.398 3.795 20 10 CHCDRO CN(C)c1cc(F)c(C[NH2+]C(C)(C)/C=C\Cl)cc1F ZINC001179626397 1121897700 /nfs/dbraw/zinc/89/77/00/1121897700.db2.gz IUBHKGSYBVEBFR-WAYWQWQTSA-N 1 0 288.769 3.652 20 10 CHCDRO CC[C@H](C)C[N@H+](C)Cc1cc(C(C)(C)C)cc(O)c1O ZINC000732183404 1121910991 /nfs/dbraw/zinc/91/09/91/1121910991.db2.gz PBKWQDMWWGGIDE-LBPRGKRZSA-N 1 0 279.424 3.873 20 10 CHCDRO CC(C)c1ccc(O)c(C[N@@H+]2CCC[C@@H](c3ncc[nH]3)C2)c1 ZINC001179850593 1121916295 /nfs/dbraw/zinc/91/62/95/1121916295.db2.gz YQTWEIQTMFWVNM-OAHLLOKOSA-N 1 0 299.418 3.618 20 10 CHCDRO CCC[N@@H+](Cc1ccccc1O)C[C@@H](OC)[C@H](C)CC ZINC001180194735 1121964706 /nfs/dbraw/zinc/96/47/06/1121964706.db2.gz MAEQHOWKZHSHKO-RHSMWYFYSA-N 1 0 279.424 3.665 20 10 CHCDRO CCC[N@H+](Cc1ccccc1O)Cc1ccccc1NC ZINC001180195079 1121965594 /nfs/dbraw/zinc/96/55/94/1121965594.db2.gz QFYICYDTDXUIHD-UHFFFAOYSA-N 1 0 284.403 3.846 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2cc(F)ccc2O)[C@H]2CCCC[C@@H]12 ZINC001180271335 1121971310 /nfs/dbraw/zinc/97/13/10/1121971310.db2.gz ISFPEDDZHKSMQO-KCXAZCMYSA-N 1 0 277.383 3.932 20 10 CHCDRO CN(C)c1ccc(C[NH2+]CCC2CCCC2)cc1F ZINC000733322863 1121976208 /nfs/dbraw/zinc/97/62/08/1121976208.db2.gz WALSHVCLRSLJGQ-UHFFFAOYSA-N 1 0 264.388 3.562 20 10 CHCDRO CC[C@@H]1CCCC[N@@H+]1Cc1cc(F)c(N(C)C)cc1F ZINC001180372567 1121984867 /nfs/dbraw/zinc/98/48/67/1121984867.db2.gz VCGBPWKIDGIYSU-CYBMUJFWSA-N 1 0 282.378 3.795 20 10 CHCDRO COc1cc(C)c(C[N@H+](C)CC2CCCCC2)c(O)c1 ZINC001180539850 1121998142 /nfs/dbraw/zinc/99/81/42/1121998142.db2.gz BRDOCXNGUBLPGX-UHFFFAOYSA-N 1 0 277.408 3.721 20 10 CHCDRO COc1cc(C)cc(C[N@@H+]2CC3(CCC3)[C@H]2C(C)C)c1O ZINC001182087044 1122107927 /nfs/dbraw/zinc/10/79/27/1122107927.db2.gz OTHWEOFHYLNVPO-QGZVFWFLSA-N 1 0 289.419 3.720 20 10 CHCDRO Cc1ccc(O)c(C[N@H+]2CC[C@H](C)C3(CCC3)C2)c1 ZINC000779604417 1129031989 /nfs/dbraw/zinc/03/19/89/1129031989.db2.gz LCYLURBTQHHFRM-AWEZNQCLSA-N 1 0 259.393 3.713 20 10 CHCDRO Cc1cccc(C[N@H+]2CC[C@@H](C)C3(CCC3)C2)c1O ZINC000779604335 1129032081 /nfs/dbraw/zinc/03/20/81/1129032081.db2.gz JNPOXNKZISSTHR-CQSZACIVSA-N 1 0 259.393 3.713 20 10 CHCDRO Cc1ccc(C[N@@H+]2Cc3ccccc3OC(C)(C)C2)c(O)c1 ZINC001182152740 1122116476 /nfs/dbraw/zinc/11/64/76/1122116476.db2.gz SITSPESKTPYFOQ-UHFFFAOYSA-N 1 0 297.398 3.874 20 10 CHCDRO c1ccc2c(c1)NCCC[C@H]2[NH2+]Cc1ccc2c(c1)CCO2 ZINC000774159969 1122135588 /nfs/dbraw/zinc/13/55/88/1122135588.db2.gz AABORFWHAZSLPV-GOSISDBHSA-N 1 0 294.398 3.658 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc3c(c2)OCO3)c(O)c1 ZINC000192749822 1129033767 /nfs/dbraw/zinc/03/37/67/1129033767.db2.gz AVIIXEVAVDUYQA-STQMWFEESA-N 1 0 299.370 3.841 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCCc2occc21 ZINC000774193626 1122138267 /nfs/dbraw/zinc/13/82/67/1122138267.db2.gz UQUWCKTZRZPIOW-KRWDZBQOSA-N 1 0 284.403 3.821 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cccc3cc[nH]c32)c1 ZINC000774428178 1122163615 /nfs/dbraw/zinc/16/36/15/1122163615.db2.gz BBZLHNOBVWVNOH-LBPRGKRZSA-N 1 0 296.370 3.733 20 10 CHCDRO CCSCCC[NH2+][C@H](CC)c1ccccc1O ZINC000271683165 1122171771 /nfs/dbraw/zinc/17/17/71/1122171771.db2.gz IVMKRIULWDVSQI-CYBMUJFWSA-N 1 0 253.411 3.576 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)C[C@H]2CC2(C)C)c(Cl)c1 ZINC001183074290 1122202115 /nfs/dbraw/zinc/20/21/15/1122202115.db2.gz DIKSQLBZMIREMS-LLVKDONJSA-N 1 0 267.800 3.832 20 10 CHCDRO CC[C@@H]1[C@H](C)CC[N@@H+]1Cc1cc2c(cc1O)CCC2 ZINC000774618487 1122218004 /nfs/dbraw/zinc/21/80/04/1122218004.db2.gz LNRUGYBZQLRVPI-MLGOLLRUSA-N 1 0 259.393 3.501 20 10 CHCDRO CCc1cccc(C[NH2+]C2([C@H]3CCCCO3)CCC2)c1O ZINC001183482995 1122224838 /nfs/dbraw/zinc/22/48/38/1122224838.db2.gz PSNYLUHVSRIWGH-MRXNPFEDSA-N 1 0 289.419 3.536 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2cccc3c2OCO3)c(O)c1C ZINC000273302338 1122228249 /nfs/dbraw/zinc/22/82/49/1122228249.db2.gz BRRFMTKDPFBGTO-ZDUSSCGKSA-N 1 0 299.370 3.589 20 10 CHCDRO Cc1csc([C@@H](C)C[NH2+]Cc2c(O)cccc2Cl)n1 ZINC000273341144 1122229413 /nfs/dbraw/zinc/22/94/13/1122229413.db2.gz AJBITWQWJLLRIB-VIFPVBQESA-N 1 0 296.823 3.704 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC[C@H]2CCO[C@@H](C)C2)c(O)c1 ZINC000273386365 1122230218 /nfs/dbraw/zinc/23/02/18/1122230218.db2.gz CTMJLAVDHLXHEI-KKUMJFAQSA-N 1 0 277.408 3.556 20 10 CHCDRO COCC[C@H]([NH2+][C@@H](C)c1cc(C)ccc1O)c1ccco1 ZINC000273413969 1122231168 /nfs/dbraw/zinc/23/11/68/1122231168.db2.gz IIGZGODMWFLOON-ZFWWWQNUSA-N 1 0 289.375 3.722 20 10 CHCDRO CCOc1ccc(C[NH2+][C@@H](C)c2ccc(C)cc2O)cc1 ZINC000273391105 1122231723 /nfs/dbraw/zinc/23/17/23/1122231723.db2.gz KSBGYUIXGVZCTG-AWEZNQCLSA-N 1 0 285.387 3.950 20 10 CHCDRO CC(C)C[C@@H]1C[C@@H]([NH2+][C@H](C)c2cc(F)ccc2O)CCO1 ZINC000273533197 1122237326 /nfs/dbraw/zinc/23/73/26/1122237326.db2.gz WTPRZZZGXVITOS-VHDGCEQUSA-N 1 0 295.398 3.776 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCO[C@@H](C(C)(C)C)C1)c1cc(F)ccc1O ZINC000273530924 1122237846 /nfs/dbraw/zinc/23/78/46/1122237846.db2.gz WHUCKDVBJGVNDK-DETPVDSQSA-N 1 0 295.398 3.776 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCCSC2)c(O)c1C ZINC000273552624 1122238463 /nfs/dbraw/zinc/23/84/63/1122238463.db2.gz GFDKZRBVQGVABX-QWHCGFSZSA-N 1 0 265.422 3.555 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCc2c1cccc2O)c1cc(F)ccc1O ZINC000273562935 1122239114 /nfs/dbraw/zinc/23/91/14/1122239114.db2.gz IPYMCRLKEHMSCA-BMIGLBTASA-N 1 0 287.334 3.575 20 10 CHCDRO COCCC1(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)CCC1 ZINC000273607443 1122240028 /nfs/dbraw/zinc/24/00/28/1122240028.db2.gz UQZLDOQFFJYXPP-OAHLLOKOSA-N 1 0 291.435 3.866 20 10 CHCDRO CCc1cnc(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)s1 ZINC000273621762 1122240909 /nfs/dbraw/zinc/24/09/09/1122240909.db2.gz ZGSGPCMTTHCXDQ-LBPRGKRZSA-N 1 0 290.432 3.879 20 10 CHCDRO CCc1cccc(C[NH2+]CCCc2ccsc2)c1O ZINC001184389150 1122273359 /nfs/dbraw/zinc/27/33/59/1122273359.db2.gz VHEXUQAPRZNGJF-UHFFFAOYSA-N 1 0 275.417 3.739 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CCC[C@@H](CF)C1 ZINC000711498574 1122296847 /nfs/dbraw/zinc/29/68/47/1122296847.db2.gz QHMUFHXGXCBOAF-ZDUSSCGKSA-N 1 0 273.351 3.727 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](c2ccccc2)N(C)C)c(O)c1 ZINC000192907538 1129046665 /nfs/dbraw/zinc/04/66/65/1129046665.db2.gz UIRNPGWWSRBRFJ-QAPCUYQASA-N 1 0 298.430 3.654 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCC(F)(F)C1)c1ccc(N(C)C)cc1 ZINC000281207770 1122396409 /nfs/dbraw/zinc/39/64/09/1122396409.db2.gz UBIGTTOLGCUXSO-CHWSQXEVSA-N 1 0 282.378 3.839 20 10 CHCDRO C[N@@H+](Cc1cc(Cl)ccc1O)C[C@@H]1CC1(C)C ZINC001203664212 1122432005 /nfs/dbraw/zinc/43/20/05/1122432005.db2.gz RBEFSGWHPLWVLH-NSHDSACASA-N 1 0 253.773 3.524 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCc2ccc(F)cc21)c1ccccc1O ZINC000775134972 1122437387 /nfs/dbraw/zinc/43/73/87/1122437387.db2.gz AOTAINRWJVEADA-ZBEGNZNMSA-N 1 0 271.335 3.869 20 10 CHCDRO CCCN(C[C@@H]1CCO[C@H](CC)C1)c1ccc(C[NH3+])cc1 ZINC000775139655 1122438367 /nfs/dbraw/zinc/43/83/67/1122438367.db2.gz DMOKFXAQQFWHRH-SJLPKXTDSA-N 1 0 290.451 3.567 20 10 CHCDRO CCc1ccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)o1 ZINC000775365110 1122528015 /nfs/dbraw/zinc/52/80/15/1122528015.db2.gz SWXGAGWJXKVKFW-ZDUSSCGKSA-N 1 0 272.392 3.759 20 10 CHCDRO C[C@H](C[NH2+][C@H](C)c1ccccc1O)Oc1ccc(F)cc1 ZINC000183534827 1129060839 /nfs/dbraw/zinc/06/08/39/1129060839.db2.gz NCXUOPGUMLUTJM-CHWSQXEVSA-N 1 0 289.350 3.649 20 10 CHCDRO CCN(C)c1ccc(C[N@H+]([C@H](C)C2CC2)C2CC2)cc1 ZINC001190674160 1122551851 /nfs/dbraw/zinc/55/18/51/1122551851.db2.gz PVOZYLXAUZUVFE-CQSZACIVSA-N 1 0 272.436 3.906 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H](C)c2c(F)cccc2F)c1 ZINC000071408075 1129062611 /nfs/dbraw/zinc/06/26/11/1129062611.db2.gz MDMIWHAUTGBQHY-LLVKDONJSA-N 1 0 277.314 3.830 20 10 CHCDRO CC[C@@H](CSC)[NH2+][C@H](C)c1ccc(N(C)CC)cc1 ZINC000775420205 1122559829 /nfs/dbraw/zinc/55/98/29/1122559829.db2.gz IBVUUAIXPUDSOL-HIFRSBDPSA-N 1 0 280.481 3.935 20 10 CHCDRO COc1ccc(N(C)C[C@H]2CCCC[N@@H+]2C(C)C)cc1F ZINC001191891260 1122620651 /nfs/dbraw/zinc/62/06/51/1122620651.db2.gz GZJSPCGIADSZSD-OAHLLOKOSA-N 1 0 294.414 3.533 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](C)N(C)C1CC1)c1cc(Cl)ccc1O ZINC000775501743 1122628869 /nfs/dbraw/zinc/62/88/69/1122628869.db2.gz KTDWBYZGDNWZGU-NHYWBVRUSA-N 1 0 296.842 3.569 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)CSC)c1cc(Cl)ccc1O ZINC000775508623 1122629745 /nfs/dbraw/zinc/62/97/45/1122629745.db2.gz DNOAAHOFQUQIDA-JOYOIKCWSA-N 1 0 273.829 3.838 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1C[C@@](C)(OC)C1(C)C)c1ccccc1O ZINC000775513170 1122633215 /nfs/dbraw/zinc/63/32/15/1122633215.db2.gz OONHHJIOUSRLHJ-YSVLISHTSA-N 1 0 277.408 3.637 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](C)c1ccncc1)c1ccccc1O ZINC000775512921 1122634482 /nfs/dbraw/zinc/63/44/82/1122634482.db2.gz SMQFKGPFSHXQFH-CZUORRHYSA-N 1 0 270.376 3.632 20 10 CHCDRO CC[C@H]([NH2+][C@H](COC)Cc1ccccc1)c1ccccc1O ZINC000775514085 1122634506 /nfs/dbraw/zinc/63/45/06/1122634506.db2.gz VOWLLTHNEYUTBV-WMZOPIPTSA-N 1 0 299.414 3.691 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)C1CCOCC1)c1cc(Cl)ccc1O ZINC000775514393 1122635409 /nfs/dbraw/zinc/63/54/09/1122635409.db2.gz USSYYNJNVLJBQC-XHDPSFHLSA-N 1 0 297.826 3.901 20 10 CHCDRO CC[C@H]([NH2+]CCC1CC1)c1cc(Cl)ccc1O ZINC000775525222 1122641832 /nfs/dbraw/zinc/64/18/32/1122641832.db2.gz FBRJDQNCOJVNMG-ZDUSSCGKSA-N 1 0 253.773 3.886 20 10 CHCDRO Cc1cccc(C[NH2+]Cc2ccc(N(C)C)cc2)c1C ZINC000048463030 1122650906 /nfs/dbraw/zinc/65/09/06/1122650906.db2.gz HNUKDEAHNJCSEH-UHFFFAOYSA-N 1 0 268.404 3.659 20 10 CHCDRO CC[C@H]([NH2+]CC1(OC)CCC1)c1cc(Cl)ccc1O ZINC000775547304 1122658537 /nfs/dbraw/zinc/65/85/37/1122658537.db2.gz PUHQJCPARNSMAW-ZDUSSCGKSA-N 1 0 283.799 3.655 20 10 CHCDRO Cc1cc(C[N@H+]2CC[C@@H](C)C(C)(C)C2)ccc1N(C)C ZINC001193210179 1122680561 /nfs/dbraw/zinc/68/05/61/1122680561.db2.gz KTKOIHIUQMEDGE-OAHLLOKOSA-N 1 0 274.452 3.929 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+]2CCC[C@H](C)C2)c1O ZINC000775638220 1122849117 /nfs/dbraw/zinc/84/91/17/1122849117.db2.gz CITFMYRCOGAKES-JTQLQIEISA-N 1 0 253.773 3.586 20 10 CHCDRO COc1ccc(O)c(C[N@H+]2Cc3ccccc3[C@@H](C)C2)c1 ZINC000775645704 1122853279 /nfs/dbraw/zinc/85/32/79/1122853279.db2.gz FSOHEDZHXPRHBV-ZDUSSCGKSA-N 1 0 283.371 3.520 20 10 CHCDRO CCCSC[C@H](C)[NH2+][C@H](C)c1cc(OC)ccc1O ZINC000894502276 1122865851 /nfs/dbraw/zinc/86/58/51/1122865851.db2.gz OUFAWNWNRUVGGR-NWDGAFQWSA-N 1 0 283.437 3.583 20 10 CHCDRO CC[N@H+](Cc1ccccc1C)Cc1cc(OC)ccc1O ZINC000775652613 1122868585 /nfs/dbraw/zinc/86/85/85/1122868585.db2.gz NZPQVSLCXCEVNK-UHFFFAOYSA-N 1 0 285.387 3.731 20 10 CHCDRO COCC[N@H+](Cc1cccc(C)c1O)[C@H](C)c1ccccc1 ZINC000775657118 1122870904 /nfs/dbraw/zinc/87/09/04/1122870904.db2.gz UWIAEXDLQSCZRP-MRXNPFEDSA-N 1 0 299.414 3.910 20 10 CHCDRO Cc1cccc(C[N@H+](C)CCc2ccccc2F)c1O ZINC000775663183 1122874174 /nfs/dbraw/zinc/87/41/74/1122874174.db2.gz KOHBNDAEHAUSOW-UHFFFAOYSA-N 1 0 273.351 3.514 20 10 CHCDRO CCCN(Cc1ccc(Cl)cn1)c1ccc(C[NH3+])cc1 ZINC000894569017 1122875036 /nfs/dbraw/zinc/87/50/36/1122875036.db2.gz BXGJEUJZKREKQX-UHFFFAOYSA-N 1 0 289.810 3.610 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CCC[C@@H]2CC(C)(C)C)c1 ZINC000775664843 1122875637 /nfs/dbraw/zinc/87/56/37/1122875637.db2.gz BTOMLEIHDIGAAY-CQSZACIVSA-N 1 0 277.408 3.801 20 10 CHCDRO [O-]c1c(F)cc(Cl)cc1C[N@@H+]1CCC[C@H]1C1CCC1 ZINC000775670159 1122884983 /nfs/dbraw/zinc/88/49/83/1122884983.db2.gz UQRYCZBWMKGIOX-AWEZNQCLSA-N 1 0 283.774 3.949 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]C1C[C@H]2CC[C@@H](C1)S2 ZINC000925082102 1122916954 /nfs/dbraw/zinc/91/69/54/1122916954.db2.gz VCEYILIRWNTNFX-ZXFUBFMLSA-N 1 0 290.476 3.577 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CC[C@H](c3ccccc3)[C@@H]2C)c1 ZINC000775723019 1122924555 /nfs/dbraw/zinc/92/45/55/1122924555.db2.gz BNKFRYHACYFYLN-KSSFIOAISA-N 1 0 297.398 3.779 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](C)[C@@H]2C)c1O ZINC000775737054 1122928359 /nfs/dbraw/zinc/92/83/59/1122928359.db2.gz NXWGJKWGEHFONA-KOLCDFICSA-N 1 0 253.773 3.584 20 10 CHCDRO Cc1cccc(CN2CCc3ccc(F)c(F)c3C2)c1O ZINC000775739399 1122930398 /nfs/dbraw/zinc/93/03/98/1122930398.db2.gz DDGSQSSQBSFPKP-UHFFFAOYSA-N 1 0 289.325 3.537 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+]C2(C)CCCC2)c1O ZINC000775819443 1122980942 /nfs/dbraw/zinc/98/09/42/1122980942.db2.gz HQQTVJVCEZKVTQ-UHFFFAOYSA-N 1 0 253.773 3.776 20 10 CHCDRO C[C@H]([NH2+]Cc1ccnc(Cl)c1)c1ccc(N(C)C)cc1 ZINC000775832372 1122984470 /nfs/dbraw/zinc/98/44/70/1122984470.db2.gz ZXPMVEKSJCOIBI-LBPRGKRZSA-N 1 0 289.810 3.652 20 10 CHCDRO C[C@H]1[C@H](C(F)(F)F)CCC[N@@H+]1Cc1cc(F)ccc1O ZINC000776012508 1123036556 /nfs/dbraw/zinc/03/65/56/1123036556.db2.gz HFNQRRYJXWAIKQ-JOYOIKCWSA-N 1 0 291.288 3.694 20 10 CHCDRO CCC1(C[NH2+]Cc2c(O)cc(C)cc2Cl)CC1 ZINC001200864042 1123062115 /nfs/dbraw/zinc/06/21/15/1123062115.db2.gz PUXABDXEJLFAHK-UHFFFAOYSA-N 1 0 253.773 3.634 20 10 CHCDRO CCO[C@H](CC[NH2+]Cc1ccc2c(c1)CCCO2)C(C)C ZINC001200911948 1123063882 /nfs/dbraw/zinc/06/38/82/1123063882.db2.gz WMZSNBPMRIYRJC-QGZVFWFLSA-N 1 0 291.435 3.552 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H]2CC[C@@H]3CCC[C@@H]3C2)c1O ZINC000776174882 1123101766 /nfs/dbraw/zinc/10/17/66/1123101766.db2.gz IMUAJWNGRJYPNX-SQWLQELKSA-N 1 0 259.393 3.759 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+][C@H]1C[C@H]1Cc1ccccc1 ZINC000776177304 1123102456 /nfs/dbraw/zinc/10/24/56/1123102456.db2.gz MJXVLHXGUCSQCG-CJNGLKHVSA-N 1 0 287.790 3.766 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+][C@H]1C[C@@H]1Cc1ccccc1 ZINC000776177302 1123102493 /nfs/dbraw/zinc/10/24/93/1123102493.db2.gz MJXVLHXGUCSQCG-BBRMVZONSA-N 1 0 287.790 3.766 20 10 CHCDRO c1cc2c(cc1C[NH2+]CC1(C3CC3)CCC1)CCCO2 ZINC001201595402 1123129324 /nfs/dbraw/zinc/12/93/24/1123129324.db2.gz RFDCICRRLGMYON-UHFFFAOYSA-N 1 0 271.404 3.682 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+]CCCC2CC2)c1O ZINC000776208991 1123147061 /nfs/dbraw/zinc/14/70/61/1123147061.db2.gz PWJXGGBIDHHYPG-UHFFFAOYSA-N 1 0 253.773 3.634 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+][C@@H]2CCC(F)(F)C2)c1O ZINC000776251388 1123179397 /nfs/dbraw/zinc/17/93/97/1123179397.db2.gz GSGNJZZWSSFCNU-LLVKDONJSA-N 1 0 275.726 3.631 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H](CO)CCC(C)(C)C)c(Cl)c1 ZINC001202159250 1123180368 /nfs/dbraw/zinc/18/03/68/1123180368.db2.gz SCYUJLQPKGSUEW-LBPRGKRZSA-N 1 0 299.842 3.631 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]CC(C)(C)C(C)(F)F)c1 ZINC000696567195 1123195244 /nfs/dbraw/zinc/19/52/44/1123195244.db2.gz GPAXTNQRLDYVJA-SNVBAGLBSA-N 1 0 287.350 3.733 20 10 CHCDRO CCCN(CCC)c1ccc(C[NH2+][C@@H](CC)[C@H](C)O)cc1 ZINC001202381518 1123204376 /nfs/dbraw/zinc/20/43/76/1123204376.db2.gz OSEMNMLXBJDLHQ-YJBOKZPZSA-N 1 0 292.467 3.562 20 10 CHCDRO CC[C@H](C)[NH2+]Cc1cc(OC)cc(C(C)(C)C)c1O ZINC000850008533 1123237131 /nfs/dbraw/zinc/23/71/31/1123237131.db2.gz VGQGXUYNSAEWKG-NSHDSACASA-N 1 0 265.397 3.586 20 10 CHCDRO COc1cc(C[NH2+][C@@H](C)CSC)c(O)c(C(C)(C)C)c1 ZINC000850145991 1123243979 /nfs/dbraw/zinc/24/39/79/1123243979.db2.gz QUOMKEJYKHBCCM-NSHDSACASA-N 1 0 297.464 3.539 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C[C@@H](C)c2ccccn2)cc1 ZINC000850343084 1123254541 /nfs/dbraw/zinc/25/45/41/1123254541.db2.gz YXOOVWVENQVCKL-MRXNPFEDSA-N 1 0 297.446 3.821 20 10 CHCDRO COc1cc(C[NH2+]CCC(C)(C)F)c(O)c(C(C)(C)C)c1 ZINC000850374040 1123259624 /nfs/dbraw/zinc/25/96/24/1123259624.db2.gz GXWQHDOHUQYRGB-UHFFFAOYSA-N 1 0 297.414 3.926 20 10 CHCDRO Oc1ccc2c(c1)[C@@H]([NH2+]Cc1cc(Cl)ccc1O)CC2 ZINC000850386326 1123261231 /nfs/dbraw/zinc/26/12/31/1123261231.db2.gz HSZSMWGFEIMKAQ-HNNXBMFYSA-N 1 0 289.762 3.528 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+][C@H](C)C2CCC(F)CC2)c1 ZINC000850396380 1123262553 /nfs/dbraw/zinc/26/25/53/1123262553.db2.gz UXARCZPTNNHYPJ-DNOWBOINSA-N 1 0 295.398 3.797 20 10 CHCDRO COc1cccc(C[NH2+]Cc2c(O)cccc2Cl)c1C ZINC000850416172 1123264447 /nfs/dbraw/zinc/26/44/47/1123264447.db2.gz CMZRDBDFMQQCLH-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO COc1cccc(O)c1C[NH2+][C@H]1CCCc2c(C)cccc21 ZINC000850411500 1123264669 /nfs/dbraw/zinc/26/46/69/1123264669.db2.gz CYIRTMNQIHEARQ-KRWDZBQOSA-N 1 0 297.398 3.876 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)C(C)(C)C(F)F ZINC000850422522 1123265482 /nfs/dbraw/zinc/26/54/82/1123265482.db2.gz TTWMFMOGJHADBF-LLVKDONJSA-N 1 0 270.367 3.522 20 10 CHCDRO C[C@H](C[NH2+][C@H](C)c1ccc(N(C)C)cc1)c1ccccn1 ZINC000850481497 1123273087 /nfs/dbraw/zinc/27/30/87/1123273087.db2.gz HJKFRANJFGJNHC-HUUCEWRRSA-N 1 0 283.419 3.602 20 10 CHCDRO CCC(C)(C)[C@H](C)[NH2+][C@H](C)c1cccc(OC)c1O ZINC000850502143 1123275995 /nfs/dbraw/zinc/27/59/95/1123275995.db2.gz MJCXWRHAKJBFPE-NEPJUHHUSA-N 1 0 265.397 3.876 20 10 CHCDRO C[C@@H]([NH2+][C@H]1C=CCC1)c1cc2c(cc1O)CCCC2 ZINC000850507972 1123277319 /nfs/dbraw/zinc/27/73/19/1123277319.db2.gz HEPJOZDISPVNGB-DOMZBBRYSA-N 1 0 257.377 3.640 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@H]1C[C@H](Oc3ccccc3)C1)CC2 ZINC000850530966 1123284807 /nfs/dbraw/zinc/28/48/07/1123284807.db2.gz FVTKLFJUQSAKQN-XIRDDKMYSA-N 1 0 295.382 3.579 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@H]1C[C@H](Oc3ccccc3)C1)CC2 ZINC000850530965 1123285189 /nfs/dbraw/zinc/28/51/89/1123285189.db2.gz FVTKLFJUQSAKQN-DJIMGWMZSA-N 1 0 295.382 3.579 20 10 CHCDRO C[C@@H]([NH2+]C[C@]1(C)CC1(F)F)c1ccc(Cl)cc1O ZINC000850536154 1123286942 /nfs/dbraw/zinc/28/69/42/1123286942.db2.gz HPMWFPDXXMFWGO-PELKAZGASA-N 1 0 275.726 3.742 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@H]2C(C)(C)C2(F)F)c(O)c1 ZINC000850552828 1123289879 /nfs/dbraw/zinc/28/98/79/1123289879.db2.gz QBTWUZDTDQGWNK-YPMHNXCESA-N 1 0 283.362 3.951 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1C(C)(C)C1(F)F)c1ccc(Cl)cc1O ZINC000850553202 1123290029 /nfs/dbraw/zinc/29/00/29/1123290029.db2.gz TZJMQSLDDJEHIC-UFBFGSQYSA-N 1 0 289.753 3.988 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCc2cccc(O)c21)C1CCC(F)CC1 ZINC000850555990 1123290805 /nfs/dbraw/zinc/29/08/05/1123290805.db2.gz QDERRIUOCIIBSI-WZKVNAIUSA-N 1 0 277.383 3.886 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCCc2ccco2)c(O)c1 ZINC000850570308 1123294403 /nfs/dbraw/zinc/29/44/03/1123294403.db2.gz UNLNECXZOQVNOU-CYBMUJFWSA-N 1 0 259.349 3.577 20 10 CHCDRO CO[C@@H](C[NH2+][C@@H]1CCc2cccc(O)c21)C1CCCCC1 ZINC000850569598 1123294498 /nfs/dbraw/zinc/29/44/98/1123294498.db2.gz KADRQYCTMDRBRO-WBVHZDCISA-N 1 0 289.419 3.564 20 10 CHCDRO CC[C@H]([NH2+][C@@H](c1ccccc1)[C@@H](C)O)c1ccccc1O ZINC000850582913 1123296522 /nfs/dbraw/zinc/29/65/22/1123296522.db2.gz HOTIWSBEYJPSRQ-RPVQJOFSSA-N 1 0 285.387 3.555 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@@H](C)C2CCCCCC2)c1 ZINC000149890377 1123366672 /nfs/dbraw/zinc/36/66/72/1123366672.db2.gz XLFUBDAMELRCPF-ZDUSSCGKSA-N 1 0 277.408 3.849 20 10 CHCDRO CCC[N@H+](Cc1cc(C2CC2)no1)Cc1ccccc1O ZINC000851791445 1123380508 /nfs/dbraw/zinc/38/05/08/1123380508.db2.gz AMSSNZLOLBQOQZ-UHFFFAOYSA-N 1 0 286.375 3.670 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H](c3ccccn3)C2)cc1 ZINC000852083360 1123395524 /nfs/dbraw/zinc/39/55/24/1123395524.db2.gz DRDSXBFBCBRQCI-QGZVFWFLSA-N 1 0 295.430 3.527 20 10 CHCDRO CC1(C)C[C@@]1([NH2+]Cc1ccccc1O)c1ccccc1 ZINC000853091738 1123424130 /nfs/dbraw/zinc/42/41/30/1123424130.db2.gz OYSXGDBHXNRZDW-GOSISDBHSA-N 1 0 267.372 3.807 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]CC(C)(C)CC(F)(F)F)c1 ZINC000853096308 1123424239 /nfs/dbraw/zinc/42/42/39/1123424239.db2.gz WUQUYOKEXKUKST-UHFFFAOYSA-N 1 0 275.314 3.769 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCc3cc(N)ccc32)c1 ZINC000854225725 1123477724 /nfs/dbraw/zinc/47/77/24/1123477724.db2.gz JTVKXMWAAJGYNC-YVEFUNNKSA-N 1 0 282.387 3.621 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C(C)(C)[C@H](O)c2ccccc2)cc1C ZINC000895659101 1123502240 /nfs/dbraw/zinc/50/22/40/1123502240.db2.gz SAVSVWWBRLRVSU-GOSISDBHSA-N 1 0 299.414 3.611 20 10 CHCDRO CCN1CCC([NH2+][C@@H](C)c2ccc3ccccc3c2O)CC1 ZINC000273440199 1129125905 /nfs/dbraw/zinc/12/59/05/1129125905.db2.gz YHGWRJCCBPZMBT-AWEZNQCLSA-N 1 0 298.430 3.680 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2cc3ccccc3o2)c1 ZINC000113322774 1123521898 /nfs/dbraw/zinc/52/18/98/1123521898.db2.gz WYKLOMLBAMDNOH-UHFFFAOYSA-N 1 0 267.328 3.737 20 10 CHCDRO Cc1cc(Cl)cc(C[NH+]2C[C@@H](C)C[C@H](C)C2)c1O ZINC001237685196 1129128083 /nfs/dbraw/zinc/12/80/83/1129128083.db2.gz FILWSDHKHHQZEK-QWRGUYRKSA-N 1 0 267.800 3.832 20 10 CHCDRO C[C@@H]1C[NH+](Cc2c(O)ccc3ccccc32)C[C@H]1C ZINC000097987277 1123577258 /nfs/dbraw/zinc/57/72/58/1123577258.db2.gz UILOYEPJVHVSKG-CHWSQXEVSA-N 1 0 255.361 3.633 20 10 CHCDRO CCOc1cccc(C[NH+]2CC(C)(c3ccccc3)C2)c1O ZINC000857058734 1123583345 /nfs/dbraw/zinc/58/33/45/1123583345.db2.gz TUSDEVQQBFDHEG-UHFFFAOYSA-N 1 0 297.398 3.564 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CC[C@H]2CC2(F)F)c(O)c1 ZINC000857081923 1123585806 /nfs/dbraw/zinc/58/58/06/1123585806.db2.gz RKWDCHRBOIBUKJ-RYUDHWBXSA-N 1 0 269.335 3.705 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](c1ccccn1)C1CC1 ZINC000896609393 1123605489 /nfs/dbraw/zinc/60/54/89/1123605489.db2.gz NGTGVISBQXBOKF-IBGZPJMESA-N 1 0 295.430 3.697 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CCO[C@@H](CC(C)C)C2)cc1C ZINC000776949110 1123608828 /nfs/dbraw/zinc/60/88/28/1123608828.db2.gz JYPGFKAZWSTAHR-SJORKVTESA-N 1 0 291.435 3.687 20 10 CHCDRO Cc1ccccc1C[NH2+]Cc1ccc(N(C)C)cc1C ZINC000115629502 1123620399 /nfs/dbraw/zinc/62/03/99/1123620399.db2.gz PYHXPZMLNWJCBW-UHFFFAOYSA-N 1 0 268.404 3.659 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2ccc(OCC3CC3)cc2)c1 ZINC000858239450 1123639086 /nfs/dbraw/zinc/63/90/86/1123639086.db2.gz NTCDOEXXDIKAFK-UHFFFAOYSA-N 1 0 297.398 3.779 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2ccc(Cl)cc2C)c1 ZINC000858239651 1123639384 /nfs/dbraw/zinc/63/93/84/1123639384.db2.gz RPVGWKUFNUSGOX-UHFFFAOYSA-N 1 0 275.779 3.952 20 10 CHCDRO FC(F)(F)C1(C[NH2+]Cc2ccc3c(c2)CCO3)CCCC1 ZINC000858307660 1123642651 /nfs/dbraw/zinc/64/26/51/1123642651.db2.gz KXTJYDZEXLUEDZ-UHFFFAOYSA-N 1 0 299.336 3.834 20 10 CHCDRO CCC[C@H](C[NH2+][C@@H](C)c1c(C)cc(C)cc1O)OCC ZINC000858450481 1123655371 /nfs/dbraw/zinc/65/53/71/1123655371.db2.gz DONXQFQLHMZNGL-LSDHHAIUSA-N 1 0 279.424 3.865 20 10 CHCDRO CC[C@@H]([NH2+][C@H](CO)CCC(C)C)c1ccc(C)cc1O ZINC000858486631 1123657808 /nfs/dbraw/zinc/65/78/08/1123657808.db2.gz XSCFBRHRYDUKDG-GOEBONIOSA-N 1 0 279.424 3.538 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CC[C@@H]2CC=CCC2)c1O ZINC000858515215 1123659503 /nfs/dbraw/zinc/65/95/03/1123659503.db2.gz FKJWJAATZPCPTA-ZIAGYGMSSA-N 1 0 275.392 3.798 20 10 CHCDRO CC[C@H]([NH2+]Cc1cccnc1C)c1ccc(N(C)C)cc1 ZINC000858518513 1123659625 /nfs/dbraw/zinc/65/96/25/1123659625.db2.gz ISRWVWRSXAONHC-SFHVURJKSA-N 1 0 283.419 3.697 20 10 CHCDRO C/C=C/C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000858538407 1123660733 /nfs/dbraw/zinc/66/07/33/1123660733.db2.gz WADSLIYJIOBIBC-BWPKMQGJSA-N 1 0 258.409 3.904 20 10 CHCDRO C/C=C\C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000858538410 1123660745 /nfs/dbraw/zinc/66/07/45/1123660745.db2.gz WADSLIYJIOBIBC-JZIMQPMSSA-N 1 0 258.409 3.904 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2CO[C@@H](C3CC3)C2)c1O ZINC000858548246 1123661668 /nfs/dbraw/zinc/66/16/68/1123661668.db2.gz RPODEDAHAXRXIK-PSOPSSQASA-N 1 0 295.810 3.572 20 10 CHCDRO C[C@H]([NH2+]CCCSc1nccs1)C1CC(F)(F)C1 ZINC000862281917 1123798097 /nfs/dbraw/zinc/79/80/97/1123798097.db2.gz ZEJHBNQBMGUZQP-VIFPVBQESA-N 1 0 292.420 3.649 20 10 CHCDRO COCCC1CC[NH+](Cc2cc(Cl)c(C)cc2O)CC1 ZINC000862437922 1123810320 /nfs/dbraw/zinc/81/03/20/1123810320.db2.gz VQTCOOLJYKGJGT-UHFFFAOYSA-N 1 0 297.826 3.603 20 10 CHCDRO COC[C@@H](CC(C)C)[NH2+]Cc1c(C)c2ccccc2n1C ZINC000475189087 1123812143 /nfs/dbraw/zinc/81/21/43/1123812143.db2.gz DOSCQRUJAUYIDT-OAHLLOKOSA-N 1 0 288.435 3.637 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H](C)CCc2ccsc2)c1 ZINC000862475910 1123812963 /nfs/dbraw/zinc/81/29/63/1123812963.db2.gz BKTDQIJNLDJFDX-CYBMUJFWSA-N 1 0 275.417 3.873 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)c1ccccc1O)c1ccc2c(c1)OCCO2 ZINC000192785099 1123816001 /nfs/dbraw/zinc/81/60/01/1123816001.db2.gz FXYLHWFVTGJULA-CHWSQXEVSA-N 1 0 299.370 3.575 20 10 CHCDRO C[C@H]1CC2(CCC2)C[N@@H+]1Cc1ccc(N(C)C)cc1 ZINC000763645020 1129148680 /nfs/dbraw/zinc/14/86/80/1129148680.db2.gz DDXOEBBDALWQIF-AWEZNQCLSA-N 1 0 258.409 3.517 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]Cc1cc(F)ccc1F ZINC000083552488 1129150667 /nfs/dbraw/zinc/15/06/67/1129150667.db2.gz UQOAOWFOCIIELR-UHFFFAOYSA-N 1 0 283.705 3.614 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)Cc1ccco1)c1ccc(C)cc1O ZINC000794794009 1123951263 /nfs/dbraw/zinc/95/12/63/1123951263.db2.gz PBGKSXXZNDQTMW-CZUORRHYSA-N 1 0 273.376 3.966 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](O)c1ccccc1C)c1ccc(C)cc1O ZINC000794806397 1123955403 /nfs/dbraw/zinc/95/54/03/1123955403.db2.gz IGRZQFFERPBBPV-PKOBYXMFSA-N 1 0 299.414 3.783 20 10 CHCDRO CC[C@H]([NH2+]C1CCC(O)(CC)CC1)c1ccc(C)cc1O ZINC000794810398 1123955554 /nfs/dbraw/zinc/95/55/54/1123955554.db2.gz KZQGYVUANVVMPG-HQVVEAJESA-N 1 0 291.435 3.825 20 10 CHCDRO CC[C@@H]([NH2+][C@H](CO)C1CCCCC1)c1ccc(C)cc1O ZINC000794818358 1123960076 /nfs/dbraw/zinc/96/00/76/1123960076.db2.gz SFUXXTVCLZSCKF-IAGOWNOFSA-N 1 0 291.435 3.683 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)[C@H]1CCCOC1)c1ccc(C)cc1O ZINC000794818124 1123960477 /nfs/dbraw/zinc/96/04/77/1123960477.db2.gz QIKPQIFIZLRKFO-DZKIICNBSA-N 1 0 277.408 3.556 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C2CCC(OC(C)(C)C)CC2)c1 ZINC000865697990 1124006133 /nfs/dbraw/zinc/00/61/33/1124006133.db2.gz FTGPWNNCSAEPQU-UHFFFAOYSA-N 1 0 291.435 3.917 20 10 CHCDRO Cc1ncc([C@@H](C)[NH2+]Cc2cc(C)c(C)cc2O)s1 ZINC000865701147 1124006796 /nfs/dbraw/zinc/00/67/96/1124006796.db2.gz HMVHJPNRJHJPAE-LLVKDONJSA-N 1 0 276.405 3.625 20 10 CHCDRO Cc1cc(C[NH2+]CCCSc2nccs2)c(C)o1 ZINC000120785239 1124023880 /nfs/dbraw/zinc/02/38/80/1124023880.db2.gz SYTXWEMWVMEBBN-UHFFFAOYSA-N 1 0 282.434 3.625 20 10 CHCDRO C[C@@H]1C[C@@H]([NH2+]CC[C@H]2CCSC2)c2c1c(F)ccc2O ZINC000866402379 1124063188 /nfs/dbraw/zinc/06/31/88/1124063188.db2.gz JQWUGAGBTGJQLZ-NTZNESFSSA-N 1 0 295.423 3.812 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]Cc2csc(C)c2C)c1O ZINC000866428762 1124065200 /nfs/dbraw/zinc/06/52/00/1124065200.db2.gz GARQRYRENLMQNX-NSHDSACASA-N 1 0 291.416 3.930 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+]Cc2ccnc(F)c2)c1O ZINC000866473820 1124069762 /nfs/dbraw/zinc/06/97/62/1124069762.db2.gz HZAQQHBTKNTFQR-JTQLQIEISA-N 1 0 294.757 3.739 20 10 CHCDRO CS[C@H]1C[C@H]([NH2+][C@@H](C)c2c(C)cc(C)cc2O)C1 ZINC000866488324 1124072854 /nfs/dbraw/zinc/07/28/54/1124072854.db2.gz MZTGXCBPAXYEQZ-AVGNSLFASA-N 1 0 265.422 3.554 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1C[C@H]1C(F)(F)F)c1ccc(Cl)cc1O ZINC000866499084 1124073251 /nfs/dbraw/zinc/07/32/51/1124073251.db2.gz FESCQKLXJXEPPK-BDODKLCJSA-N 1 0 279.689 3.647 20 10 CHCDRO C[C@H]1C[C@H]([NH2+][C@@H]2C[C@H]2C(F)(F)F)c2c1c(F)ccc2O ZINC000866499023 1124073478 /nfs/dbraw/zinc/07/34/78/1124073478.db2.gz CWQBXKAJGJTLPP-WDQPUEAGSA-N 1 0 289.272 3.620 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C1CCC1)[C@H]1CCOC1)c1ccccc1O ZINC000866512727 1124076141 /nfs/dbraw/zinc/07/61/41/1124076141.db2.gz OFPWGMPISYGPNY-ZVZYQTTQSA-N 1 0 289.419 3.638 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](C2CCC2)[C@H]2CCOC2)c(O)c1 ZINC000866513012 1124076222 /nfs/dbraw/zinc/07/62/22/1124076222.db2.gz RADDFZCHHPJQLN-YEWWUXTCSA-N 1 0 289.419 3.556 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC23CCOCC3)c(O)c1 ZINC000866529658 1124078720 /nfs/dbraw/zinc/07/87/20/1124078720.db2.gz RJXDFCMBXDFFCP-CABCVRRESA-N 1 0 289.419 3.558 20 10 CHCDRO COc1ccc2ccc(O)c(C[N@H+](C(C)C)C3CC3)c2c1 ZINC000029539665 1124086830 /nfs/dbraw/zinc/08/68/30/1124086830.db2.gz PTVUKGBWPROTHW-UHFFFAOYSA-N 1 0 285.387 3.927 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCc2cccc(O)c21)c1cc2cnccc2o1 ZINC000866618868 1124090622 /nfs/dbraw/zinc/09/06/22/1124090622.db2.gz BKFIQPILHONUHI-RISCZKNCSA-N 1 0 294.354 3.872 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C2([C@H]3CCCCO3)CCC2)c1 ZINC000866623400 1124091180 /nfs/dbraw/zinc/09/11/80/1124091180.db2.gz QLZPFCWRCXSVPA-RHSMWYFYSA-N 1 0 289.419 3.843 20 10 CHCDRO CSC1CC[NH+](Cc2ccc(N3CCCC3)cc2)CC1 ZINC001119304512 1131250178 /nfs/dbraw/zinc/25/01/78/1131250178.db2.gz UWTCCKJLFQGBGC-UHFFFAOYSA-N 1 0 290.476 3.614 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCc2ccccc21 ZINC000122684614 1124524253 /nfs/dbraw/zinc/52/42/53/1124524253.db2.gz LMENESMZUOCHIY-IBGZPJMESA-N 1 0 280.415 3.838 20 10 CHCDRO CC(=O)C1CC[NH+](Cc2cc(C(C)C)c(C)cc2O)CC1 ZINC000872798605 1124730692 /nfs/dbraw/zinc/73/06/92/1124730692.db2.gz PAFHFYYVDPBMQV-UHFFFAOYSA-N 1 0 289.419 3.625 20 10 CHCDRO CCCOc1ccc(C[NH2+]Cc2cccnc2C)cc1C ZINC000873145160 1124741745 /nfs/dbraw/zinc/74/17/45/1124741745.db2.gz ZRPXNRLNQCAQDY-UHFFFAOYSA-N 1 0 284.403 3.777 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccccc1)c1ccccc1O ZINC000019919943 1124770011 /nfs/dbraw/zinc/77/00/11/1124770011.db2.gz OVTQFZICDDDVKP-MRXNPFEDSA-N 1 0 255.361 3.676 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccccc1F)c1ccccc1O ZINC000019912775 1124770893 /nfs/dbraw/zinc/77/08/93/1124770893.db2.gz LMTNVQZBKCQOFA-MRXNPFEDSA-N 1 0 273.351 3.815 20 10 CHCDRO CCN(CC)CC[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000019919344 1124770970 /nfs/dbraw/zinc/77/09/70/1124770970.db2.gz ZYRQKMKGLNSUSU-AWEZNQCLSA-N 1 0 286.419 3.538 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]CCC2=CCCCC2)c1 ZINC000020093706 1124805003 /nfs/dbraw/zinc/80/50/03/1124805003.db2.gz UJXIEZZLHCAQOB-CYBMUJFWSA-N 1 0 275.392 3.942 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCc2ccccc2F)c(O)c1 ZINC000020088797 1124805787 /nfs/dbraw/zinc/80/57/87/1124805787.db2.gz SPJMPBMDTWKRNC-ZDUSSCGKSA-N 1 0 273.351 3.733 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H](C)CCC(C)C)c1O ZINC000020122908 1124807241 /nfs/dbraw/zinc/80/72/41/1124807241.db2.gz ZQHOKDOTQSOTBH-ZDUSSCGKSA-N 1 0 265.397 3.705 20 10 CHCDRO CO[C@]1(C)CCC[N@H+](Cc2cc(Cl)c(C)cc2O)CC1 ZINC000825748476 1124854808 /nfs/dbraw/zinc/85/48/08/1124854808.db2.gz CDYHTHQGDISBDB-MRXNPFEDSA-N 1 0 297.826 3.745 20 10 CHCDRO CCC(CC)[C@H](C[NH2+][C@H](CC)c1ccccc1O)N(C)C ZINC000021036377 1124892219 /nfs/dbraw/zinc/89/22/19/1124892219.db2.gz WHNCVMAIPKREHR-SJORKVTESA-N 1 0 292.467 3.799 20 10 CHCDRO CCCC[C@H](CC)C[NH2+]Cc1cccc(OC)c1O ZINC000021505381 1124929006 /nfs/dbraw/zinc/92/90/06/1124929006.db2.gz MXISXRWYWYNVCG-ZDUSSCGKSA-N 1 0 265.397 3.707 20 10 CHCDRO Cc1ccc(C[N@@H+](C)[C@H](C)c2cccs2)c(O)c1 ZINC000876589789 1124963245 /nfs/dbraw/zinc/96/32/45/1124963245.db2.gz OUMCMDIQHBKZJY-GFCCVEGCSA-N 1 0 261.390 3.955 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccc(N(C)C)cc1 ZINC000126056905 1124965001 /nfs/dbraw/zinc/96/50/01/1124965001.db2.gz GVCHSTWKQJWYAW-CYBMUJFWSA-N 1 0 299.374 3.512 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCCc2ccccc2)c(O)c1 ZINC000021813600 1124972666 /nfs/dbraw/zinc/97/26/66/1124972666.db2.gz VBFVDMWHNFCUEH-HNNXBMFYSA-N 1 0 269.388 3.984 20 10 CHCDRO COc1ccccc1[C@@H](C)[NH2+]Cc1ccc(C)cc1O ZINC000876883122 1124986808 /nfs/dbraw/zinc/98/68/08/1124986808.db2.gz ZUPJFRQUOPUDEK-CYBMUJFWSA-N 1 0 271.360 3.560 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2ccc(OC(C)C)cc2)c(O)c1 ZINC000876925669 1124990146 /nfs/dbraw/zinc/99/01/46/1124990146.db2.gz BLNDKXGXIFKFEI-UHFFFAOYSA-N 1 0 285.387 3.778 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2cccc(OC(C)C)c2)c(O)c1 ZINC000876944947 1124991652 /nfs/dbraw/zinc/99/16/52/1124991652.db2.gz VZLRXNCEDXEPCK-UHFFFAOYSA-N 1 0 285.387 3.778 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(C)cc1O)c1ccccc1 ZINC000876989460 1124995112 /nfs/dbraw/zinc/99/51/12/1124995112.db2.gz ZSJXZABVXYEULM-MRXNPFEDSA-N 1 0 255.361 3.942 20 10 CHCDRO CCOc1cccc([C@@H](C)[NH2+]Cc2ccc(C)cc2O)c1 ZINC000876990713 1124995547 /nfs/dbraw/zinc/99/55/47/1124995547.db2.gz AOMJNNFHFRLHSG-CQSZACIVSA-N 1 0 285.387 3.950 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H]2CCc3cccc(F)c3C2)cc1 ZINC001170961596 1131323955 /nfs/dbraw/zinc/32/39/55/1131323955.db2.gz QCCSVLJJFSVMFM-INIZCTEOSA-N 1 0 298.405 3.539 20 10 CHCDRO Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(C)cc1O)CC2 ZINC000877015356 1124998732 /nfs/dbraw/zinc/99/87/32/1124998732.db2.gz MZXWAVNRAQSBDO-QGZVFWFLSA-N 1 0 267.372 3.786 20 10 CHCDRO CCc1cccc2c1OCC[C@H]2[NH2+]Cc1ccc(C)cc1O ZINC000877023144 1124999730 /nfs/dbraw/zinc/99/97/30/1124999730.db2.gz FXNVBCTVXXLCML-QGZVFWFLSA-N 1 0 297.398 3.876 20 10 CHCDRO CC[C@@H]([NH2+]Cc1c(C)cccc1O)c1nc(C)cs1 ZINC000877025221 1125000036 /nfs/dbraw/zinc/00/00/36/1125000036.db2.gz DEAIIXMHBGAXBT-CYBMUJFWSA-N 1 0 276.405 3.706 20 10 CHCDRO CCc1ccccc1C[NH2+]Cc1ccc(C)cc1O ZINC000877059704 1125003794 /nfs/dbraw/zinc/00/37/94/1125003794.db2.gz PRYYZVMBVPAWCD-UHFFFAOYSA-N 1 0 255.361 3.553 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]C1CCC(OC(C)C)CC1 ZINC000877114681 1125010708 /nfs/dbraw/zinc/01/07/08/1125010708.db2.gz XVAFLSATFBAUSN-UHFFFAOYSA-N 1 0 277.408 3.526 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H]2[C@@H]3Cc4cc(Cl)ccc4[C@@H]32)c1O ZINC000529644404 1125028043 /nfs/dbraw/zinc/02/80/43/1125028043.db2.gz YUCJAKCREDWJHD-IXDOHACOSA-N 1 0 299.801 3.782 20 10 CHCDRO Cc1ccc(C[NH2+]C[C@@H]2CCCC(F)(F)C2)c(O)c1 ZINC000877498853 1125036445 /nfs/dbraw/zinc/03/64/45/1125036445.db2.gz VTHGKWCNIUJVCC-GFCCVEGCSA-N 1 0 269.335 3.616 20 10 CHCDRO COc1cccc(C[NH2+]Cc2cccc(Cl)c2C)c1O ZINC000877525485 1125038128 /nfs/dbraw/zinc/03/81/28/1125038128.db2.gz FEJRJUNJCHGXKT-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+][C@H]1CCc2cc(Cl)ccc21 ZINC000529666234 1125039044 /nfs/dbraw/zinc/03/90/44/1125039044.db2.gz SHKHBMNZKFXURG-HNNXBMFYSA-N 1 0 291.753 3.962 20 10 CHCDRO CC[N@H+](Cc1ccc(C)cc1O)[C@H](C)c1cccnc1 ZINC000877532191 1125040252 /nfs/dbraw/zinc/04/02/52/1125040252.db2.gz SUECZHVKRJBVCS-CQSZACIVSA-N 1 0 270.376 3.679 20 10 CHCDRO C[C@H](CCc1cccnc1)[NH2+]Cc1cc(Cl)ccc1O ZINC000877612699 1125054295 /nfs/dbraw/zinc/05/42/95/1125054295.db2.gz MJXXRYKDPPKSEG-GFCCVEGCSA-N 1 0 290.794 3.552 20 10 CHCDRO CO[C@@H](c1ccccc1)[C@@H](C)[NH2+]Cc1cc(C)ccc1O ZINC000877652329 1125057113 /nfs/dbraw/zinc/05/71/13/1125057113.db2.gz GLCMQPHYJMOYFA-RDTXWAMCSA-N 1 0 285.387 3.566 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)c2ccc3c(c2)CCCO3)c(O)c1 ZINC000877644139 1125058450 /nfs/dbraw/zinc/05/84/50/1125058450.db2.gz RGWAHBUGJVUKDA-AWEZNQCLSA-N 1 0 297.398 3.876 20 10 CHCDRO Cc1cc(C[NH2+][C@H](C)c2ccccc2O)cnc1Cl ZINC000877756485 1125071652 /nfs/dbraw/zinc/07/16/52/1125071652.db2.gz LWRXEIFXVRVBAI-LLVKDONJSA-N 1 0 276.767 3.600 20 10 CHCDRO CC(C)(O)C1CC[NH+](Cc2ccc3ccccc3c2O)CC1 ZINC000877751463 1125071668 /nfs/dbraw/zinc/07/16/68/1125071668.db2.gz BCCVHHGTMQOELD-UHFFFAOYSA-N 1 0 299.414 3.528 20 10 CHCDRO C[C@@H]([NH2+]Cc1cccc2c1OC(C)(C)C2)c1ccccc1O ZINC000877756267 1125071878 /nfs/dbraw/zinc/07/18/78/1125071878.db2.gz DDXRZASDEBICIB-CYBMUJFWSA-N 1 0 297.398 3.957 20 10 CHCDRO CCOc1cccc(F)c1C[NH2+][C@@H](C)c1ccccc1O ZINC000877758364 1125074361 /nfs/dbraw/zinc/07/43/61/1125074361.db2.gz WBTZNIWNBFBLME-LBPRGKRZSA-N 1 0 289.350 3.781 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000127366646 1125089090 /nfs/dbraw/zinc/08/90/90/1125089090.db2.gz DWOKBXJRZUDSGC-AWEZNQCLSA-N 1 0 276.767 3.711 20 10 CHCDRO C[C@H]([NH2+]Cc1cncc(C(F)(F)F)c1)c1ccccc1O ZINC000879650562 1125223922 /nfs/dbraw/zinc/22/39/22/1125223922.db2.gz HIUCRHTXFRVGPL-JTQLQIEISA-N 1 0 296.292 3.657 20 10 CHCDRO Cc1cc(Br)cc(C[NH2+][C@H]2CC[C@H](C)C2)c1O ZINC000783710101 1125285786 /nfs/dbraw/zinc/28/57/86/1125285786.db2.gz JNSWVPRREQEBDK-ZANVPECISA-N 1 0 298.224 3.741 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](C2CC2)C2CCCC2)c1 ZINC000130225448 1125358559 /nfs/dbraw/zinc/35/85/59/1125358559.db2.gz JNJKLIBQFNKTTC-UHFFFAOYSA-N 1 0 275.392 3.698 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(SC)o2)c1 ZINC000883156407 1125374339 /nfs/dbraw/zinc/37/43/39/1125374339.db2.gz NIPOUJXIVVBDEY-JTQLQIEISA-N 1 0 293.388 3.567 20 10 CHCDRO CCOc1cccc(C[NH2+]CC(C)(C)CC(F)F)c1O ZINC000883252239 1125385358 /nfs/dbraw/zinc/38/53/58/1125385358.db2.gz ZPTDLJMCLZYKFH-UHFFFAOYSA-N 1 0 287.350 3.562 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]CC[C@H]2CCCC2(F)F)c1 ZINC000883266398 1125388812 /nfs/dbraw/zinc/38/88/12/1125388812.db2.gz ZHQFNDNVXDELRL-CYBMUJFWSA-N 1 0 269.335 3.616 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCC2(CCC2)O1)c1ccc(C)cc1O ZINC000883357023 1125401270 /nfs/dbraw/zinc/40/12/70/1125401270.db2.gz BBTOBHYITRFXDW-HOCLYGCPSA-N 1 0 289.419 3.843 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCC[C@]12CCCO2)c1ccccc1O ZINC000883365664 1125402021 /nfs/dbraw/zinc/40/20/21/1125402021.db2.gz FBWFJNJUHYQAKJ-UAGQMJEPSA-N 1 0 275.392 3.535 20 10 CHCDRO C[C@@H]([NH2+]C1CCC2(COC2)CC1)c1cc(Cl)ccc1O ZINC000883382047 1125406793 /nfs/dbraw/zinc/40/67/93/1125406793.db2.gz YUCSYQLPFQTVAR-LLVKDONJSA-N 1 0 295.810 3.655 20 10 CHCDRO C[C@H](C[NH2+]Cc1ccc(N2CCCCC2)cc1)C1CC1 ZINC000133042459 1125430832 /nfs/dbraw/zinc/43/08/32/1125430832.db2.gz PUWOZMHUQZFWCG-OAHLLOKOSA-N 1 0 272.436 3.813 20 10 CHCDRO Cc1cc(C[N@H+]2CCCC[C@H](C)C2)ccc1N(C)C ZINC001139670015 1131357462 /nfs/dbraw/zinc/35/74/62/1131357462.db2.gz VJMMVYGTRPCZQI-AWEZNQCLSA-N 1 0 260.425 3.683 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000245617718 1129214662 /nfs/dbraw/zinc/21/46/62/1129214662.db2.gz VVKPXSJVEABDOY-IVSAIRAKSA-N 1 0 290.451 3.749 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCS[C@@H]3CCCC[C@H]32)c1O ZINC000245638998 1129215594 /nfs/dbraw/zinc/21/55/94/1129215594.db2.gz CXDJOSOZUFFGEP-HUUCEWRRSA-N 1 0 277.433 3.561 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]Cc1ccc(F)c(Cl)c1)CC2 ZINC000297495677 1129225006 /nfs/dbraw/zinc/22/50/06/1129225006.db2.gz BRMFTWYFEPIEQP-CQSZACIVSA-N 1 0 291.753 3.962 20 10 CHCDRO CC(C)OCCC[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000184863482 1129258622 /nfs/dbraw/zinc/25/86/22/1129258622.db2.gz WLYDBWKYIWXZIT-AWEZNQCLSA-N 1 0 291.435 3.737 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)c1ccccc1F)c1ccccc1O ZINC000037763986 1129266598 /nfs/dbraw/zinc/26/65/98/1129266598.db2.gz UFCAIHTZFSGTDN-RYUDHWBXSA-N 1 0 259.324 3.943 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccccc1O)c1c(F)cccc1F ZINC000037771752 1129267530 /nfs/dbraw/zinc/26/75/30/1129267530.db2.gz KMIIVAJHLRGZAO-SNVBAGLBSA-N 1 0 263.287 3.521 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CCCC12CCOCC2)c1ccccc1O ZINC000282683822 1129276500 /nfs/dbraw/zinc/27/65/00/1129276500.db2.gz JVGGAMMVGBTEAE-WBVHZDCISA-N 1 0 289.419 3.782 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2coc3ccccc23)c1 ZINC000734004043 1129290711 /nfs/dbraw/zinc/29/07/11/1129290711.db2.gz JLGMVGQARAUVJE-UHFFFAOYSA-N 1 0 267.328 3.737 20 10 CHCDRO CCOc1ccc(C[NH2+]C[C@@H](C)C(C)(C)C)c(O)c1 ZINC000734509970 1129310475 /nfs/dbraw/zinc/31/04/75/1129310475.db2.gz PLFGIFUSTDONOJ-GFCCVEGCSA-N 1 0 265.397 3.563 20 10 CHCDRO Cc1ccc(CC[NH2+]Cc2ccc(N(C)C)c(F)c2)cc1 ZINC000734847943 1129324164 /nfs/dbraw/zinc/32/41/64/1129324164.db2.gz ZCDITNHDBZGEPE-UHFFFAOYSA-N 1 0 286.394 3.532 20 10 CHCDRO COc1cc(C)cc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)c1 ZINC000090723907 1129326022 /nfs/dbraw/zinc/32/60/22/1129326022.db2.gz XZTASWLDGKGQFH-HNNXBMFYSA-N 1 0 298.430 3.920 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](C)SC)c1ccc(N(C)C)cc1 ZINC000090725666 1129326319 /nfs/dbraw/zinc/32/63/19/1129326319.db2.gz RKWTWTWVWBGHLY-DOMZBBRYSA-N 1 0 266.454 3.545 20 10 CHCDRO CCc1ccc(C[N@H+](C)Cc2ccccc2O)cc1 ZINC000735309560 1129340517 /nfs/dbraw/zinc/34/05/17/1129340517.db2.gz OWUGBOIDJWEAEI-UHFFFAOYSA-N 1 0 255.361 3.587 20 10 CHCDRO Cc1csc(C[NH2+][C@H](C)c2cc(C)ccc2O)c1 ZINC000379295548 1129358740 /nfs/dbraw/zinc/35/87/40/1129358740.db2.gz XDYGTJDCCFLSAG-GFCCVEGCSA-N 1 0 261.390 3.921 20 10 CHCDRO CCC[C@](C)(CO)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000735926151 1129361394 /nfs/dbraw/zinc/36/13/94/1129361394.db2.gz KIQBZYKBQURZTL-LJQANCHMSA-N 1 0 299.414 3.700 20 10 CHCDRO Cc1cccc(C[N@H+](C)Cc2ccccc2O)c1C ZINC000091956747 1129376083 /nfs/dbraw/zinc/37/60/83/1129376083.db2.gz DCJURIHXIDZLBL-UHFFFAOYSA-N 1 0 255.361 3.641 20 10 CHCDRO Cc1ccc2oc(C[NH2+]Cc3ccccc3O)cc2c1 ZINC000740003918 1129408822 /nfs/dbraw/zinc/40/88/22/1129408822.db2.gz BUPDNHAODGCOJU-UHFFFAOYSA-N 1 0 267.328 3.737 20 10 CHCDRO CCO[C@@H]1C[C@@H]([NH2+][C@H](C)c2cc(C)ccc2O)C12CCC2 ZINC000248498177 1129420112 /nfs/dbraw/zinc/42/01/12/1129420112.db2.gz MEUYGPXPIFYTHH-KBRIMQKVSA-N 1 0 289.419 3.699 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](C)[C@H](C)Cc2ccc(O)cc2)cc1C ZINC000093324683 1129421010 /nfs/dbraw/zinc/42/10/10/1129421010.db2.gz LMYQKRKXEJPWBG-OAHLLOKOSA-N 1 0 299.414 3.778 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2CC[C@H](C)CC2)c1 ZINC000248530473 1129421566 /nfs/dbraw/zinc/42/15/66/1129421566.db2.gz XJJCAWAQCAYHIZ-AVGNSLFASA-N 1 0 263.381 3.630 20 10 CHCDRO CCc1ccccc1C[NH2+][C@H](C)c1cc(F)ccc1O ZINC000094618344 1129448310 /nfs/dbraw/zinc/44/83/10/1129448310.db2.gz ANNOSXGUAUVZOT-GFCCVEGCSA-N 1 0 273.351 3.945 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)c2cc(F)ccc2O)cc1 ZINC000094616762 1129448334 /nfs/dbraw/zinc/44/83/34/1129448334.db2.gz KVABRNCJWNJYGX-GFCCVEGCSA-N 1 0 259.324 3.691 20 10 CHCDRO Oc1ccccc1C[N@H+](CCOCC1CC1)C1CCCC1 ZINC000741786151 1129452694 /nfs/dbraw/zinc/45/26/94/1129452694.db2.gz WUMKLHHPJHIKEU-UHFFFAOYSA-N 1 0 289.419 3.563 20 10 CHCDRO CC(C)[C@@H](CCO)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000742381252 1129473284 /nfs/dbraw/zinc/47/32/84/1129473284.db2.gz UKVDHQLSVJWOTH-GOSISDBHSA-N 1 0 299.414 3.556 20 10 CHCDRO CCOc1ccc(C[NH2+]C(CC)(CC)CC)c(O)c1 ZINC000742373409 1129475566 /nfs/dbraw/zinc/47/55/66/1129475566.db2.gz BQTSKOUFRFPFSM-UHFFFAOYSA-N 1 0 265.397 3.849 20 10 CHCDRO COc1ccc(C[NH2+][C@H]2C[C@H](C)C[C@H](C)C2)cc1C ZINC000250875930 1129501116 /nfs/dbraw/zinc/50/11/16/1129501116.db2.gz KEVOMAXYHATEMW-VIKVFOODSA-N 1 0 261.409 3.918 20 10 CHCDRO CCC[C@H]1[C@@H](C)CCC[N@@H+]1Cc1cc2c(cc1O)OCO2 ZINC000743380215 1129522561 /nfs/dbraw/zinc/52/25/61/1129522561.db2.gz WJAVUZYXYLVFLB-JSGCOSHPSA-N 1 0 291.391 3.522 20 10 CHCDRO CN(C)c1ccc(C[N@H+](CC2CCC2)C2CC2)cc1 ZINC000743840948 1129537483 /nfs/dbraw/zinc/53/74/83/1129537483.db2.gz APDYOBCKUNHFCO-UHFFFAOYSA-N 1 0 258.409 3.517 20 10 CHCDRO CN(C)c1ccc(C[N@H+](CCC2CC2)C2CC2)cc1 ZINC000743841120 1129537615 /nfs/dbraw/zinc/53/76/15/1129537615.db2.gz FIZDDBOGLBIXKQ-UHFFFAOYSA-N 1 0 258.409 3.517 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)CC2CCC2)cc1 ZINC000743839555 1129539162 /nfs/dbraw/zinc/53/91/62/1129539162.db2.gz KITQMEUDANKFPR-UHFFFAOYSA-N 1 0 260.425 3.765 20 10 CHCDRO CC[N@H+](CC=C(C)C)Cc1cc(Br)ccc1O ZINC000743870886 1129541835 /nfs/dbraw/zinc/54/18/35/1129541835.db2.gz FTPXBMWDAWOQHA-UHFFFAOYSA-N 1 0 298.224 3.943 20 10 CHCDRO Oc1ccccc1C[N@H+](CCC1CC1)Cc1ccco1 ZINC000744398720 1129575511 /nfs/dbraw/zinc/57/55/11/1129575511.db2.gz YLPMUOAFCGQAIZ-UHFFFAOYSA-N 1 0 271.360 3.788 20 10 CHCDRO CC[C@@H]1C[N@H+](Cc2c(O)ccc3ccccc32)C[C@@H](C)O1 ZINC000252442488 1129576494 /nfs/dbraw/zinc/57/64/94/1129576494.db2.gz ACNKTYNDCMHGMV-UKRRQHHQSA-N 1 0 285.387 3.545 20 10 CHCDRO CC(C)O[C@@H]1C[C@@H]([NH2+][C@H](C)c2ccccc2O)C1(C)C ZINC000766331755 1129604656 /nfs/dbraw/zinc/60/46/56/1129604656.db2.gz UKWXERANPLTFBU-DAXOMENPSA-N 1 0 277.408 3.635 20 10 CHCDRO CC[C@H](C[C@H](C)CO)[NH2+][C@H](CC)c1ccc(N(C)C)cc1 ZINC000766360157 1129659011 /nfs/dbraw/zinc/65/90/11/1129659011.db2.gz JARQZCPJJWGHTJ-YXJHDRRASA-N 1 0 292.467 3.590 20 10 CHCDRO CCSCCC[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000305690541 1129659276 /nfs/dbraw/zinc/65/92/76/1129659276.db2.gz DZSUZDHKEBGRFB-CYBMUJFWSA-N 1 0 266.454 3.546 20 10 CHCDRO CC[C@H](C[C@H](C)CO)[NH2+][C@H](C)c1ccc(N(C)CC)cc1 ZINC000766361413 1129659891 /nfs/dbraw/zinc/65/98/91/1129659891.db2.gz VQBBGWIOFZKTFP-ZMSDIMECSA-N 1 0 292.467 3.590 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](C)c1ccncc1)c1ccc(N(C)C)cc1 ZINC000766487767 1129669617 /nfs/dbraw/zinc/66/96/17/1129669617.db2.gz KDTPGLNDDNOZMD-KXBFYZLASA-N 1 0 297.446 3.992 20 10 CHCDRO CC(C)C[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(O)cc1O ZINC001169059529 1129693642 /nfs/dbraw/zinc/69/36/42/1129693642.db2.gz RDCXOMRZBBJZTP-KRWDZBQOSA-N 1 0 299.414 3.845 20 10 CHCDRO CCCC[N@@H+](Cc1ccccc1O)C[C@H](O)CCC(C)C ZINC001169754356 1129754055 /nfs/dbraw/zinc/75/40/55/1129754055.db2.gz LIGMCWXVASDFKG-QGZVFWFLSA-N 1 0 293.451 3.791 20 10 CHCDRO C[C@@H]1CC[C@@H]1[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000796527137 1129773424 /nfs/dbraw/zinc/77/34/24/1129773424.db2.gz VSHYILBHYFRIOR-YGRLFVJLSA-N 1 0 286.341 3.660 20 10 CHCDRO C[C@H]1CC[C@@H]1[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000796527111 1129774888 /nfs/dbraw/zinc/77/48/88/1129774888.db2.gz VSHYILBHYFRIOR-HZMBPMFUSA-N 1 0 286.341 3.660 20 10 CHCDRO CCc1cccc(C[NH2+]Cc2cccc(Cl)c2)c1O ZINC000691442317 1129788290 /nfs/dbraw/zinc/78/82/90/1129788290.db2.gz BFDOWSNEUYTVHP-UHFFFAOYSA-N 1 0 275.779 3.898 20 10 CHCDRO CC(C)CC[C@@H]1CCC[N@@H+]1Cc1cc2c(cc1O)OCO2 ZINC000767763400 1129811638 /nfs/dbraw/zinc/81/16/38/1129811638.db2.gz AMMXBZHJKADFFM-AWEZNQCLSA-N 1 0 291.391 3.522 20 10 CHCDRO CCOc1ccc(C[N@H+](CC)C2CCCCC2)c(O)c1 ZINC000768138753 1129835339 /nfs/dbraw/zinc/83/53/39/1129835339.db2.gz SVTJKZYDODHCFI-UHFFFAOYSA-N 1 0 277.408 3.946 20 10 CHCDRO Cc1ccc(O)c(C[N@H+](C)Cc2cccc(Cl)c2)c1 ZINC000768175407 1129839603 /nfs/dbraw/zinc/83/96/03/1129839603.db2.gz OUPAFSZYRSXXGZ-UHFFFAOYSA-N 1 0 275.779 3.986 20 10 CHCDRO CCOc1ccc(C[N@H+](C)[C@H](C)c2ccccc2)c(O)c1 ZINC000768196499 1129842356 /nfs/dbraw/zinc/84/23/56/1129842356.db2.gz GHOUVOSOQPEZRE-CQSZACIVSA-N 1 0 285.387 3.984 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2Cc3ccccc3[C@@H](C)C2)c1 ZINC000768196348 1129842488 /nfs/dbraw/zinc/84/24/88/1129842488.db2.gz PSGHZLTWZCYGEA-AWEZNQCLSA-N 1 0 267.372 3.820 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+]2Cc3ccccc3[C@H](C)C2)c1 ZINC000768195586 1129842941 /nfs/dbraw/zinc/84/29/41/1129842941.db2.gz NVPACNUIENRQEI-CQSZACIVSA-N 1 0 297.398 3.910 20 10 CHCDRO CCOc1ccc(C[N@H+](C)C2CCCCCC2)c(O)c1 ZINC000768214093 1129844087 /nfs/dbraw/zinc/84/40/87/1129844087.db2.gz HGAHHFNWWISLFS-UHFFFAOYSA-N 1 0 277.408 3.946 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](C)[C@@H]2CCc3ccccc32)c1 ZINC000768233231 1129845602 /nfs/dbraw/zinc/84/56/02/1129845602.db2.gz LZWQFWSBRCLFLM-GOSISDBHSA-N 1 0 297.398 3.910 20 10 CHCDRO CCN(CC)c1ccc(C[NH+]2C3CCC2CC3)cc1 ZINC000768230128 1129845715 /nfs/dbraw/zinc/84/57/15/1129845715.db2.gz QPWJURJBXXNQSB-UHFFFAOYSA-N 1 0 258.409 3.660 20 10 CHCDRO CCC[N@H+](Cc1cc(Br)ccc1O)C1CC1 ZINC000768291630 1129849426 /nfs/dbraw/zinc/84/94/26/1129849426.db2.gz QZDZAWHFHORCQW-UHFFFAOYSA-N 1 0 284.197 3.529 20 10 CHCDRO CCOc1ccc(C[N@H+](CC)C2CCCC2)c(O)c1 ZINC000768336602 1129852399 /nfs/dbraw/zinc/85/23/99/1129852399.db2.gz WWGWORFEBIWVDG-UHFFFAOYSA-N 1 0 263.381 3.555 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCC(F)(F)C1)c1ccc(N(C)C)cc1 ZINC000381949990 1129853814 /nfs/dbraw/zinc/85/38/14/1129853814.db2.gz AWFFXFHDFFCUFC-YPMHNXCESA-N 1 0 268.351 3.591 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CC[C@@H](c3ccccc3)C2)c1 ZINC000768361491 1129853855 /nfs/dbraw/zinc/85/38/55/1129853855.db2.gz RMSFYRZKBBLSTC-MRXNPFEDSA-N 1 0 297.398 3.780 20 10 CHCDRO Oc1cc2c(cc1C[N@@H+]1CCc3cc(F)ccc3C1)CCC2 ZINC000768481005 1129857866 /nfs/dbraw/zinc/85/78/66/1129857866.db2.gz DGFYQEMGECBIOE-UHFFFAOYSA-N 1 0 297.373 3.578 20 10 CHCDRO COc1cc(C[N@H+](C)[C@H]2CCC[C@H](C)C2)c(O)cc1C ZINC000768442723 1129857954 /nfs/dbraw/zinc/85/79/54/1129857954.db2.gz ZJYVLOKHWMICPL-WFASDCNBSA-N 1 0 277.408 3.720 20 10 CHCDRO CC[C@@H]1Cc2ccccc2C[N@@H+]1Cc1cc(OC)ccc1O ZINC000768530293 1129860553 /nfs/dbraw/zinc/86/05/53/1129860553.db2.gz HICGNAOXLJHBGA-QGZVFWFLSA-N 1 0 297.398 3.738 20 10 CHCDRO C[C@@H]1CO[C@@H](C)C[N@@H+]1Cc1cc(-c2ccccc2)ccc1O ZINC000768536266 1129861011 /nfs/dbraw/zinc/86/10/11/1129861011.db2.gz GXYXNOKJJIAITC-CABCVRRESA-N 1 0 297.398 3.668 20 10 CHCDRO COCC[C@H]1CCCC[N@H+](Cc2cc(C)c(C)cc2O)C1 ZINC000768541247 1129861836 /nfs/dbraw/zinc/86/18/36/1129861836.db2.gz LWULOXNLXHCYNN-MRXNPFEDSA-N 1 0 291.435 3.648 20 10 CHCDRO COc1cccc(O)c1C[N@H+](C)CCCCc1ccccc1 ZINC000768871088 1129878139 /nfs/dbraw/zinc/87/81/39/1129878139.db2.gz HWBQTDZZZYZDGZ-UHFFFAOYSA-N 1 0 299.414 3.856 20 10 CHCDRO Cc1ccc(O)c(C[N@H+](C)CCc2ccccc2F)c1 ZINC000769020848 1129886751 /nfs/dbraw/zinc/88/67/51/1129886751.db2.gz HEXUUOUARJNRMW-UHFFFAOYSA-N 1 0 273.351 3.514 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@H]3CCC[C@H]32)cc1C ZINC000769101748 1129890030 /nfs/dbraw/zinc/89/00/30/1129890030.db2.gz GCCQFHJCYLNDME-GOEBONIOSA-N 1 0 259.393 3.774 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC[C@H]3CCC[C@H]32)cc1 ZINC000769101752 1129890164 /nfs/dbraw/zinc/89/01/64/1129890164.db2.gz GDGFQFJFZKAEAN-NVXWUHKLSA-N 1 0 258.409 3.517 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CCC[C@H]1C1CCC1 ZINC000769246263 1129898911 /nfs/dbraw/zinc/89/89/11/1129898911.db2.gz YWJDUBITKRWGNV-AWEZNQCLSA-N 1 0 265.784 3.810 20 10 CHCDRO CN(C)c1ccc(C[N@@H+](Cc2ccco2)CC2CC2)cc1 ZINC000769326711 1129902625 /nfs/dbraw/zinc/90/26/25/1129902625.db2.gz MSAOWTJQWYJDEK-UHFFFAOYSA-N 1 0 284.403 3.758 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCc3ccccc3OC2)c1 ZINC000800986515 1129902929 /nfs/dbraw/zinc/90/29/29/1129902929.db2.gz GWQIFFSBVTVFBJ-HOCLYGCPSA-N 1 0 297.398 3.745 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CC[C@H](c3ccccc3F)C2)cc1 ZINC000769380283 1129905656 /nfs/dbraw/zinc/90/56/56/1129905656.db2.gz RCIVFMHUXINGTP-INIZCTEOSA-N 1 0 298.405 3.881 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CCCCC[C@H]2C)c1 ZINC000769416629 1129907609 /nfs/dbraw/zinc/90/76/09/1129907609.db2.gz JUAGRTZYBIVMGO-CYBMUJFWSA-N 1 0 263.381 3.555 20 10 CHCDRO COc1cccc(O)c1C[N@@H+]1C[C@@H](c2ccccc2)C[C@H]1C ZINC000769445518 1129910149 /nfs/dbraw/zinc/91/01/49/1129910149.db2.gz JZAOPGGSILOFLB-ZBFHGGJFSA-N 1 0 297.398 3.779 20 10 CHCDRO C[C@@H]1COCCC[N@@H+]1Cc1cc(-c2ccccc2)ccc1O ZINC000769458411 1129911759 /nfs/dbraw/zinc/91/17/59/1129911759.db2.gz TZTWSWGXCKPUQV-OAHLLOKOSA-N 1 0 297.398 3.670 20 10 CHCDRO COc1cccc(C[N@H+](C)[C@H](C)Cc2ccc(C)cc2)c1O ZINC000769462006 1129911882 /nfs/dbraw/zinc/91/18/82/1129911882.db2.gz FBVRVNSCSBHMMW-OAHLLOKOSA-N 1 0 299.414 3.772 20 10 CHCDRO COc1cccc(O)c1C[N@H+](C)[C@H](C)Cc1ccc(C)cc1 ZINC000769464477 1129911941 /nfs/dbraw/zinc/91/19/41/1129911941.db2.gz YCUDGPGEHSRCAT-OAHLLOKOSA-N 1 0 299.414 3.772 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CC[C@@H]2Cc2ccccc2)c1O ZINC000769507052 1129914572 /nfs/dbraw/zinc/91/45/72/1129914572.db2.gz ZMXVSQHLQPAPPX-QGZVFWFLSA-N 1 0 297.398 3.608 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CC[C@H]2Cc2ccccc2)cc1C ZINC000769505900 1129915047 /nfs/dbraw/zinc/91/50/47/1129915047.db2.gz JZALONLPJPMHDT-SFHVURJKSA-N 1 0 281.399 3.826 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCOC3(C2)CCCCCC3)c1 ZINC000769515555 1129915872 /nfs/dbraw/zinc/91/58/72/1129915872.db2.gz VYGNFLBIOLJDKC-UHFFFAOYSA-N 1 0 289.419 3.626 20 10 CHCDRO CCc1cccc(C[NH2+][C@@H]2CCc3ccccc32)c1O ZINC000691473395 1129922380 /nfs/dbraw/zinc/92/23/80/1129922380.db2.gz JFGJRJFHZFYORY-QGZVFWFLSA-N 1 0 267.372 3.732 20 10 CHCDRO CCCC[N@H+](Cc1ccc(C)cn1)Cc1ccccc1O ZINC000801596173 1129932233 /nfs/dbraw/zinc/93/22/33/1129932233.db2.gz RLHYBHAIYWGMTC-UHFFFAOYSA-N 1 0 284.403 3.898 20 10 CHCDRO CCCC[N@H+](Cc1ccccc1O)CC1(O)CCCCC1 ZINC000801596573 1129932255 /nfs/dbraw/zinc/93/22/55/1129932255.db2.gz GFHMNUHUGDGFLV-UHFFFAOYSA-N 1 0 291.435 3.690 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCC[C@@H]1CCc1ccccc1 ZINC000770509095 1129947844 /nfs/dbraw/zinc/94/78/44/1129947844.db2.gz HXZPMWBCUKVVGO-GOSISDBHSA-N 1 0 281.399 3.989 20 10 CHCDRO CC[C@H](Cc1ccccc1)[N@H+](C)Cc1ccccc1O ZINC000770505281 1129947905 /nfs/dbraw/zinc/94/79/05/1129947905.db2.gz NIEKWBKHMVGUBL-QGZVFWFLSA-N 1 0 269.388 3.845 20 10 CHCDRO C[C@H]1c2cc(F)cc(F)c2CC[N@H+]1Cc1ccccc1O ZINC000770504538 1129948299 /nfs/dbraw/zinc/94/82/99/1129948299.db2.gz IKULQSMJYLAOST-NSHDSACASA-N 1 0 289.325 3.790 20 10 CHCDRO Oc1ccccc1C[N@H+](CC1CCCCC1)C1CC1 ZINC000770509688 1129949025 /nfs/dbraw/zinc/94/90/25/1129949025.db2.gz RCAUIYVDNFIBLW-UHFFFAOYSA-N 1 0 259.393 3.937 20 10 CHCDRO COc1ccc(N2CCC[N@@H+]([C@@H](C)CC(C)C)CC2)cc1 ZINC000770509366 1129949076 /nfs/dbraw/zinc/94/90/76/1129949076.db2.gz LONDMFXFYCUZFI-INIZCTEOSA-N 1 0 290.451 3.642 20 10 CHCDRO Cc1ccncc1[C@@H](C)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000771388971 1129979493 /nfs/dbraw/zinc/97/94/93/1129979493.db2.gz QDRVGEMFXCQVRI-LSDHHAIUSA-N 1 0 283.419 3.868 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCC2C[C@H](C)O[C@@H](C)C2)c(O)c1 ZINC000802308717 1129991311 /nfs/dbraw/zinc/99/13/11/1129991311.db2.gz HGGRSHYOFQKQMX-KKUMJFAQSA-N 1 0 291.435 3.945 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCC2C[C@@H](C)O[C@H](C)C2)c1 ZINC000802309996 1129991589 /nfs/dbraw/zinc/99/15/89/1129991589.db2.gz WRABUYRJEXOGDC-KFWWJZLASA-N 1 0 291.435 3.945 20 10 CHCDRO C[C@]1([NH2+]Cc2cc(-c3ccccc3)ccc2O)CCCOC1 ZINC000771896844 1129995764 /nfs/dbraw/zinc/99/57/64/1129995764.db2.gz RJTCENWZPWICJX-IBGZPJMESA-N 1 0 297.398 3.718 20 10 CHCDRO COc1ccc(C[N@H+](C)Cc2ccc(N(C)C)cc2)cc1C ZINC000771934105 1129996534 /nfs/dbraw/zinc/99/65/34/1129996534.db2.gz WGGFHDHXLKGZTR-UHFFFAOYSA-N 1 0 298.430 3.702 20 10 CHCDRO C[N@H+](Cc1ccccc1O)[C@H]1CCc2cccc(F)c2C1 ZINC001171005899 1131412708 /nfs/dbraw/zinc/41/27/08/1131412708.db2.gz SDZOWPRQFACJMK-HNNXBMFYSA-N 1 0 285.362 3.521 20 10 CHCDRO C[N@H+](CCOc1ccccc1)Cc1cc(Cl)ccc1O ZINC000771932052 1129999412 /nfs/dbraw/zinc/99/94/12/1129999412.db2.gz UCRGLKPYCZQHBN-UHFFFAOYSA-N 1 0 291.778 3.556 20 10 CHCDRO CCc1cccc(C[NH2+][C@@H](C)CCc2ccco2)c1O ZINC000691507870 1130020798 /nfs/dbraw/zinc/02/07/98/1130020798.db2.gz TVYNGENXNUESFK-ZDUSSCGKSA-N 1 0 273.376 3.659 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCC2(CCCCC2)O1)c1ccccc1O ZINC000786431599 1130093545 /nfs/dbraw/zinc/09/35/45/1130093545.db2.gz ROZQWNAZRIALGN-HUUCEWRRSA-N 1 0 289.419 3.925 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C2CC3(C2)COC(C)(C)C3)c1 ZINC000903325906 1130155184 /nfs/dbraw/zinc/15/51/84/1130155184.db2.gz XJNOLXWSUSOVIC-WRSVWVKZSA-N 1 0 289.419 3.699 20 10 CHCDRO C[C@@H]([NH2+]CC[C@@H]1CCC(F)(F)C1)c1ccccc1O ZINC000903333094 1130158795 /nfs/dbraw/zinc/15/87/95/1130158795.db2.gz NNZODHAEGNDEND-NEPJUHHUSA-N 1 0 269.335 3.868 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H](c2ccccn2)C2CC2)c1O ZINC000903335284 1130160781 /nfs/dbraw/zinc/16/07/81/1130160781.db2.gz NJLGPUAOJORIRM-YVEFUNNKSA-N 1 0 298.386 3.598 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CC[C@H]2CCC(F)(F)C2)c1O ZINC000903340770 1130162116 /nfs/dbraw/zinc/16/21/16/1130162116.db2.gz JLAWSNONNMUOAK-NWDGAFQWSA-N 1 0 299.361 3.877 20 10 CHCDRO C[C@@H]([NH2+][C@@H](c1ccccn1)C1CC1)c1ccc(N(C)C)cc1 ZINC000903341305 1130163006 /nfs/dbraw/zinc/16/30/06/1130163006.db2.gz XLAMYHDHSHAZRZ-AUUYWEPGSA-N 1 0 295.430 3.950 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCOC12CCCC2)c1ccc(Cl)cc1O ZINC000903388770 1130169614 /nfs/dbraw/zinc/16/96/14/1130169614.db2.gz NMQWBIRRIRANPE-ABAIWWIYSA-N 1 0 295.810 3.798 20 10 CHCDRO CC[C@H]([NH2+]CCc1cccnc1C)c1ccc(C)cc1O ZINC000903419257 1130173965 /nfs/dbraw/zinc/17/39/65/1130173965.db2.gz UCGYAPHBIYVNDZ-KRWDZBQOSA-N 1 0 284.403 3.687 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@H](c2ccncc2)C2CC2)c1O ZINC000903428858 1130175785 /nfs/dbraw/zinc/17/57/85/1130175785.db2.gz LVIJKPCKWCOLNY-PXAZEXFGSA-N 1 0 298.386 3.598 20 10 CHCDRO CC[C@@H]([NH2+]CCC(O)(CC)CC)c1ccc(N(C)C)cc1 ZINC000788264665 1130180386 /nfs/dbraw/zinc/18/03/86/1130180386.db2.gz ZWRLLTHOUOSTRM-QGZVFWFLSA-N 1 0 292.467 3.735 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CCN(C)c2ccccc2)c(O)c1 ZINC000788507881 1130191618 /nfs/dbraw/zinc/19/16/18/1130191618.db2.gz SOIRVUIULLFCJQ-MRXNPFEDSA-N 1 0 298.430 3.796 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CC2(SC)CC2)cc1F ZINC000788524883 1130191915 /nfs/dbraw/zinc/19/19/15/1130191915.db2.gz XRFHFBVALXRPBN-UHFFFAOYSA-N 1 0 296.455 3.657 20 10 CHCDRO CCN1CCCC[C@@H]1C[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000788595035 1130196347 /nfs/dbraw/zinc/19/63/47/1130196347.db2.gz ZBZCPNUBPRVJHI-HZPDHXFCSA-N 1 0 290.451 3.534 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCC[C@H](OC)C2)cc1 ZINC000746753335 1130199183 /nfs/dbraw/zinc/19/91/83/1130199183.db2.gz FEZNESDQJWDKFJ-AEFFLSMTSA-N 1 0 290.451 3.580 20 10 CHCDRO C[C@H](C[NH2+][C@@H](C)c1ccc(N(C)C)cc1)CC(F)(F)F ZINC000397035358 1130216679 /nfs/dbraw/zinc/21/66/79/1130216679.db2.gz ZRVGBYZJPIIRMK-RYUDHWBXSA-N 1 0 288.357 3.992 20 10 CHCDRO COc1c2ccccc2oc1C[NH2+][C@H](C)c1ccccc1O ZINC000788982682 1130225134 /nfs/dbraw/zinc/22/51/34/1130225134.db2.gz YICGGDUODDXKDP-GFCCVEGCSA-N 1 0 297.354 3.998 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)c1 ZINC000749129207 1130266616 /nfs/dbraw/zinc/26/66/16/1130266616.db2.gz NLZQCRFNUZYZAX-OAHLLOKOSA-N 1 0 298.430 3.920 20 10 CHCDRO C[C@@]1(C2CC2)C[N@H+](Cc2ccc3ccccc3c2O)CCO1 ZINC000826877323 1130305404 /nfs/dbraw/zinc/30/54/04/1130305404.db2.gz DKHBAEJFAGGMNL-IBGZPJMESA-N 1 0 297.398 3.546 20 10 CHCDRO CC(C)(C)[C@H]1C[N@H+](Cc2c(O)ccc3ccccc32)CCO1 ZINC000790416446 1130312972 /nfs/dbraw/zinc/31/29/72/1130312972.db2.gz PPNOXCDKTONMFC-GOSISDBHSA-N 1 0 299.414 3.792 20 10 CHCDRO CCC[N@H+](Cc1ccccc1O)CC1(OC)CCCC1 ZINC000792163957 1130434010 /nfs/dbraw/zinc/43/40/10/1130434010.db2.gz DTPZBZAXJUSZHG-UHFFFAOYSA-N 1 0 277.408 3.563 20 10 CHCDRO CCC(C)(C)[N@H+](C)Cc1c([O-])ccc(Cl)c1F ZINC000792167748 1130434097 /nfs/dbraw/zinc/43/40/97/1130434097.db2.gz PMKSIILEGRZXPG-UHFFFAOYSA-N 1 0 259.752 3.805 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)c2ccc(C)cc2O)c(F)c1 ZINC000756755589 1130439258 /nfs/dbraw/zinc/43/92/58/1130439258.db2.gz AXLHMBXOQDLLQU-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO CC(C)[C@@H]1CC[C@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000796697121 1130447437 /nfs/dbraw/zinc/44/74/37/1130447437.db2.gz WKYNIRNZAYNADT-ZWKOTPCHSA-N 1 0 272.436 3.811 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+]CCCOC(C)(C)C)c1O ZINC000827168940 1130457093 /nfs/dbraw/zinc/45/70/93/1130457093.db2.gz ADLYNNDGMGYVKJ-UHFFFAOYSA-N 1 0 285.815 3.649 20 10 CHCDRO CCC[N@H+](CCCCCF)Cc1ccccc1O ZINC000792868335 1130503066 /nfs/dbraw/zinc/50/30/66/1130503066.db2.gz TZNFTWNBUBDURZ-UHFFFAOYSA-N 1 0 253.361 3.744 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C2CCCC2)c(C(F)(F)F)c1 ZINC000792892132 1130503989 /nfs/dbraw/zinc/50/39/89/1130503989.db2.gz UKWSDJMOGRXYHV-UHFFFAOYSA-N 1 0 286.341 3.804 20 10 CHCDRO Cc1cc(CC[NH2+]CC2(F)CC2)c(C)n1-c1ccccc1 ZINC000792893578 1130504222 /nfs/dbraw/zinc/50/42/22/1130504222.db2.gz HBGPSTCDWCVUSJ-UHFFFAOYSA-N 1 0 286.394 3.728 20 10 CHCDRO CC[C@@H](C)[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000792888620 1130504577 /nfs/dbraw/zinc/50/45/77/1130504577.db2.gz HXMMOXOAZQTWBO-SNVBAGLBSA-N 1 0 274.330 3.660 20 10 CHCDRO C[C@H]1C[C@H](C)[NH+]1Cc1ccc(OCc2ccccc2)cc1O ZINC000793220978 1130530874 /nfs/dbraw/zinc/53/08/74/1130530874.db2.gz SQGHDGHBEMGUHD-GJZGRUSLSA-N 1 0 297.398 3.954 20 10 CHCDRO CCC[C@@H]([NH2+]Cc1cc(C)ccc1O)[C@@H](O)c1ccccc1 ZINC000793245517 1130536875 /nfs/dbraw/zinc/53/68/75/1130536875.db2.gz YBZPLFWXNFNTPD-MJGOQNOKSA-N 1 0 299.414 3.693 20 10 CHCDRO CO[C@@]1(C)CCC[N@H+](Cc2cc(Cl)cc(C)c2O)CC1 ZINC000793340496 1130540811 /nfs/dbraw/zinc/54/08/11/1130540811.db2.gz PCPNCASGROVWPV-INIZCTEOSA-N 1 0 297.826 3.745 20 10 CHCDRO CCCc1ccc(C[NH2+]Cc2ccc(OC)cc2O)cc1 ZINC000793388076 1130551522 /nfs/dbraw/zinc/55/15/22/1130551522.db2.gz KULAYMRNMHKYJQ-UHFFFAOYSA-N 1 0 285.387 3.643 20 10 CHCDRO CC[C@@]1(C)CC[N@H+](Cc2c(O)ccc3ccncc32)C1 ZINC000758398078 1130609786 /nfs/dbraw/zinc/60/97/86/1130609786.db2.gz TVYZJSQWNCUSGE-KRWDZBQOSA-N 1 0 270.376 3.562 20 10 CHCDRO CC[N@H+](Cc1cc(Cl)ccc1O)[C@H]1CCOC(C)(C)C1 ZINC000811511441 1130618750 /nfs/dbraw/zinc/61/87/50/1130618750.db2.gz ISDOMZIYBCTLSX-AWEZNQCLSA-N 1 0 297.826 3.825 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H](c2cccnc2)C2CC2)cc1C ZINC000758625418 1130619483 /nfs/dbraw/zinc/61/94/83/1130619483.db2.gz USHUQROEDWGZFV-GOSISDBHSA-N 1 0 282.387 3.645 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]C(C)(C)CC(F)(F)F)c1 ZINC000780587149 1130685656 /nfs/dbraw/zinc/68/56/56/1130685656.db2.gz KFVQQRSIWYJDRR-UHFFFAOYSA-N 1 0 291.313 3.612 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C(C)(C)CC(F)(F)F)cc1C ZINC000780587216 1130685864 /nfs/dbraw/zinc/68/58/64/1130685864.db2.gz LAWYDKTZBCJQJV-UHFFFAOYSA-N 1 0 275.314 3.830 20 10 CHCDRO CCCCC[N@H+](CCCOC)Cc1cc(C)ccc1O ZINC000780793447 1130692578 /nfs/dbraw/zinc/69/25/78/1130692578.db2.gz OBTCMAOFSLUNLB-UHFFFAOYSA-N 1 0 279.424 3.729 20 10 CHCDRO Cc1cccc(C[N@H+]2C[C@@H](C(F)(F)F)CC[C@@H]2C)c1O ZINC000780792965 1130693154 /nfs/dbraw/zinc/69/31/54/1130693154.db2.gz KNCXXURSBXRSDP-AAEUAGOBSA-N 1 0 287.325 3.863 20 10 CHCDRO Oc1c(C[N@@H+]2C[C@@H]3C[C@@H]3[C@H](F)C2)cccc1-c1ccccc1 ZINC001235001278 1130699887 /nfs/dbraw/zinc/69/98/87/1130699887.db2.gz LYUWKVSQRNZWFW-RYQLBKOJSA-N 1 0 297.373 3.849 20 10 CHCDRO C[C@@H]1C[C@H](F)C[N@@H+]1Cc1cccc(-c2ccccc2)c1O ZINC001234993261 1130699999 /nfs/dbraw/zinc/69/99/99/1130699999.db2.gz XTWRXJSWMLJGLI-CJNGLKHVSA-N 1 0 285.362 3.992 20 10 CHCDRO CC[C@H]1COCC[N@@H+]1Cc1cccc(-c2ccccc2)c1O ZINC001234996721 1130700492 /nfs/dbraw/zinc/70/04/92/1130700492.db2.gz NARDFSKNWUNQKN-KRWDZBQOSA-N 1 0 297.398 3.670 20 10 CHCDRO CCC[N@H+](CCOC)Cc1cccc(-c2ccccc2)c1O ZINC001234990574 1130701433 /nfs/dbraw/zinc/70/14/33/1130701433.db2.gz IBOQJOGPVWKGMW-UHFFFAOYSA-N 1 0 299.414 3.918 20 10 CHCDRO C[C@@H](Nc1cc2c(c[nH+]1)CCCC2)c1cc(F)ccc1O ZINC000812739192 1130710459 /nfs/dbraw/zinc/71/04/59/1130710459.db2.gz MTVGYTVLXTUGMH-LLVKDONJSA-N 1 0 286.350 3.978 20 10 CHCDRO Oc1ccc(Cl)cc1CNc1cc2c(c[nH+]1)CCCC2 ZINC000812782142 1130713768 /nfs/dbraw/zinc/71/37/68/1130713768.db2.gz NUZKDTIKMFQAJA-UHFFFAOYSA-N 1 0 288.778 3.932 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCCSCC2)cc1 ZINC000692468830 1130740379 /nfs/dbraw/zinc/74/03/79/1130740379.db2.gz PJKYGEJVJZDWKO-INIZCTEOSA-N 1 0 292.492 3.908 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)CSC(C)(C)C)c1 ZINC000813330914 1130760616 /nfs/dbraw/zinc/76/06/16/1130760616.db2.gz IYEBCFUWPRURAO-VXGBXAGGSA-N 1 0 297.464 3.972 20 10 CHCDRO Cc1ccc(OC2CC[NH+](Cc3ccc(N)cc3)CC2)cc1 ZINC001235669807 1130764967 /nfs/dbraw/zinc/76/49/67/1130764967.db2.gz KGBIURZUHUSALJ-UHFFFAOYSA-N 1 0 296.414 3.621 20 10 CHCDRO CC(C)(C)c1ccc(C[NH+]2CC3(C2)CC(F)(F)C3)c(O)c1 ZINC001235674881 1130765791 /nfs/dbraw/zinc/76/57/91/1130765791.db2.gz HUTPVGLGNLMHPD-UHFFFAOYSA-N 1 0 295.373 3.921 20 10 CHCDRO CC(C)(C)c1ccc(C[N@@H+]2CCc3occc3C2)c(O)c1 ZINC001235677859 1130766209 /nfs/dbraw/zinc/76/62/09/1130766209.db2.gz IAOJMBQKSXSXSH-UHFFFAOYSA-N 1 0 285.387 3.841 20 10 CHCDRO CCO[C@@H]1CCC[N@H+](Cc2ccc(C(C)(C)C)cc2O)C1 ZINC001235685990 1130767434 /nfs/dbraw/zinc/76/74/34/1130767434.db2.gz WGBCZTZQMYJDCK-MRXNPFEDSA-N 1 0 291.435 3.691 20 10 CHCDRO CC(C)[C@@H]1COCC[N@@H+]1Cc1ccc(C(C)(C)C)cc1O ZINC001235679453 1130768050 /nfs/dbraw/zinc/76/80/50/1130768050.db2.gz OQWOPGMUTLMWRG-INIZCTEOSA-N 1 0 291.435 3.547 20 10 CHCDRO COc1cc(C[N@@H+]2C[C@H](C)[C@H]3CCCC[C@@H]32)c(O)cc1C ZINC000782278911 1130768250 /nfs/dbraw/zinc/76/82/50/1130768250.db2.gz ZMMXCAZGJJSYTH-IMJJTQAJSA-N 1 0 289.419 3.720 20 10 CHCDRO Nc1ccc(C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)cc1 ZINC001235715883 1130772386 /nfs/dbraw/zinc/77/23/86/1130772386.db2.gz WXVXQZISNWQANJ-QGZVFWFLSA-N 1 0 270.351 3.745 20 10 CHCDRO FC1(F)CCCC[C@H](C[NH2+]Cc2ccc3c(c2)CCO3)C1 ZINC000813782803 1130783207 /nfs/dbraw/zinc/78/32/07/1130783207.db2.gz UHLJKNMHKLLNLC-AWEZNQCLSA-N 1 0 295.373 3.927 20 10 CHCDRO Nc1ccc(C[N@@H+]2CC[C@@H](c3ccccc3Cl)C2)cc1 ZINC001235826584 1130783363 /nfs/dbraw/zinc/78/33/63/1130783363.db2.gz YZIFFCSCCGEFQW-CQSZACIVSA-N 1 0 286.806 3.912 20 10 CHCDRO Cc1nc2cc(C[N@@H+](C)Cc3ccccc3O)ccc2s1 ZINC001235862687 1130788787 /nfs/dbraw/zinc/78/87/87/1130788787.db2.gz JWDRRYNHDXJTCH-UHFFFAOYSA-N 1 0 298.411 3.942 20 10 CHCDRO CC[C@@H](c1ccccc1)[N@H+](C)Cc1ccc(N)cc1 ZINC001235959374 1130816572 /nfs/dbraw/zinc/81/65/72/1130816572.db2.gz IITSRULPRIFXQN-KRWDZBQOSA-N 1 0 254.377 3.852 20 10 CHCDRO C[C@@H]([NH2+]CCCOc1ccccc1F)c1ccccc1O ZINC000783504003 1130830657 /nfs/dbraw/zinc/83/06/57/1130830657.db2.gz WPGYINQZTMNWOU-CYBMUJFWSA-N 1 0 289.350 3.651 20 10 CHCDRO Cc1ccc(OCC[NH2+][C@H](C)c2ccccc2O)c(C)c1 ZINC000783501736 1130831296 /nfs/dbraw/zinc/83/12/96/1130831296.db2.gz PTEBANHTWCDZGI-OAHLLOKOSA-N 1 0 285.387 3.739 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1ccccc1O)c1c(C)nn(C)c1C ZINC000783517995 1130833108 /nfs/dbraw/zinc/83/31/08/1130833108.db2.gz MJIKVBFCSKOSAX-IAQYHMDHSA-N 1 0 287.407 3.544 20 10 CHCDRO C[C@@H]([NH2+]CCc1c[nH]c2cc(F)ccc12)c1ccccc1O ZINC000783509941 1130833314 /nfs/dbraw/zinc/83/33/14/1130833314.db2.gz UZGGNPOIXVLFNX-GFCCVEGCSA-N 1 0 298.361 3.906 20 10 CHCDRO C[C@H]([NH2+][C@H]1c2ccccc2C[C@@H]1C)c1ccccc1O ZINC000783522545 1130833536 /nfs/dbraw/zinc/83/35/36/1130833536.db2.gz PFRFMCZHAWJXET-ZJNRKIDTSA-N 1 0 267.372 3.976 20 10 CHCDRO C[C@@H]([NH2+]CCC1Cc2ccccc2C1)c1ccccc1O ZINC000783520292 1130833717 /nfs/dbraw/zinc/83/37/17/1130833717.db2.gz ZYPLSBGVDGIJJN-CQSZACIVSA-N 1 0 281.399 3.848 20 10 CHCDRO CCC(CC)[C@H](CC[NH2+][C@H](C)c1ccccc1O)OC ZINC000783519321 1130834547 /nfs/dbraw/zinc/83/45/47/1130834547.db2.gz RLSZAXGZBUUYSB-DYVFJYSZSA-N 1 0 279.424 3.884 20 10 CHCDRO C[C@H](C[N@H+](C)Cc1ccccc1O)c1ccc(F)cc1 ZINC000783535074 1130835193 /nfs/dbraw/zinc/83/51/93/1130835193.db2.gz LPEPMWCOEWIXCE-CYBMUJFWSA-N 1 0 273.351 3.767 20 10 CHCDRO Cc1cccc(C[N@@H+]2CC3(CCC3)[C@@H]2C(C)C)c1O ZINC000814170930 1130838383 /nfs/dbraw/zinc/83/83/83/1130838383.db2.gz GQXCVDNADWLHFQ-INIZCTEOSA-N 1 0 259.393 3.711 20 10 CHCDRO Cc1ccc(O)c(C[N@H+]2C[C@H](C)[C@H]3CCCC[C@H]32)c1 ZINC000783593533 1130841377 /nfs/dbraw/zinc/84/13/77/1130841377.db2.gz VPXYHHVXVDHGJR-NUEKZKHPSA-N 1 0 259.393 3.711 20 10 CHCDRO CC(C)CCC[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000783595922 1130842096 /nfs/dbraw/zinc/84/20/96/1130842096.db2.gz GAVJRWKRFFWJEU-UHFFFAOYSA-N 1 0 292.492 3.766 20 10 CHCDRO Oc1ccc(Br)cc1C[NH2+]C12CCC(CC1)C2 ZINC000784641448 1130914907 /nfs/dbraw/zinc/91/49/07/1130914907.db2.gz XKOLROSUVFTBJC-UHFFFAOYSA-N 1 0 296.208 3.577 20 10 CHCDRO C[C@H]1OCC[C@]1(C)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000784640497 1130915013 /nfs/dbraw/zinc/91/50/13/1130915013.db2.gz PGSZWINAANMFGH-KUHUBIRLSA-N 1 0 297.398 3.716 20 10 CHCDRO COc1ccc(C2=CC[N@H+](Cc3ccc(N)cc3)CC2)cc1 ZINC001236411576 1130932486 /nfs/dbraw/zinc/93/24/86/1130932486.db2.gz NNYYNBMODOWQSY-UHFFFAOYSA-N 1 0 294.398 3.567 20 10 CHCDRO Cc1cc(C[N@@H+]2CCC[C@H]2c2cccn2C)ccc1N(C)C ZINC000815063762 1130954793 /nfs/dbraw/zinc/95/47/93/1130954793.db2.gz QLMYPHMKFFASAA-IBGZPJMESA-N 1 0 297.446 3.737 20 10 CHCDRO COc1ccc(O)c(C[NH2+]Cc2cc(C)cc(Cl)c2)c1 ZINC000815125821 1130959611 /nfs/dbraw/zinc/95/96/11/1130959611.db2.gz AHUHYZLRKUNWQW-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO CCCN1CCC[C@H]1C[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000797115430 1130963322 /nfs/dbraw/zinc/96/33/22/1130963322.db2.gz SXEKUJPZISCAEE-RDJZCZTQSA-N 1 0 290.451 3.616 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CC[C@H](C)F)cc1F ZINC000815148651 1130967380 /nfs/dbraw/zinc/96/73/80/1130967380.db2.gz CTXMHOBYSRMXPD-LBPRGKRZSA-N 1 0 270.367 3.510 20 10 CHCDRO CC(=O)c1cc(Cl)cc(C[N@@H+]2CC(C)=C[C@@H](C)C2)c1O ZINC000797526118 1130990775 /nfs/dbraw/zinc/99/07/75/1130990775.db2.gz INOSNYCCELINCX-SNVBAGLBSA-N 1 0 293.794 3.646 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H]2Cc3ccccc32)c(O)c1 ZINC000815576078 1131001735 /nfs/dbraw/zinc/00/17/35/1131001735.db2.gz IVFVTHOSSCDDLC-HOCLYGCPSA-N 1 0 281.399 4.000 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H](O)c2ccccc2C)c(O)c1 ZINC000815579936 1131002743 /nfs/dbraw/zinc/00/27/43/1131002743.db2.gz YUHKBMZNYAWOCO-CRAIPNDOSA-N 1 0 299.414 3.702 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CCC(F)(F)F)c(O)c1 ZINC000815587319 1131005003 /nfs/dbraw/zinc/00/50/03/1131005003.db2.gz GTZYBZZPHQYMFT-JTQLQIEISA-N 1 0 261.287 3.612 20 10 CHCDRO CCc1ccc(C[N@H+](C)[C@H]2CC[C@H](C)CC2)c(O)c1 ZINC001236788606 1131005885 /nfs/dbraw/zinc/00/58/85/1131005885.db2.gz PTJMJVHJYLWEJD-SAZUREKKSA-N 1 0 261.409 3.965 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CC(C)(C)[C@@H](O)C(C)C)c(O)c1 ZINC000815598010 1131006239 /nfs/dbraw/zinc/00/62/39/1131006239.db2.gz KQPKOKNADFUWCT-PBHICJAKSA-N 1 0 293.451 3.703 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@@H]2CCCC23CCCC3)c1 ZINC000815593306 1131006488 /nfs/dbraw/zinc/00/64/88/1131006488.db2.gz IUXPYVKLPYJJKM-MRXNPFEDSA-N 1 0 275.392 3.603 20 10 CHCDRO CCc1ccc(C[N@H+](Cc2ccco2)C2CC2)c(O)c1 ZINC001236792803 1131008221 /nfs/dbraw/zinc/00/82/21/1131008221.db2.gz RNBFJHHBPDOWTM-UHFFFAOYSA-N 1 0 271.360 3.712 20 10 CHCDRO c1cc(C[NH2+][C@H]2CCCC23CCCC3)cc2c1OCC2 ZINC000815573636 1131008191 /nfs/dbraw/zinc/00/81/91/1131008191.db2.gz PAPFVTCMJKQHFE-KRWDZBQOSA-N 1 0 271.404 3.824 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CCC23CCCC3)c(Cl)c1 ZINC001236796929 1131008654 /nfs/dbraw/zinc/00/86/54/1131008654.db2.gz AKZKEHMRTCHZGU-UHFFFAOYSA-N 1 0 281.783 3.573 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@H]2CCCCS2)c(O)c1 ZINC000815614855 1131008931 /nfs/dbraw/zinc/00/89/31/1131008931.db2.gz CFMUVBZBILBWBT-ZIAGYGMSSA-N 1 0 279.449 3.945 20 10 CHCDRO CCOCC(C)(C)C[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000815626823 1131010557 /nfs/dbraw/zinc/01/05/57/1131010557.db2.gz MXWGXYLGEVVZBU-CQSZACIVSA-N 1 0 279.424 3.722 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2cnn3ccccc23)c(O)c1 ZINC000815625490 1131010568 /nfs/dbraw/zinc/01/05/68/1131010568.db2.gz FJOGYCSERXLABM-CQSZACIVSA-N 1 0 295.386 3.508 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CCSC(C)C)c(O)c1 ZINC000815625598 1131010745 /nfs/dbraw/zinc/01/07/45/1131010745.db2.gz HVWJUHFTVXTMDQ-ZDUSSCGKSA-N 1 0 267.438 3.801 20 10 CHCDRO Fc1ccccc1[C@H]1C[C@H]([NH2+]Cc2ccc3c(c2)CCO3)C1 ZINC000797876495 1131011499 /nfs/dbraw/zinc/01/14/99/1131011499.db2.gz LLFDTSXVVRZOGI-WKILWMFISA-N 1 0 297.373 3.796 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CCC[C@@H]2C(C)C)c(Cl)c1 ZINC001236808621 1131011722 /nfs/dbraw/zinc/01/17/22/1131011722.db2.gz QBTCXMKYKGWCTJ-CQSZACIVSA-N 1 0 283.799 3.675 20 10 CHCDRO CCOc1ccc(C[NH2+][C@H]2C[C@H](c3ccccc3)C2)c(O)c1 ZINC000797876791 1131011766 /nfs/dbraw/zinc/01/17/66/1131011766.db2.gz GQPATRJQAYUYSA-QAQDUYKDSA-N 1 0 297.398 3.827 20 10 CHCDRO CC[C@@H]1CCC[N@H+](Cc2c(O)cc(OC)cc2Cl)C1 ZINC001236801121 1131012295 /nfs/dbraw/zinc/01/22/95/1131012295.db2.gz DDZIJPNIZQHODW-LLVKDONJSA-N 1 0 283.799 3.676 20 10 CHCDRO COc1cc(C)c(C[N@@H+]2CC[C@@H](c3ccccc3)C2)c(O)c1 ZINC001236806788 1131012639 /nfs/dbraw/zinc/01/26/39/1131012639.db2.gz BDMXJBCVYZOSEM-MRXNPFEDSA-N 1 0 297.398 3.699 20 10 CHCDRO CCC[N@@H+](Cc1c(C)cc(OC)cc1O)CC(C)C ZINC001236822223 1131014484 /nfs/dbraw/zinc/01/44/84/1131014484.db2.gz YRAPVEOVOCXGBN-UHFFFAOYSA-N 1 0 265.397 3.577 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](CO)C2CCCCC2)c(O)c1 ZINC000815648132 1131017153 /nfs/dbraw/zinc/01/71/53/1131017153.db2.gz 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1131100411 /nfs/dbraw/zinc/10/04/11/1131100411.db2.gz RVJBRZLTYDBXBT-UHFFFAOYSA-N 1 0 267.328 3.770 20 10 CHCDRO CC[N@H+](Cc1ccccn1)Cc1ccc2ccccc2c1O ZINC000816509360 1131102591 /nfs/dbraw/zinc/10/25/91/1131102591.db2.gz NNRIPRLXJGLHDJ-UHFFFAOYSA-N 1 0 292.382 3.963 20 10 CHCDRO Oc1c(C[N@@H+]2CCC[C@@H]3COCC[C@@H]32)ccc2ccccc21 ZINC000816520838 1131103295 /nfs/dbraw/zinc/10/32/95/1131103295.db2.gz ZOADOUHUENOJBZ-AEFFLSMTSA-N 1 0 297.398 3.546 20 10 CHCDRO Cc1cccc(O)c1C[N@H+](C)Cc1ccc(Cl)cc1 ZINC001237489809 1131103955 /nfs/dbraw/zinc/10/39/55/1131103955.db2.gz KTYKNUHFDMJVOM-UHFFFAOYSA-N 1 0 275.779 3.986 20 10 CHCDRO COc1ccc(C[NH2+]C2CCC(C(F)F)CC2)cc1C ZINC000799717937 1131104021 /nfs/dbraw/zinc/10/40/21/1131104021.db2.gz NXTFLIBOZOICQC-UHFFFAOYSA-N 1 0 283.362 3.917 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+]1C[C@@H]2C[C@H](C1)c1ccccc12 ZINC001237492477 1131104979 /nfs/dbraw/zinc/10/49/79/1131104979.db2.gz RCRVVFUWUSUTKU-GASCZTMLSA-N 1 0 279.383 3.787 20 10 CHCDRO Cc1nc(CC[NH2+]Cc2ccc3ccccc3c2O)cs1 ZINC000816533918 1131105522 /nfs/dbraw/zinc/10/55/22/1131105522.db2.gz OQUFGTGYLHWUOX-UHFFFAOYSA-N 1 0 298.411 3.643 20 10 CHCDRO CO[C@H]1CCCC[C@@H]1[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000799730078 1131106035 /nfs/dbraw/zinc/10/60/35/1131106035.db2.gz WXNXAIGRYJOJEA-BPUTZDHNSA-N 1 0 277.408 3.617 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CC[C@H](OC)C[C@H]2C)cc1 ZINC000799736023 1131106848 /nfs/dbraw/zinc/10/68/48/1131106848.db2.gz GFPGFAOIPBXYJH-QAPCUYQASA-N 1 0 290.451 3.532 20 10 CHCDRO CC1(C)C[C@@H]1C[NH2+]Cc1ccc2ccccc2c1O ZINC000816549400 1131106899 /nfs/dbraw/zinc/10/68/99/1131106899.db2.gz MVCFELNBVDVIII-CQSZACIVSA-N 1 0 255.361 3.681 20 10 CHCDRO C[C@@H]1CCSCC[N@@H+]1Cc1ccc2ccccc2c1O ZINC000816591862 1131109481 /nfs/dbraw/zinc/10/94/81/1131109481.db2.gz QBUPJILHTAXYKC-CYBMUJFWSA-N 1 0 287.428 3.873 20 10 CHCDRO Oc1c(C[NH2+][C@H]2CCCSC2)ccc2ccccc21 ZINC000816556141 1131109516 /nfs/dbraw/zinc/10/95/16/1131109516.db2.gz AYVPWWDZWDUQDO-AWEZNQCLSA-N 1 0 273.401 3.531 20 10 CHCDRO CSCCCC[NH2+]Cc1ccc2ccccc2c1O ZINC000816552090 1131109628 /nfs/dbraw/zinc/10/96/28/1131109628.db2.gz AJUUTXJYNMAOAW-UHFFFAOYSA-N 1 0 275.417 3.778 20 10 CHCDRO CO[C@]1(C)C[C@H]([NH2+]Cc2ccc3ccccc3c2O)C1(C)C ZINC000816554070 1131109644 /nfs/dbraw/zinc/10/96/44/1131109644.db2.gz NWORGCSMAKPUFO-QFBILLFUSA-N 1 0 299.414 3.839 20 10 CHCDRO CC(C)=CCC[NH2+]Cc1ccc2ccccc2c1O ZINC000816590984 1131110270 /nfs/dbraw/zinc/11/02/70/1131110270.db2.gz QJERLKBHGCXZDM-UHFFFAOYSA-N 1 0 255.361 3.991 20 10 CHCDRO Oc1c(C[NH2+]CC[C@@H]2CCCCO2)ccc2ccccc21 ZINC000816566352 1131110744 /nfs/dbraw/zinc/11/07/44/1131110744.db2.gz SCQQJGUHZBCAOE-INIZCTEOSA-N 1 0 285.387 3.594 20 10 CHCDRO CC1(C)C[C@@H]([NH2+]Cc2ccc3ccccc3c2O)CCO1 ZINC000816558525 1131111853 /nfs/dbraw/zinc/11/18/53/1131111853.db2.gz BYWGZTYOSSGZRB-HNNXBMFYSA-N 1 0 285.387 3.593 20 10 CHCDRO COC1(C[NH2+]Cc2ccc3ccccc3c2O)CCCCC1 ZINC000816572236 1131112733 /nfs/dbraw/zinc/11/27/33/1131112733.db2.gz ICGBEVOEIGLOHV-UHFFFAOYSA-N 1 0 299.414 3.984 20 10 CHCDRO Oc1c(C[N@@H+]2CCCC3(CC3)C2)ccc2ccccc21 ZINC000816571896 1131112774 /nfs/dbraw/zinc/11/27/74/1131112774.db2.gz UAEXKFFNVIVACF-UHFFFAOYSA-N 1 0 267.372 3.921 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CC(C)(C)[C@@H]2C(C)C)c1O ZINC000816624852 1131112901 /nfs/dbraw/zinc/11/29/01/1131112901.db2.gz JNOFRLRNXUVLSM-INIZCTEOSA-N 1 0 277.408 3.657 20 10 CHCDRO CCc1ccc([C@@H]2CC[N@H+](Cc3ccccc3O)C2)cc1 ZINC000816619388 1131116320 /nfs/dbraw/zinc/11/63/20/1131116320.db2.gz DQCLCNKBDXVQQN-QGZVFWFLSA-N 1 0 281.399 3.944 20 10 CHCDRO CCOC1(C)CC[NH+](Cc2ccc3ccccc3c2O)CC1 ZINC000816617249 1131116424 /nfs/dbraw/zinc/11/64/24/1131116424.db2.gz SJUSTXWMTZMXGD-UHFFFAOYSA-N 1 0 299.414 3.936 20 10 CHCDRO Oc1ccc(-c2ccc(F)cc2)cc1C[N@@H+]1CC[C@H](F)C1 ZINC001237641597 1131123942 /nfs/dbraw/zinc/12/39/42/1131123942.db2.gz UMHBLRKTGVSBQW-INIZCTEOSA-N 1 0 289.325 3.742 20 10 CHCDRO CC[C@@H](C)[N@H+](C)Cc1cc(Br)c(C)cc1O ZINC001237681994 1131126839 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ZINC000817584886 1131173132 /nfs/dbraw/zinc/17/31/32/1131173132.db2.gz ABBHNMFZOKGZNL-QLFBSQMISA-N 1 0 277.408 3.617 20 10 CHCDRO CS[C@H](C)C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC000168851328 1131187301 /nfs/dbraw/zinc/18/73/01/1131187301.db2.gz FQNYBHXAYCWJAG-UTUOFQBUSA-N 1 0 265.422 3.590 20 10 CHCDRO Cc1cc([C@H](C)[NH2+]CCc2ccc(N)cc2)c(C)s1 ZINC000817955884 1131190099 /nfs/dbraw/zinc/19/00/99/1131190099.db2.gz KDXZRXOUFFGKSC-LBPRGKRZSA-N 1 0 274.433 3.840 20 10 CHCDRO Nc1ccc(CC[NH2+][C@@H]2CC[C@@H]3CCCC[C@H]3C2)cc1 ZINC000817955890 1131190139 /nfs/dbraw/zinc/19/01/39/1131190139.db2.gz KEJVTIDELLVKIC-XYJFISCASA-N 1 0 272.436 3.760 20 10 CHCDRO Nc1ccc(CC[NH2+][C@@H]2CC[C@@H]3CCCC[C@@H]3C2)cc1 ZINC000817955888 1131190281 /nfs/dbraw/zinc/19/02/81/1131190281.db2.gz KEJVTIDELLVKIC-LZLYRXPVSA-N 1 0 272.436 3.760 20 10 CHCDRO Cc1cccc([C@@H](C)[NH2+]CCc2ccc(N)cc2)c1C ZINC000817955812 1131190639 /nfs/dbraw/zinc/19/06/39/1131190639.db2.gz IGIVUYWXZGIJQZ-OAHLLOKOSA-N 1 0 268.404 3.779 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccc(N)cc1)c1ccc(F)cc1 ZINC000817955444 1131190746 /nfs/dbraw/zinc/19/07/46/1131190746.db2.gz BBJYFXJDDRMJDF-KRWDZBQOSA-N 1 0 272.367 3.691 20 10 CHCDRO CCOc1cccc([C@H](C)[NH2+]CCc2ccc(N)cc2)c1 ZINC000817956216 1131190976 /nfs/dbraw/zinc/19/09/76/1131190976.db2.gz UCBBVEQQBBNBDK-AWEZNQCLSA-N 1 0 284.403 3.561 20 10 CHCDRO COc1ccc([C@@H](C)[C@H](C)[NH2+]CCc2ccc(N)cc2)cc1 ZINC000817956148 1131191018 /nfs/dbraw/zinc/19/10/18/1131191018.db2.gz RUZPQMHIJNZGMU-GJZGRUSLSA-N 1 0 298.430 3.602 20 10 CHCDRO Nc1ccc(CC[NH2+][C@@H]2CCCc3ccc(F)cc32)cc1 ZINC000817957306 1131191115 /nfs/dbraw/zinc/19/11/15/1131191115.db2.gz KQYMDMHRLLRGNH-GOSISDBHSA-N 1 0 284.378 3.618 20 10 CHCDRO Cc1ccc2c(c1)[C@H]([NH2+]CCc1ccc(N)cc1)CCCO2 ZINC000817956165 1131191323 /nfs/dbraw/zinc/19/13/23/1131191323.db2.gz SJCXTMHDPVPDLL-GOSISDBHSA-N 1 0 296.414 3.623 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CC12CC2)c1cc(Cl)ccc1O ZINC000818356925 1131211207 /nfs/dbraw/zinc/21/12/07/1131211207.db2.gz SPXYNVMWOQKRDY-WCQYABFASA-N 1 0 251.757 3.639 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1C[C@H]2C[C@H]2C1)c1ccc(N(C)C)cc1 ZINC000818359327 1131211770 /nfs/dbraw/zinc/21/17/70/1131211770.db2.gz IXYYPKFWZZKAQP-JYYAWHABSA-N 1 0 258.409 3.592 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[N@@H+]1CCC12CCCC2 ZINC001118301485 1131217314 /nfs/dbraw/zinc/21/73/14/1131217314.db2.gz IIMKZXYFSBVXAQ-UHFFFAOYSA-N 1 0 270.420 3.805 20 10 CHCDRO Cc1cc(C[N@@H+]2CCc3cccc(O)c3C2)cnc1C1CC1 ZINC001238622938 1131224276 /nfs/dbraw/zinc/22/42/76/1131224276.db2.gz GFFVYMCIBUOBSH-UHFFFAOYSA-N 1 0 294.398 3.531 20 10 CHCDRO Oc1ccccc1C[NH2+][C@@H]1CCc2c(Cl)cccc2C1 ZINC001171012193 1131419321 /nfs/dbraw/zinc/41/93/21/1131419321.db2.gz GSTHNDDZCTZGJW-CQSZACIVSA-N 1 0 287.790 3.693 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H]2C[C@@H](C)O[C@@H](C)C2)cc1 ZINC000823671982 1131437100 /nfs/dbraw/zinc/43/71/00/1131437100.db2.gz ZKZCMEIJCGVXTA-QLPKVWCKSA-N 1 0 290.451 3.578 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCC[C@@H](C)C1)c1cc(F)ccc1O ZINC000227372495 1131461475 /nfs/dbraw/zinc/46/14/75/1131461475.db2.gz WVZIHYXFSPNKBD-WZRBSPASSA-N 1 0 251.345 3.761 20 10 CHCDRO Cc1cccc(C[NH2+]C[C@H]2CSc3ccccc32)c1O ZINC000824482942 1131470437 /nfs/dbraw/zinc/47/04/37/1131470437.db2.gz FCIKZZJFXHIYQT-AWEZNQCLSA-N 1 0 285.412 3.680 20 10 CHCDRO CCOc1ccc(C[NH2+]C[C@@H]2CCCCC2(F)F)c(O)c1 ZINC000824544373 1131475244 /nfs/dbraw/zinc/47/52/44/1131475244.db2.gz VZYNKRUJGJYCLJ-ZDUSSCGKSA-N 1 0 299.361 3.706 20 10 CHCDRO C[C@H](CCCO)C[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000824603147 1131476112 /nfs/dbraw/zinc/47/61/12/1131476112.db2.gz LIYLRIIHBDLYIM-OAHLLOKOSA-N 1 0 299.414 3.557 20 10 CHCDRO CC1(C)OCC[C@H]1[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000824625222 1131478107 /nfs/dbraw/zinc/47/81/07/1131478107.db2.gz HCAVTPZPADRXON-GOSISDBHSA-N 1 0 297.398 3.716 20 10 CHCDRO FCC1CC[NH+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC001138219976 1131478721 /nfs/dbraw/zinc/47/87/21/1131478721.db2.gz VZUAGKUVDSTTKA-UHFFFAOYSA-N 1 0 290.426 3.858 20 10 CHCDRO Cc1c(C[NH+]2CCC(F)(F)CC2)c2ccccc2n1C ZINC001138252767 1131482579 /nfs/dbraw/zinc/48/25/79/1131482579.db2.gz TWBAUISWPWSETE-UHFFFAOYSA-N 1 0 278.346 3.718 20 10 CHCDRO Cc1c(C[NH+]2CCC3(CC3)CC2)c2ccccc2n1C ZINC001138253690 1131483116 /nfs/dbraw/zinc/48/31/16/1131483116.db2.gz CHTPNXPBGSNOIJ-UHFFFAOYSA-N 1 0 268.404 3.863 20 10 CHCDRO Cc1csc(C[NH2+]Cc2ccc(N(C)C)c(F)c2)c1 ZINC000824750045 1131483802 /nfs/dbraw/zinc/48/38/02/1131483802.db2.gz BNZOORGXRYDPKU-UHFFFAOYSA-N 1 0 278.396 3.551 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@](C)(OC)c1ccccc1)c1ccccc1O ZINC000824780327 1131484069 /nfs/dbraw/zinc/48/40/69/1131484069.db2.gz KMYRLARPSHJOKL-IEBWSBKVSA-N 1 0 299.414 3.995 20 10 CHCDRO Cc1cccc(C[NH2+]CC[C@@]2(C)CC2(Cl)Cl)c1O ZINC000824971728 1131492203 /nfs/dbraw/zinc/49/22/03/1131492203.db2.gz XPADIAFNZREOIR-ZDUSSCGKSA-N 1 0 288.218 3.764 20 10 CHCDRO CN1CCCc2cc(C[N@@H+]3CCC4(CCCC4)C3)ccc21 ZINC001138357828 1131493693 /nfs/dbraw/zinc/49/36/93/1131493693.db2.gz LWWFGYYBFUKOOP-UHFFFAOYSA-N 1 0 284.447 3.835 20 10 CHCDRO Cc1cccc(C[NH2+]C2(Cc3ccc(F)cc3)CC2)c1O ZINC000825017562 1131494535 /nfs/dbraw/zinc/49/45/35/1131494535.db2.gz USBWZYNAYLVXIZ-UHFFFAOYSA-N 1 0 285.362 3.705 20 10 CHCDRO CC[C@H]([NH2+]C1CCC(OC(F)F)CC1)c1ccccc1O ZINC000825143601 1131499814 /nfs/dbraw/zinc/49/98/14/1131499814.db2.gz GXYYGOFFVYACMG-YIZWMMSDSA-N 1 0 299.361 3.983 20 10 CHCDRO COC[C@H]1CCC[N@H+](Cc2cc(Cl)cc(C)c2O)CC1 ZINC000825321978 1131506266 /nfs/dbraw/zinc/50/62/66/1131506266.db2.gz TYIPKVXEYXMKPF-ZDUSSCGKSA-N 1 0 297.826 3.603 20 10 CHCDRO CS[C@H]1CC[C@@H]([NH2+]Cc2cc(Cl)c(C)cc2O)C1 ZINC000825320943 1131506327 /nfs/dbraw/zinc/50/63/27/1131506327.db2.gz QPISMYVCNIKGHP-NEPJUHHUSA-N 1 0 285.840 3.728 20 10 CHCDRO COC1CCC(C[NH2+]Cc2cc(Cl)c(C)cc2O)CC1 ZINC000825330639 1131507759 /nfs/dbraw/zinc/50/77/59/1131507759.db2.gz BDKWGGIMWKGNKP-UHFFFAOYSA-N 1 0 297.826 3.649 20 10 CHCDRO Cc1cc(C[N@H+]2C[C@@H]3CC(F)(F)C[C@@H]3C2)ccc1N(C)C ZINC001139669900 1131626442 /nfs/dbraw/zinc/62/64/42/1131626442.db2.gz CTGPFZAWAQEIKD-GASCZTMLSA-N 1 0 294.389 3.538 20 10 CHCDRO Cc1cc(C[N@H+]2CCC[C@H](C)[C@H]2C)ccc1N(C)C ZINC001139672313 1131626985 /nfs/dbraw/zinc/62/69/85/1131626985.db2.gz VLUNCWMXBTYENT-DZGCQCFKSA-N 1 0 260.425 3.681 20 10 CHCDRO COc1ccccc1C[N@H+](C)Cc1c(C)ccc(C)c1O ZINC001140180350 1131672979 /nfs/dbraw/zinc/67/29/79/1131672979.db2.gz VNNMHBQPBOLIQX-UHFFFAOYSA-N 1 0 285.387 3.650 20 10 CHCDRO Cc1ccc(C)c(C[N@H+](C)Cc2cccc(F)c2)c1O ZINC001140178355 1131673099 /nfs/dbraw/zinc/67/30/99/1131673099.db2.gz JIHZHMRWKXHBDG-UHFFFAOYSA-N 1 0 273.351 3.780 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cccc(C)c2F)c1 ZINC000845972549 1131673525 /nfs/dbraw/zinc/67/35/25/1131673525.db2.gz RQISXSSMDXNSCC-LBPRGKRZSA-N 1 0 289.350 3.699 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCOC3(CCCCC3)C2)c1O ZINC001140183709 1131674329 /nfs/dbraw/zinc/67/43/29/1131674329.db2.gz HWWSSDJAXLUOPA-UHFFFAOYSA-N 1 0 289.419 3.544 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H]2CC=C(C)CC2)c1 ZINC000845973082 1131674467 /nfs/dbraw/zinc/67/44/67/1131674467.db2.gz WVUYISUIVBIQNV-OLZOCXBDSA-N 1 0 261.365 3.550 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccsc2C)c1 ZINC000845973381 1131674996 /nfs/dbraw/zinc/67/49/96/1131674996.db2.gz ZOCPMWNQQJBQTF-JTQLQIEISA-N 1 0 277.389 3.622 20 10 CHCDRO C[C@@H]1C[C@H]1c1ccc(C[NH2+][C@H]2CCc3cccc(O)c32)o1 ZINC000834518166 1131681224 /nfs/dbraw/zinc/68/12/24/1131681224.db2.gz DYAWEPAUVMCXLD-DFBGVHRSSA-N 1 0 283.371 3.886 20 10 CHCDRO CN(C)c1ccc(C[NH2+]CC[C@@]2(C)C[C@@]2(F)Cl)cc1 ZINC000846036454 1131681640 /nfs/dbraw/zinc/68/16/40/1131681640.db2.gz LNWZMZFNQXYYCQ-GJZGRUSLSA-N 1 0 284.806 3.547 20 10 CHCDRO C[C@H](C[NH2+][C@@H]1CCc2cccc(O)c21)c1ccc(F)cc1 ZINC000834566411 1131684427 /nfs/dbraw/zinc/68/44/27/1131684427.db2.gz MOVKAHZKJXYPHX-MLGOLLRUSA-N 1 0 285.362 3.912 20 10 CHCDRO CC(C)[C@@H]1C[C@H]([NH2+]Cc2cc(Cl)ccc2O)CS1 ZINC000846054483 1131685469 /nfs/dbraw/zinc/68/54/69/1131685469.db2.gz BZEKFQFHSNGLNZ-JSGCOSHPSA-N 1 0 285.840 3.665 20 10 CHCDRO CCOCc1cc(C[NH2+][C@H](C)C(C)(C)C)ccc1OC ZINC000846107513 1131686364 /nfs/dbraw/zinc/68/63/64/1131686364.db2.gz IGHBBKWVTGIBQQ-CYBMUJFWSA-N 1 0 279.424 3.756 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CC[C@]3(CC3(F)F)C2)c(Cl)c1 ZINC000846117850 1131688100 /nfs/dbraw/zinc/68/81/00/1131688100.db2.gz RWJPIGWUHHHBAE-ZDUSSCGKSA-N 1 0 287.737 3.585 20 10 CHCDRO F[C@@H]1CCC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000846122514 1131689003 /nfs/dbraw/zinc/68/90/03/1131689003.db2.gz NIODENSVNNBKMV-MRXNPFEDSA-N 1 0 276.399 3.611 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CCSC(C)(C)C)c1O ZINC000846149317 1131691115 /nfs/dbraw/zinc/69/11/15/1131691115.db2.gz KTQQQXHCYBHDQD-NSHDSACASA-N 1 0 283.437 3.583 20 10 CHCDRO Cc1ccc(CC[NH2+][C@H]2CCc3cccc(O)c32)cc1 ZINC000834654504 1131691099 /nfs/dbraw/zinc/69/10/99/1131691099.db2.gz OOMVFAMKVFEXTI-INIZCTEOSA-N 1 0 267.372 3.520 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]C[C@@H](C)C(C)(C)C)c1O ZINC000846148434 1131691234 /nfs/dbraw/zinc/69/12/34/1131691234.db2.gz ZIGOHEVVVGOOSO-VXGBXAGGSA-N 1 0 265.397 3.734 20 10 CHCDRO CCC1(C[NH2+][C@H](C)c2cccc(OC)c2O)CCC1 ZINC000846150879 1131691238 /nfs/dbraw/zinc/69/12/38/1131691238.db2.gz SFWQLVOKVWSKCD-GFCCVEGCSA-N 1 0 263.381 3.632 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CC23CCC(CC2)C3)c1O ZINC000846156594 1131692117 /nfs/dbraw/zinc/69/21/17/1131692117.db2.gz GAGPLBXNDDKXFT-SFYCDEOASA-N 1 0 275.392 3.632 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H]2CCC(C)(C)C2)c1O ZINC000846157241 1131692419 /nfs/dbraw/zinc/69/24/19/1131692419.db2.gz BSJKAMPNRQKWCM-NWDGAFQWSA-N 1 0 263.381 3.630 20 10 CHCDRO CC(C)(C[NH2+][C@H]1CCc2cccc(O)c21)[C@H]1CCCCO1 ZINC000834680626 1131693508 /nfs/dbraw/zinc/69/35/08/1131693508.db2.gz CYDLMTYWJCUSEO-GOEBONIOSA-N 1 0 289.419 3.564 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@H](C)CCc2ccco2)c1O ZINC000846138959 1131693674 /nfs/dbraw/zinc/69/36/74/1131693674.db2.gz YRVPKXHBJSKXSX-CHWSQXEVSA-N 1 0 289.375 3.666 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@@H](c1cccnc1)C1CC1)CC2 ZINC000834693477 1131694131 /nfs/dbraw/zinc/69/41/31/1131694131.db2.gz OWSOUMZZFFBLED-MAUKXSAKSA-N 1 0 280.371 3.515 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCc2cccc(O)c21)c1c(C)noc1C ZINC000834692674 1131694519 /nfs/dbraw/zinc/69/45/19/1131694519.db2.gz GWZIKLGAGXMQLJ-KBPBESRZSA-N 1 0 286.375 3.725 20 10 CHCDRO CCc1ccc(C[NH2+][C@@H](C)c2cccc(OC)c2O)s1 ZINC000846140142 1131694682 /nfs/dbraw/zinc/69/46/82/1131694682.db2.gz HGPVAJQSSAFXDI-NSHDSACASA-N 1 0 291.416 3.876 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H]2CCC[C@@H](SC)C2)c1O ZINC000846145110 1131694855 /nfs/dbraw/zinc/69/48/55/1131694855.db2.gz MVZSQWKVKJTURR-RWMBFGLXSA-N 1 0 295.448 3.726 20 10 CHCDRO CO[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000846204188 1131695858 /nfs/dbraw/zinc/69/58/58/1131695858.db2.gz WXNXAIGRYJOJEA-NUEKZKHPSA-N 1 0 277.408 3.617 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)[C@](C)(O)c2ccccc2)c1 ZINC000846188666 1131697870 /nfs/dbraw/zinc/69/78/70/1131697870.db2.gz OGDPAMVRULKMGR-DOXZYTNZSA-N 1 0 299.414 3.647 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@](C)(O)c2ccccc2)c(O)c1 ZINC000846187844 1131697917 /nfs/dbraw/zinc/69/79/17/1131697917.db2.gz LPSNANGIFPGXFU-DOXZYTNZSA-N 1 0 299.414 3.647 20 10 CHCDRO Cc1ccc(C[NH+](C)C)cc1N[C@@H]1CCc2cccc(O)c21 ZINC000834755605 1131702167 /nfs/dbraw/zinc/70/21/67/1131702167.db2.gz GSERHPAEHJDTRX-MRXNPFEDSA-N 1 0 296.414 3.862 20 10 CHCDRO Oc1cccc(Cl)c1C[NH+]1CC(c2ccccc2)C1 ZINC001140341361 1131703186 /nfs/dbraw/zinc/70/31/86/1131703186.db2.gz JXMIFMSOBHFTPD-UHFFFAOYSA-N 1 0 273.763 3.645 20 10 CHCDRO CCC[C@@H](C[NH2+][C@@H](CC)c1ccc(C)cc1O)OC ZINC000834841500 1131710921 /nfs/dbraw/zinc/71/09/21/1131710921.db2.gz VAJDUNGWAGYZDM-ZFWWWQNUSA-N 1 0 265.397 3.556 20 10 CHCDRO CO[C@H](C[NH2+][C@H](C)c1ccc(C)cc1O)Cc1ccccc1 ZINC000834856651 1131712835 /nfs/dbraw/zinc/71/28/35/1131712835.db2.gz SVIPGLOHAGDMEO-WBVHZDCISA-N 1 0 299.414 3.609 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)CC(C)(C)O)c1cc(Cl)ccc1O ZINC000834876782 1131715981 /nfs/dbraw/zinc/71/59/81/1131715981.db2.gz OTPWQXBOEGBKEL-GWCFXTLKSA-N 1 0 285.815 3.636 20 10 CHCDRO CO[C@@](C)(C[NH2+][C@@H](C)c1ccccc1O)c1ccccc1 ZINC000834885074 1131718455 /nfs/dbraw/zinc/71/84/55/1131718455.db2.gz SVWLEXSMWYOCGY-KSSFIOAISA-N 1 0 285.387 3.605 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@]2(C)CC2(Cl)Cl)c1 ZINC000834885240 1131718571 /nfs/dbraw/zinc/71/85/71/1131718571.db2.gz UKTSEJKHUJSMQQ-GXFFZTMASA-N 1 0 288.218 3.935 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ncccc1C)c1ccc(N(C)C)cc1 ZINC000834885970 1131718596 /nfs/dbraw/zinc/71/85/96/1131718596.db2.gz ONKJOPOFXBOGFH-GOSISDBHSA-N 1 0 297.446 3.739 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCO[C@@H](C(C)C)C2)c(O)c1 ZINC000834886216 1131718643 /nfs/dbraw/zinc/71/86/43/1131718643.db2.gz QXKSNJNGMKIPTJ-HDMKZQKVSA-N 1 0 291.435 3.802 20 10 CHCDRO C[C@H]([NH2+][C@@H]1C[C@H](C)n2ccnc21)c1cc(Cl)ccc1O ZINC000834892699 1131719348 /nfs/dbraw/zinc/71/93/48/1131719348.db2.gz CSHULWRKEPQQRS-OUJBWJOFSA-N 1 0 291.782 3.599 20 10 CHCDRO CC[C@H]([NH2+][C@H]1C[C@@H](C)n2ccnc21)c1ccc(C)cc1O ZINC000834895823 1131720975 /nfs/dbraw/zinc/72/09/75/1131720975.db2.gz RVIDWFLDJIOEBP-SNPRPXQTSA-N 1 0 285.391 3.644 20 10 CHCDRO Cc1cc(C)c(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)cn1 ZINC000834903737 1131727430 /nfs/dbraw/zinc/72/74/30/1131727430.db2.gz QIVXZXDWUUAOFY-OAHLLOKOSA-N 1 0 284.403 3.872 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1COCC1(C)C)c1cc(Cl)ccc1O ZINC000834905783 1131727973 /nfs/dbraw/zinc/72/79/73/1131727973.db2.gz WLOLUZLVYDYMRJ-OCCSQVGLSA-N 1 0 283.799 3.511 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCOC(C)(C)C1)c1cc(Cl)ccc1O ZINC000834908926 1131730314 /nfs/dbraw/zinc/73/03/14/1131730314.db2.gz ISXCHWTYAFGMNG-NEPJUHHUSA-N 1 0 297.826 3.901 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1CCOC(C)(C)C1)c1ccccc1O ZINC000834911521 1131731335 /nfs/dbraw/zinc/73/13/35/1131731335.db2.gz TZZJOKHSOYTWCN-UKRRQHHQSA-N 1 0 277.408 3.638 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCOC(C)(C)C1)c1ccc(N(C)C)cc1 ZINC000834912354 1131731811 /nfs/dbraw/zinc/73/18/11/1131731811.db2.gz WHBMKKODEINOCR-LSDHHAIUSA-N 1 0 290.451 3.608 20 10 CHCDRO CCO[C@@H]1CCC[C@H]1[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000834914824 1131733801 /nfs/dbraw/zinc/73/38/01/1131733801.db2.gz WRJBXAFMAFJKPM-BPGGGUHBSA-N 1 0 293.382 3.627 20 10 CHCDRO CCO[C@@H]1CCC[C@H]1[NH2+][C@@H](C)c1ccc(N(C)CC)cc1 ZINC000834915324 1131733812 /nfs/dbraw/zinc/73/38/12/1131733812.db2.gz XGHWZDGBAWGJKH-BMGDILEWSA-N 1 0 290.451 3.751 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]CC2(C(F)(F)F)CC2)cc1 ZINC000835052751 1131766506 /nfs/dbraw/zinc/76/65/06/1131766506.db2.gz HIIKLTRTKBZXFQ-ARJAWSKDSA-N 1 0 298.352 3.698 20 10 CHCDRO CC(C)C1([NH2+]C/C=C\c2ccc(N(C)C)cc2)CC1 ZINC000835055453 1131767284 /nfs/dbraw/zinc/76/72/84/1131767284.db2.gz JWRNFBBUSFREQQ-WAYWQWQTSA-N 1 0 258.409 3.544 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc(O)c(C)c1 ZINC001140576268 1131801817 /nfs/dbraw/zinc/80/18/17/1131801817.db2.gz ODIPOCPWLAZCIR-UHFFFAOYSA-N 1 0 298.430 3.789 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC[C@H](Oc3ccccc3C)C2)c1 ZINC001140620904 1131831435 /nfs/dbraw/zinc/83/14/35/1131831435.db2.gz GAIXLOVFLYMJNH-KRWDZBQOSA-N 1 0 297.398 3.662 20 10 CHCDRO Cc1c(O)ccc(C[N@@H+]2CCc3ccccc3[C@@H]2C)c1O ZINC001140742412 1131905041 /nfs/dbraw/zinc/90/50/41/1131905041.db2.gz NIOWWMXGBUJAIB-ZDUSSCGKSA-N 1 0 283.371 3.526 20 10 CHCDRO CCC[N@H+](Cc1ccccc1)Cc1ccc(O)c(C)c1O ZINC001140745539 1131905920 /nfs/dbraw/zinc/90/59/20/1131905920.db2.gz KFIOHYSDAJVGMP-UHFFFAOYSA-N 1 0 285.387 3.818 20 10 CHCDRO CC(C)O[C@H](C[N@H+](C)Cc1ccccc1O)c1ccccc1 ZINC000794412482 1131919657 /nfs/dbraw/zinc/91/96/57/1131919657.db2.gz PJMPKRWVLJCZEA-LJQANCHMSA-N 1 0 299.414 3.990 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)COC2)c1ccc(N(C)C)cc1 ZINC000773077041 1131936666 /nfs/dbraw/zinc/93/66/66/1131936666.db2.gz BNNDDNLXZQUIDU-CQSZACIVSA-N 1 0 296.414 3.634 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H](CO)CC(C)(C)C)cc1 ZINC000773077556 1131936823 /nfs/dbraw/zinc/93/68/23/1131936823.db2.gz RXHNEDBUFBLJJU-ZBFHGGJFSA-N 1 0 292.467 3.590 20 10 CHCDRO CC[C@@H]([NH2+]CC1(C2CC2)CC1)c1ccc(N(C)C)cc1 ZINC000773098574 1131946573 /nfs/dbraw/zinc/94/65/73/1131946573.db2.gz MRNAIDLIWNFSIT-QGZVFWFLSA-N 1 0 272.436 3.984 20 10 CHCDRO CC[C@H](C)[N@H+](C)Cc1ccc(N(C)C)cc1Cl ZINC001140922074 1131963117 /nfs/dbraw/zinc/96/31/17/1131963117.db2.gz GPUUDJUYSCDHFN-NSHDSACASA-N 1 0 254.805 3.636 20 10 CHCDRO COc1ccc([C@H](C)[N@H+](C)Cc2ccc(C)cc2O)cc1 ZINC001140951009 1131971253 /nfs/dbraw/zinc/97/12/53/1131971253.db2.gz SXUSIZUJDZCWRZ-AWEZNQCLSA-N 1 0 285.387 3.902 20 10 CHCDRO CC[N@H+](Cc1cccs1)Cc1ccc(C)cc1O ZINC001140957481 1131974289 /nfs/dbraw/zinc/97/42/89/1131974289.db2.gz APOIMMPUNKQFIS-UHFFFAOYSA-N 1 0 261.390 3.784 20 10 CHCDRO COc1cc(O)c(C[NH+]2CCCCCCCC2)c(OC)c1 ZINC001141030842 1131988666 /nfs/dbraw/zinc/98/86/66/1131988666.db2.gz NIKATHDWYFKJGI-UHFFFAOYSA-N 1 0 293.407 3.566 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2ccns2)c1 ZINC000715964029 1131999851 /nfs/dbraw/zinc/99/98/51/1131999851.db2.gz CLEYIIDOCHDEFG-QWRGUYRKSA-N 1 0 262.378 3.569 20 10 CHCDRO CCc1cccc(C[NH2+]CC2C[C@H]3CC[C@@H](C2)S3)c1O ZINC000716040715 1132003547 /nfs/dbraw/zinc/00/35/47/1132003547.db2.gz UHCQMUQMVJPNTP-SFESLNEESA-N 1 0 291.460 3.718 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]CC1C[C@H]3CC[C@@H](C1)S3)CC2 ZINC000716059072 1132003810 /nfs/dbraw/zinc/00/38/10/1132003810.db2.gz IDMXPWXMKNODKX-CHEQUFIKSA-N 1 0 289.444 3.643 20 10 CHCDRO c1c(C[N@@H+]2CCC23CCCC3)cc2c3c1CCCN3CCC2 ZINC001141074933 1132005533 /nfs/dbraw/zinc/00/55/33/1132005533.db2.gz DWVTVSCZPCMNFX-UHFFFAOYSA-N 1 0 296.458 3.904 20 10 CHCDRO c1c(C[N@@H+]2CCCC23CC3)cc2c3c1CCCN3CCC2 ZINC001141074917 1132005928 /nfs/dbraw/zinc/00/59/28/1132005928.db2.gz WUDKBEFCWAUZGZ-UHFFFAOYSA-N 1 0 282.431 3.514 20 10 CHCDRO CC[N@H+](Cc1cc2c3c(c1)CCCN3CCC2)C(C)C ZINC001141074697 1132006256 /nfs/dbraw/zinc/00/62/56/1132006256.db2.gz RFZCDZUJRCAUJQ-UHFFFAOYSA-N 1 0 272.436 3.616 20 10 CHCDRO C[N@H+](Cc1cc2c3c(c1)CCCN3CCC2)C1CCCC1 ZINC001141076027 1132006480 /nfs/dbraw/zinc/00/64/80/1132006480.db2.gz KBHVRDXCPJDGSD-UHFFFAOYSA-N 1 0 284.447 3.760 20 10 CHCDRO CC[C@@H]1CC[N@H+](Cc2cc3c4c(c2)CCCN4CCC3)C1 ZINC001141079040 1132007906 /nfs/dbraw/zinc/00/79/06/1132007906.db2.gz QGCRFAUGQBAOCI-OAHLLOKOSA-N 1 0 284.447 3.617 20 10 CHCDRO Cc1ccccc1[C@@H]1CCC[N@@H+]1Cc1cc(O)ccc1O ZINC001141157918 1132029868 /nfs/dbraw/zinc/02/98/68/1132029868.db2.gz QGZXCRXVXOOKJN-KRWDZBQOSA-N 1 0 283.371 3.743 20 10 CHCDRO c1cc(C[NH2+]C2CCCCCCC2)cc2c1OCC2 ZINC000037362535 1132029924 /nfs/dbraw/zinc/02/99/24/1132029924.db2.gz GASJBHNUTGHBLG-UHFFFAOYSA-N 1 0 259.393 3.824 20 10 CHCDRO CCC[N@H+](Cc1ccccc1)Cc1cc(O)ccc1O ZINC001141158979 1132031232 /nfs/dbraw/zinc/03/12/32/1132031232.db2.gz UOLPSAGHCJILLX-UHFFFAOYSA-N 1 0 271.360 3.510 20 10 CHCDRO Cc1cccc(C[N@H+](Cc2cc(O)ccc2O)C2CC2)c1C ZINC001141162755 1132032281 /nfs/dbraw/zinc/03/22/81/1132032281.db2.gz CBVDINFECZBXDS-UHFFFAOYSA-N 1 0 297.398 3.879 20 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FHRZPWRRRAHTEL-UHFFFAOYSA-N 1 0 283.362 3.923 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+][C@H]2CCC[C@@H]3C[C@@H]32)cc1 ZINC000839190604 1132189624 /nfs/dbraw/zinc/18/96/24/1132189624.db2.gz INGQBXQFWBVIHN-GBMMQYMXSA-N 1 0 270.420 3.544 20 10 CHCDRO C[N@H+](Cc1coc2ccc(F)cc12)Cc1ccccc1O ZINC001141856728 1132258383 /nfs/dbraw/zinc/25/83/83/1132258383.db2.gz NUIPWYCTKXKSIW-UHFFFAOYSA-N 1 0 285.318 3.910 20 10 CHCDRO Cc1cc(C)c(C[NH2+]C2CC(C)(C)OC(C)(C)C2)c(O)c1 ZINC001172653067 1132289397 /nfs/dbraw/zinc/28/93/97/1132289397.db2.gz ZXKREHZZXNLBMC-UHFFFAOYSA-N 1 0 291.435 3.835 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCC[C@@H]2C[C@@H]21)c1cc(Cl)ccc1O ZINC000840820047 1132290789 /nfs/dbraw/zinc/29/07/89/1132290789.db2.gz IYBBVCMIGKUHBJ-GIFSMMMISA-N 1 0 265.784 3.885 20 10 CHCDRO CC[C@@H]1OCC[C@H]1[NH2+][C@H](C)c1cc(Cl)cc(C)c1O ZINC000840821581 1132291016 /nfs/dbraw/zinc/29/10/16/1132291016.db2.gz OGWVFPQEUJQLMT-HONMWMINSA-N 1 0 283.799 3.572 20 10 CHCDRO CO[C@@](C)([C@H](C)[NH2+][C@@H](C)c1ccc(N(C)C)cc1)C1CC1 ZINC000840861367 1132297988 /nfs/dbraw/zinc/29/79/88/1132297988.db2.gz VGHFJGGGKDGDEN-DEYYWGMASA-N 1 0 290.451 3.607 20 10 CHCDRO Oc1ccc(CC[NH2+]C2CCC3(CCCC3)CC2)cc1O ZINC001172725244 1132299349 /nfs/dbraw/zinc/29/93/49/1132299349.db2.gz JBLFYVKZKJMVAD-UHFFFAOYSA-N 1 0 289.419 3.733 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)C1(OC)CCC1)c1ccc(C)cc1O ZINC000840883911 1132302696 /nfs/dbraw/zinc/30/26/96/1132302696.db2.gz HDLCQBRRDONMCR-DZGCQCFKSA-N 1 0 277.408 3.699 20 10 CHCDRO CC[C@@H]([NH2+]CC(C)(C)c1cccnc1)c1ccccc1O ZINC000840891060 1132303730 /nfs/dbraw/zinc/30/37/30/1132303730.db2.gz FJBJRFDOVDQYGV-MRXNPFEDSA-N 1 0 284.403 3.806 20 10 CHCDRO C[C@H]([NH2+]CC(C)(C)c1cccnc1)c1cc(F)ccc1O ZINC000840890641 1132304703 /nfs/dbraw/zinc/30/47/03/1132304703.db2.gz CCRPLPUSWRSIJO-LBPRGKRZSA-N 1 0 288.366 3.555 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2CCC[C@@H](CO)C2)c1O ZINC000840893385 1132305963 /nfs/dbraw/zinc/30/59/63/1132305963.db2.gz GNAIOVYMHIKOEV-SCRDCRAPSA-N 1 0 297.826 3.556 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H]2CCOC3(CCC3)C2)c(Cl)c1 ZINC000840908581 1132308099 /nfs/dbraw/zinc/30/80/99/1132308099.db2.gz FSXXGZHRMYSGGC-LBPRGKRZSA-N 1 0 295.810 3.545 20 10 CHCDRO COC1CCC(C[NH2+]Cc2c(O)cc(C)cc2Cl)CC1 ZINC000840903787 1132308326 /nfs/dbraw/zinc/30/83/26/1132308326.db2.gz PVOSKGXKBLSWNO-UHFFFAOYSA-N 1 0 297.826 3.649 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]C1(c2ccc(F)cc2)CC1 ZINC000840934555 1132309348 /nfs/dbraw/zinc/30/93/48/1132309348.db2.gz SNOCFCGXDJVJOJ-UHFFFAOYSA-N 1 0 298.405 3.979 20 10 CHCDRO Cc1noc(C)c1[C@H](C)[NH2+]Cc1ccc(N(C)C)cc1C ZINC000840934652 1132310536 /nfs/dbraw/zinc/31/05/36/1132310536.db2.gz UNHJTCVCSVMOBH-LBPRGKRZSA-N 1 0 287.407 3.517 20 10 CHCDRO COCCC(C)(C)C[NH2+]Cc1c(O)cc(C)cc1Cl ZINC000840939729 1132310790 /nfs/dbraw/zinc/31/07/90/1132310790.db2.gz PBQWSDPZEVWBJT-UHFFFAOYSA-N 1 0 285.815 3.506 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1c2ccccc2O[C@H]1C ZINC000840947209 1132312332 /nfs/dbraw/zinc/31/23/32/1132312332.db2.gz RCOOFSDQYWFIBR-IFXJQAMLSA-N 1 0 296.414 3.673 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1c2ccccc2O[C@H]1C ZINC000840947213 1132312405 /nfs/dbraw/zinc/31/24/05/1132312405.db2.gz RCOOFSDQYWFIBR-LIRRHRJNSA-N 1 0 296.414 3.673 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](C)C2CC(C)C2)cc1Cl ZINC001231866682 1132375105 /nfs/dbraw/zinc/37/51/05/1132375105.db2.gz BUMISTCQJVZLSX-UHFFFAOYSA-N 1 0 253.773 3.584 20 10 CHCDRO C[C@H](CCc1ccccc1)C[NH2+]CCc1ccc(N)cc1 ZINC000841036549 1132321086 /nfs/dbraw/zinc/32/10/86/1132321086.db2.gz VABJIRJDQIUTOI-MRXNPFEDSA-N 1 0 282.431 3.670 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCCC[C@H]2c2cccnc2)c1O ZINC001231592304 1132321141 /nfs/dbraw/zinc/32/11/41/1132321141.db2.gz JAKAPIHTVFBCLX-KRWDZBQOSA-N 1 0 282.387 3.823 20 10 CHCDRO CCC1(C)CCC([NH2+]CCc2ccc(N)cc2)CC1 ZINC000841033760 1132321888 /nfs/dbraw/zinc/32/18/88/1132321888.db2.gz ALQVTOKITKRRFQ-UHFFFAOYSA-N 1 0 260.425 3.760 20 10 CHCDRO C[C@H](CCc1ccccc1F)[NH2+]CCc1ccc(N)cc1 ZINC000841037241 1132322917 /nfs/dbraw/zinc/32/29/17/1132322917.db2.gz ZHIPGVVPLLRBNZ-CQSZACIVSA-N 1 0 286.394 3.561 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CC[C@H]3CCC[C@@H]3C2)c(O)c1 ZINC001231844629 1132379126 /nfs/dbraw/zinc/37/91/26/1132379126.db2.gz OKYLYKCFJVBIDA-HUUCEWRRSA-N 1 0 259.393 3.631 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CC[C@H]2c2ccccc2)c(O)c1 ZINC001231845601 1132379347 /nfs/dbraw/zinc/37/93/47/1132379347.db2.gz CFAUHKKSSKHMEV-KRWDZBQOSA-N 1 0 267.372 3.956 20 10 CHCDRO COc1ccc2c(c1)C[N@@H+](Cc1c(C)cc(C)cc1O)C2 ZINC001231846954 1132380073 /nfs/dbraw/zinc/38/00/73/1132380073.db2.gz TXFMAAKEBYVQES-UHFFFAOYSA-N 1 0 283.371 3.533 20 10 CHCDRO CCC[NH+](CCC)Cc1cc(Cl)c(C)cc1O ZINC001231866248 1132380957 /nfs/dbraw/zinc/38/09/57/1132380957.db2.gz AXRKDYLOPJDRRC-UHFFFAOYSA-N 1 0 255.789 3.976 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](C)C2CCCC2)cc1Cl ZINC001231871166 1132384187 /nfs/dbraw/zinc/38/41/87/1132384187.db2.gz ZZOZNHSSQUBJLI-UHFFFAOYSA-N 1 0 253.773 3.728 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@H](CF)C2)cc1Cl ZINC001231870709 1132384534 /nfs/dbraw/zinc/38/45/34/1132384534.db2.gz PCYWTPXWYZEDCW-NSHDSACASA-N 1 0 271.763 3.536 20 10 CHCDRO C[C@H]([NH2+]CCc1ccco1)c1ccc(Cl)cc1O ZINC000841745172 1132387587 /nfs/dbraw/zinc/38/75/87/1132387587.db2.gz VQHYWLPQAZCQAE-JTQLQIEISA-N 1 0 265.740 3.532 20 10 CHCDRO Cc1nc(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)cs1 ZINC000841746090 1132390172 /nfs/dbraw/zinc/39/01/72/1132390172.db2.gz VLPYERKGVDEMDD-QMMMGPOBSA-N 1 0 282.796 3.661 20 10 CHCDRO Oc1c(C[NH+]2C[C@H]3CCC[C@@H]3C2)ccc2ccccc21 ZINC001231877991 1132391977 /nfs/dbraw/zinc/39/19/77/1132391977.db2.gz CMYLTBQBYVAFLN-HUUCEWRRSA-N 1 0 267.372 3.777 20 10 CHCDRO CCn1ccnc1[C@H](C)[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841756753 1132393817 /nfs/dbraw/zinc/39/38/17/1132393817.db2.gz JXWMBCWPLPBNOC-QWRGUYRKSA-N 1 0 293.798 3.674 20 10 CHCDRO CC[C@@](C)(C[NH2+][C@@H](C)c1ccc(Cl)cc1O)OC ZINC000841759012 1132393961 /nfs/dbraw/zinc/39/39/61/1132393961.db2.gz WXEKQMWKJXHUQM-HZMBPMFUSA-N 1 0 271.788 3.511 20 10 CHCDRO CC[C@@H](C[N@H+](Cc1ccccc1O)C1CCCC1)OC ZINC000842149094 1132410872 /nfs/dbraw/zinc/41/08/72/1132410872.db2.gz VZHOYHLROIYPME-INIZCTEOSA-N 1 0 277.408 3.562 20 10 CHCDRO CCCC[C@H](CC(C)C)[NH2+]CCc1ccc(O)c(O)c1 ZINC001173251202 1132421298 /nfs/dbraw/zinc/42/12/98/1132421298.db2.gz ZGTSWWXUUOADSN-OAHLLOKOSA-N 1 0 279.424 3.835 20 10 CHCDRO C[N@H+](Cc1ccccc1O)Cc1ccnc2c(F)cccc12 ZINC001232211340 1132437562 /nfs/dbraw/zinc/43/75/62/1132437562.db2.gz CQFZZQMDCFDQII-UHFFFAOYSA-N 1 0 296.345 3.712 20 10 CHCDRO C[C@@H]1CCC[C@@H](C)[NH+]1Cc1cc(Cl)c(O)cc1O ZINC001232257681 1132444642 /nfs/dbraw/zinc/44/46/42/1132444642.db2.gz GPMCZIQJLDWSJI-NXEZZACHSA-N 1 0 269.772 3.514 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CC[C@@H](C)C[C@H]2C)cc1Cl ZINC001232270214 1132446241 /nfs/dbraw/zinc/44/62/41/1132446241.db2.gz YQXHUUKFGMTATI-GHMZBOCLSA-N 1 0 283.799 3.675 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CCC23CCCCC3)cc1Cl ZINC001232267144 1132446582 /nfs/dbraw/zinc/44/65/82/1132446582.db2.gz XTJITYZWWDAJDG-UHFFFAOYSA-N 1 0 295.810 3.963 20 10 CHCDRO Cc1ccccc1C1([NH2+]Cc2ccc(N(C)C)c(F)c2)CC1 ZINC000842732468 1132455221 /nfs/dbraw/zinc/45/52/21/1132455221.db2.gz KVXMBTAIIOENLF-UHFFFAOYSA-N 1 0 298.405 3.979 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCS[C@H]1C)c1cc(Cl)ccc1O ZINC000842927346 1132476716 /nfs/dbraw/zinc/47/67/16/1132476716.db2.gz CHVPWNPJFPNAIE-TVYUQYBPSA-N 1 0 285.840 3.980 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCS[C@H]1C)c1cc(Cl)ccc1O ZINC000842927887 1132477663 /nfs/dbraw/zinc/47/76/63/1132477663.db2.gz GOAOHEAGTICRAJ-AUTRQRHGSA-N 1 0 271.813 3.590 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2CCS[C@@H]2C)c1O ZINC000842928826 1132478074 /nfs/dbraw/zinc/47/80/74/1132478074.db2.gz LTXWLLBKQZJTDO-OPQQBVKSSA-N 1 0 285.840 3.899 20 10 CHCDRO CC(C)(C)c1cccc(C[N@@H+]2CCC[C@H](CF)C2)c1O ZINC001143110324 1132503657 /nfs/dbraw/zinc/50/36/57/1132503657.db2.gz CTIMPWWIGUCMIE-CYBMUJFWSA-N 1 0 279.399 3.871 20 10 CHCDRO CO[C@H]1CC[N@H+](Cc2cccc(C(C)(C)C)c2O)[C@H](C)C1 ZINC001143117057 1132503695 /nfs/dbraw/zinc/50/36/95/1132503695.db2.gz RAPMIYMVUNJDBL-HIFRSBDPSA-N 1 0 291.435 3.689 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)Cc1ccnc(Cl)c1C ZINC001232758441 1132516977 /nfs/dbraw/zinc/51/69/77/1132516977.db2.gz YGBVHUWIXZDHME-UHFFFAOYSA-N 1 0 290.794 3.771 20 10 CHCDRO C[C@H]1c2ccccc2CC[N@H+]1Cc1ccc(N(C)C)cc1O ZINC001232833742 1132527859 /nfs/dbraw/zinc/52/78/59/1132527859.db2.gz DMXCCIREEJIFCP-AWEZNQCLSA-N 1 0 296.414 3.578 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+](Cc2ccc(C)nc2)CC2CC2)c1 ZINC000843422892 1132531150 /nfs/dbraw/zinc/53/11/50/1132531150.db2.gz IYHQFJFSBRXEHB-UHFFFAOYSA-N 1 0 296.414 3.816 20 10 CHCDRO CC[C@H]1CCCC[N@@H+]1Cc1c(O)cccc1Cl ZINC000131540792 1132568500 /nfs/dbraw/zinc/56/85/00/1132568500.db2.gz XXYNHXLOSRYUOJ-NSHDSACASA-N 1 0 253.773 3.810 20 10 CHCDRO CC(C)(C)c1ccc(O)c(C[NH+]2CC3(C2)CC(F)(F)C3)c1 ZINC001233284122 1132594757 /nfs/dbraw/zinc/59/47/57/1132594757.db2.gz JLWWDAPLMPGBTR-UHFFFAOYSA-N 1 0 295.373 3.921 20 10 CHCDRO 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3.957 20 10 CHCDRO C[C@@H](C[NH2+]Cc1ccc(Cl)cc1O)C(C)(C)C ZINC001207568699 1133820721 /nfs/dbraw/zinc/82/07/21/1133820721.db2.gz CJALWWQSNPZQDZ-JTQLQIEISA-N 1 0 255.789 3.817 20 10 CHCDRO CC[N@H+](CCCc1ccc(C)o1)Cc1ccccc1O ZINC001207952060 1133870674 /nfs/dbraw/zinc/87/06/74/1133870674.db2.gz IKAKESSPMBTBRR-UHFFFAOYSA-N 1 0 273.376 3.748 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(C[N@@H+]2CCCC(=O)CC2)cc1 ZINC001209516766 1134031516 /nfs/dbraw/zinc/03/15/16/1134031516.db2.gz NVKZQQAMLBVQTE-UHFFFAOYSA-N 1 0 296.414 3.649 20 10 CHCDRO CO[C@@H]1CCC[N@H+](Cc2ccc(-n3c(C)ccc3C)cc2)C1 ZINC001209517420 1134033683 /nfs/dbraw/zinc/03/36/83/1134033683.db2.gz DVIJFTRRZSDLAV-LJQANCHMSA-N 1 0 298.430 3.705 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(CN2CCC(=O)[C@@H](C)C2)cc1 ZINC001209519447 1134034309 /nfs/dbraw/zinc/03/43/09/1134034309.db2.gz UWQHDFDGOVAQKG-AWEZNQCLSA-N 1 0 296.414 3.505 20 10 CHCDRO CO[C@@H](C)C1C[NH+](Cc2ccc(-n3c(C)ccc3C)cc2)C1 ZINC001209520247 1134034849 /nfs/dbraw/zinc/03/48/49/1134034849.db2.gz SFDUZXKTGUZVLV-INIZCTEOSA-N 1 0 298.430 3.561 20 10 CHCDRO CC[C@H](C[NH2+]Cc1ccc(N(C)C)cc1)CC(F)(F)F ZINC000402506198 1134658207 /nfs/dbraw/zinc/65/82/07/1134658207.db2.gz BDQZQMCUHWHGJF-LBPRGKRZSA-N 1 0 288.357 3.821 20 10 CHCDRO CC[C@@H](C[NH2+]Cc1ccc2c(c1)CCO2)CC(F)(F)F ZINC000402659507 1134669484 /nfs/dbraw/zinc/66/94/84/1134669484.db2.gz KFELCNDLXOBLCD-LLVKDONJSA-N 1 0 287.325 3.690 20 10 CHCDRO C[C@@H]1C[C@H](Oc2ccc(NN=C3C=CC(=O)C=C3)cc2)C[NH2+]1 ZINC001218047744 1135049027 /nfs/dbraw/zinc/04/90/27/1135049027.db2.gz BJEBXWKUEDZQIS-PXAZEXFGSA-N 1 0 297.358 3.937 20 10 CHCDRO CC[C@@H](Oc1ccc(N2CC[NH2+]CC2)cc1)c1ccccc1 ZINC001218178233 1135064509 /nfs/dbraw/zinc/06/45/09/1135064509.db2.gz YNSZVIVDZHXCGL-LJQANCHMSA-N 1 0 296.414 3.626 20 10 CHCDRO CCC(CC)[C@@H](CC)Oc1ccc(N2CC[NH2+]CC2)cc1 ZINC001218295343 1135081386 /nfs/dbraw/zinc/08/13/86/1135081386.db2.gz FSJMIFTYFKVYPR-GOSISDBHSA-N 1 0 290.451 3.690 20 10 CHCDRO Cc1ccc([C@H](C)Oc2ccc(N3CC[NH2+]CC3)cc2)cc1 ZINC001218343903 1135090714 /nfs/dbraw/zinc/09/07/14/1135090714.db2.gz MGLXNAQCRGUFGS-INIZCTEOSA-N 1 0 296.414 3.545 20 10 CHCDRO C[C@@H]1[NH2+]C[C@H]1OC1=CC(=O)C=CC1=NNc1ccccc1 ZINC001218394512 1135098351 /nfs/dbraw/zinc/09/83/51/1135098351.db2.gz YGNUQSIOTLQSOH-VTJSOYEQSA-N 1 0 283.331 3.547 20 10 CHCDRO Cc1ccoc1C[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2C ZINC000312869632 1135136052 /nfs/dbraw/zinc/13/60/52/1135136052.db2.gz UAMXUMWBHZQOBI-STQMWFEESA-N 1 0 271.360 3.940 20 10 CHCDRO FC1(F)CC[C@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000315066509 1135150830 /nfs/dbraw/zinc/15/08/30/1135150830.db2.gz DYTDOVGJUCDGGR-HNNXBMFYSA-N 1 0 294.389 3.954 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccncc1)c1ccc2ccccc2c1O ZINC000315211067 1135151605 /nfs/dbraw/zinc/15/16/05/1135151605.db2.gz SFEPKCALTJZPLE-CQSZACIVSA-N 1 0 292.382 3.834 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@@H](C)c2ccc(Cl)cc2)c1 ZINC000020122033 171002021 /nfs/dbraw/zinc/00/20/21/171002021.db2.gz NOMRHAPEOJGYNU-NSHDSACASA-N 1 0 291.778 3.905 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccccc1O)c1cccc(Cl)c1 ZINC000020124194 171006288 /nfs/dbraw/zinc/00/62/88/171006288.db2.gz DXNSGRWPGBZKCU-LLVKDONJSA-N 1 0 261.752 3.896 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@H](C)c2ccccc2C)c1 ZINC000020126369 171010299 /nfs/dbraw/zinc/01/02/99/171010299.db2.gz OICYUGLQFFLLSF-CYBMUJFWSA-N 1 0 271.360 3.560 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2cccc(F)c2)c1 ZINC000020147929 171035424 /nfs/dbraw/zinc/03/54/24/171035424.db2.gz VAZVUEIAJBPOMY-NEPJUHHUSA-N 1 0 289.350 3.952 20 10 CHCDRO Nc1ccc(C[NH+]2CCC(Cc3ccccc3)CC2)cc1 ZINC000020191864 171058436 /nfs/dbraw/zinc/05/84/36/171058436.db2.gz BIWGVNAYKPHYHU-UHFFFAOYSA-N 1 0 280.415 3.724 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H]2CCCc3occc32)c1O ZINC000020204321 171069607 /nfs/dbraw/zinc/06/96/07/171069607.db2.gz SHYPWPQRMUKKTG-CQSZACIVSA-N 1 0 287.359 3.551 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2ccccn2)c1 ZINC000035628782 172307986 /nfs/dbraw/zinc/30/79/86/172307986.db2.gz JIVMJJFNBNQFQW-QWHCGFSZSA-N 1 0 256.349 3.507 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCCOC1)c1ccc2ccccc2c1O ZINC000038044031 174051618 /nfs/dbraw/zinc/05/16/18/174051618.db2.gz DCWDXJCFMJODSX-KGLIPLIRSA-N 1 0 285.387 3.623 20 10 CHCDRO Clc1ccccc1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000037362521 260094938 /nfs/dbraw/zinc/09/49/38/260094938.db2.gz ZZYFGINGDBDBHR-UHFFFAOYSA-N 1 0 273.763 3.565 20 10 CHCDRO COc1cccc(C2([NH2+]Cc3cc(C)c(C)cc3O)CC2)c1 ZINC000150910806 260975681 /nfs/dbraw/zinc/97/56/81/260975681.db2.gz OJIKNCXRVOCLSL-UHFFFAOYSA-N 1 0 297.398 3.797 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2c(C)noc2C)cc1 ZINC000153921085 261085022 /nfs/dbraw/zinc/08/50/22/261085022.db2.gz MNVODEWDNMYXQZ-GFCCVEGCSA-N 1 0 287.407 3.598 20 10 CHCDRO CCC(CC)(CCO)C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000155342249 261101267 /nfs/dbraw/zinc/10/12/67/261101267.db2.gz ZFEQOOZPDVVTDI-HNNXBMFYSA-N 1 0 292.467 3.592 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CCc2c1cccc2O)c1ccccc1O ZINC000155696750 261106155 /nfs/dbraw/zinc/10/61/55/261106155.db2.gz SMQOYOFOKPKQDN-CVEARBPZSA-N 1 0 283.371 3.826 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CC)c1ccccc1O)c1ccncc1 ZINC000156002423 261111306 /nfs/dbraw/zinc/11/13/06/261111306.db2.gz PPAGKJMBFCLIPT-CVEARBPZSA-N 1 0 270.376 3.979 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(C)cc(OC)c1)c1ccccc1O ZINC000156861871 261134141 /nfs/dbraw/zinc/13/41/41/261134141.db2.gz JWAYUQBKWXXYTF-KRWDZBQOSA-N 1 0 285.387 3.950 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CCCc2ccccn2)cc1 ZINC000181496679 261899139 /nfs/dbraw/zinc/89/91/39/261899139.db2.gz NFPOLPZJATZKAD-INIZCTEOSA-N 1 0 297.446 3.821 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)c1cc(Cl)ccc1O)c1ccccn1 ZINC000184845566 262030836 /nfs/dbraw/zinc/03/08/36/262030836.db2.gz JSOIYQYCKJDTOH-GHMZBOCLSA-N 1 0 276.767 3.852 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCCOC2CCCC2)c1 ZINC000185240519 262047808 /nfs/dbraw/zinc/04/78/08/262047808.db2.gz YRPVUANDBRPCAP-AWEZNQCLSA-N 1 0 277.408 3.701 20 10 CHCDRO Cc1noc(C)c1C[C@@H](C)[NH2+][C@H](C)c1ccc(C)cc1O ZINC000185501738 262057039 /nfs/dbraw/zinc/05/70/39/262057039.db2.gz TVWSZVLNEBLQAA-VXGBXAGGSA-N 1 0 288.391 3.587 20 10 CHCDRO Cc1noc(C)c1[C@@H](C)C[NH2+][C@H](C)c1ccc(C)cc1O ZINC000186158044 262082904 /nfs/dbraw/zinc/08/29/04/262082904.db2.gz PESAFQVXBDRGKM-NWDGAFQWSA-N 1 0 288.391 3.760 20 10 CHCDRO C[C@H](C[NH2+][C@@H](C)c1cc(Cl)ccc1O)c1nccs1 ZINC000186727277 262107045 /nfs/dbraw/zinc/10/70/45/262107045.db2.gz JJRMKFHIZBPUCG-ZJUUUORDSA-N 1 0 296.823 3.956 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+][C@H]1CCCc2sccc21 ZINC000185643114 262305134 /nfs/dbraw/zinc/30/51/34/262305134.db2.gz FSRJVTUPCVWPJF-ZDUSSCGKSA-N 1 0 277.364 3.760 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](C)c2nccs2)c(O)c1 ZINC000186743670 262322974 /nfs/dbraw/zinc/32/29/74/262322974.db2.gz ASYWDNLUZGAPPW-NWDGAFQWSA-N 1 0 276.405 3.611 20 10 CHCDRO C[C@@H]([NH2+]Cc1cc(-c2ccccc2)ccc1O)[C@H]1CCOC1 ZINC000266149683 262914497 /nfs/dbraw/zinc/91/44/97/262914497.db2.gz JZRHMFVKZXNGGZ-PBHICJAKSA-N 1 0 297.398 3.574 20 10 CHCDRO CC[C@@H]([NH2+]Cc1nccs1)c1cccc(Cl)c1[O-] ZINC000287850740 263103001 /nfs/dbraw/zinc/10/30/01/263103001.db2.gz WTFDQVCHMLTSIJ-LLVKDONJSA-N 1 0 282.796 3.743 20 10 CHCDRO Cc1cccc(C[NH2+]C(C)(C)c2ccccc2F)c1O ZINC000292718637 263134158 /nfs/dbraw/zinc/13/41/58/263134158.db2.gz DYPBWTRLIGFHIF-UHFFFAOYSA-N 1 0 273.351 3.865 20 10 CHCDRO CCc1noc(C)c1C[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000293867998 263151066 /nfs/dbraw/zinc/15/10/66/263151066.db2.gz ZKBOJNIZKBUAOQ-HNNXBMFYSA-N 1 0 288.391 3.800 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@@H]1CCc3c1cccc3F)CC2 ZINC000297946380 263212957 /nfs/dbraw/zinc/21/29/57/263212957.db2.gz YJACGXTVUACNFI-CVEARBPZSA-N 1 0 283.346 3.796 20 10 CHCDRO COc1cccc(C[NH2+][C@@H]2C[C@H](c3ccccc3)[C@H]2C)c1O ZINC000370560413 267328354 /nfs/dbraw/zinc/32/83/54/267328354.db2.gz YODKBIVPKCSAAH-XOKHGSTOSA-N 1 0 297.398 3.683 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1O)c1ccncc1 ZINC000185541877 327840654 /nfs/dbraw/zinc/84/06/54/327840654.db2.gz SRAKESJUTGGJFD-XHDPSFHLSA-N 1 0 274.339 3.728 20 10 CHCDRO COC[C@H]([NH2+][C@H](C)c1ccc(C)cc1O)c1ccc(C)o1 ZINC000185630799 327841584 /nfs/dbraw/zinc/84/15/84/327841584.db2.gz SLOMKYBQJJBJIL-HIFRSBDPSA-N 1 0 289.375 3.640 20 10 CHCDRO COc1ccc([C@@H](C)[NH2+][C@H](C)c2ccccc2O)cc1 ZINC000090339506 327094110 /nfs/dbraw/zinc/09/41/10/327094110.db2.gz MBTJCKHUELCVNA-CHWSQXEVSA-N 1 0 271.360 3.813 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CC[C@H]2C[C@H]2C1)c1cc(F)ccc1O ZINC000403360350 327156895 /nfs/dbraw/zinc/15/68/95/327156895.db2.gz MRCWYGATYOHJCW-QNWHQSFQSA-N 1 0 263.356 3.618 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H](C)[C@]1(C)CCCO1 ZINC000559901753 327270087 /nfs/dbraw/zinc/27/00/87/327270087.db2.gz FIAMFJRWTBPPMG-KDOFPFPSSA-N 1 0 286.419 3.534 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H]2[C@@H]3Cc4cc(Cl)ccc4[C@@H]32)c1 ZINC000527749723 330280941 /nfs/dbraw/zinc/28/09/41/330280941.db2.gz PMSOONDLKNIQCM-BPQIPLTHSA-N 1 0 299.801 3.782 20 10 CHCDRO Oc1ccccc1C[NH2+][C@H]1CCc2cc(F)c(Cl)cc21 ZINC000527858087 330288986 /nfs/dbraw/zinc/28/89/86/330288986.db2.gz ORACIJHKYPBFBL-HNNXBMFYSA-N 1 0 291.753 3.962 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H](C)C1(C)CC1 ZINC000479446130 331730177 /nfs/dbraw/zinc/73/01/77/331730177.db2.gz ALDJVOUMHCEMGR-CYBMUJFWSA-N 1 0 256.393 3.765 20 10 CHCDRO COCCC1CC[NH+](Cc2c(O)cc(C)cc2Cl)CC1 ZINC000529637286 333502350 /nfs/dbraw/zinc/50/23/50/333502350.db2.gz BFELZHDYYHNHDO-UHFFFAOYSA-N 1 0 297.826 3.603 20 10 CHCDRO CCC([NH2+]Cc1cc(F)ccc1O)(C1CC1)C1CC1 ZINC000529644055 333503252 /nfs/dbraw/zinc/50/32/52/333503252.db2.gz MJMFILOHOPYMDB-UHFFFAOYSA-N 1 0 263.356 3.590 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1CCC12CCOCC2 ZINC000548792177 334174380 /nfs/dbraw/zinc/17/43/80/334174380.db2.gz FNUPTTDVXJNZNW-GOSISDBHSA-N 1 0 298.430 3.536 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)[C@H]1CCOC1)c1ccc2ccccc2c1O ZINC000252814063 334394541 /nfs/dbraw/zinc/39/45/41/334394541.db2.gz SJFWPODATBDRFA-YDHLFZDLSA-N 1 0 285.387 3.621 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H]1C[C@@H](C)O[C@@H](C)C1 ZINC000556145738 334497435 /nfs/dbraw/zinc/49/74/35/334497435.db2.gz OXWLPSIQIDWMKX-NHAGDIPZSA-N 1 0 286.419 3.532 20 10 CHCDRO CC(C)(C)[C@@H]1C[C@H]([NH2+]Cc2c(O)cccc2Cl)CCO1 ZINC000270665618 518950091 /nfs/dbraw/zinc/95/00/91/518950091.db2.gz PHFCZVMSNGVLAD-ABAIWWIYSA-N 1 0 297.826 3.729 20 10 CHCDRO CC(C)n1ncc2c1[C@H]([NH2+][C@@H](C)c1ccccc1O)CCC2 ZINC000364882162 520079487 /nfs/dbraw/zinc/07/94/87/520079487.db2.gz KNAYBMFJKVPRCI-XJKSGUPXSA-N 1 0 299.418 3.898 20 10 CHCDRO CCOCc1ccccc1C[NH2+]Cc1cc(C)ccc1O ZINC000071408039 520214178 /nfs/dbraw/zinc/21/41/78/520214178.db2.gz KZNJDMABEHYJJQ-UHFFFAOYSA-N 1 0 285.387 3.527 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H]2CCSC2)cc1 ZINC000280208433 520287423 /nfs/dbraw/zinc/28/74/23/520287423.db2.gz VZDGMEOXBGCOKH-KBPBESRZSA-N 1 0 278.465 3.546 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2nc(C)cs2)cc1 ZINC000126210350 520287522 /nfs/dbraw/zinc/28/75/22/520287522.db2.gz ARRAAYYWVCCRQR-ZDUSSCGKSA-N 1 0 289.448 3.758 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+][C@H]2CCCc3occc32)c1 ZINC000237092711 521153815 /nfs/dbraw/zinc/15/38/15/521153815.db2.gz AKAHIWCBVRNWSV-HNNXBMFYSA-N 1 0 287.359 3.551 20 10 CHCDRO CC[N@H+](Cc1cc(C)c(C)cc1O)[C@@H](C)c1cccnc1 ZINC000290656203 521287225 /nfs/dbraw/zinc/28/72/25/521287225.db2.gz ZJAIZEKOEOIVQA-HNNXBMFYSA-N 1 0 284.403 3.987 20 10 CHCDRO CC[N@H+](Cc1cc(F)ccc1O)[C@@H](C)c1cccnc1 ZINC000290425154 521293784 /nfs/dbraw/zinc/29/37/84/521293784.db2.gz KZJKJHPXDNBAAR-LBPRGKRZSA-N 1 0 274.339 3.509 20 10 CHCDRO CCOc1cccc(C[NH2+][C@H](C)c2cc(C)ccc2O)c1 ZINC000037679526 521374369 /nfs/dbraw/zinc/37/43/69/521374369.db2.gz WCXWFCRLYYPWNG-CQSZACIVSA-N 1 0 285.387 3.950 20 10 CHCDRO CCc1cnc(C[NH2+][C@@H](CC)c2ccc(C)cc2O)s1 ZINC000279950039 522039655 /nfs/dbraw/zinc/03/96/55/522039655.db2.gz BTDYPUKYOBDQNJ-AWEZNQCLSA-N 1 0 290.432 3.960 20 10 CHCDRO CC[C@H]([NH2+]Cc1cn2ccc(C)cc2n1)c1ccccc1O ZINC000274912183 522662438 /nfs/dbraw/zinc/66/24/38/522662438.db2.gz NKXSPBJGQCMAAY-INIZCTEOSA-N 1 0 295.386 3.589 20 10 CHCDRO CC[C@H]([NH2+]Cc1nc(C)cs1)c1ccc(C)cc1O ZINC000280003406 522671078 /nfs/dbraw/zinc/67/10/78/522671078.db2.gz GDRWEBOWQPCEPR-ZDUSSCGKSA-N 1 0 276.405 3.706 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCCSC1)c1ccc(C)cc1O ZINC000280009299 522711386 /nfs/dbraw/zinc/71/13/86/522711386.db2.gz GPCHNJCGRROHCP-OCCSQVGLSA-N 1 0 265.422 3.637 20 10 CHCDRO CC[C@@H]([NH2+]CC1CCSCC1)c1ccc(C)cc1O ZINC000280065776 522823770 /nfs/dbraw/zinc/82/37/70/522823770.db2.gz KRAYTONFILKSDE-OAHLLOKOSA-N 1 0 279.449 3.885 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1COc2ccccc21)c1ccccc1O ZINC000289846616 522856631 /nfs/dbraw/zinc/85/66/31/522856631.db2.gz BBSPWPUSPVSTJL-CZUORRHYSA-N 1 0 283.371 3.609 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@](C)(OC)C1CC1)c1ccc(C)cc1O ZINC000291301164 522859815 /nfs/dbraw/zinc/85/98/15/522859815.db2.gz SKVIQRLRVNTEOW-NVXWUHKLSA-N 1 0 277.408 3.556 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cccc(O)c1)c1ccc(C)cc1O ZINC000280092288 522879701 /nfs/dbraw/zinc/87/97/01/522879701.db2.gz MOGJZXKEMYQZOT-MRXNPFEDSA-N 1 0 271.360 3.647 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cccc(OC)c1O)c1ccccc1 ZINC000051626383 522882509 /nfs/dbraw/zinc/88/25/09/522882509.db2.gz FAZSBRITBQAUNI-OAHLLOKOSA-N 1 0 271.360 3.642 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1ccccn1)c1ccc(C)cc1O ZINC000280119781 522913135 /nfs/dbraw/zinc/91/31/35/522913135.db2.gz OGQHVEPLVUHBEE-DZGCQCFKSA-N 1 0 270.376 3.898 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)C1CCOCC1)c1ccc(N(C)C)cc1 ZINC000126181951 522932965 /nfs/dbraw/zinc/93/29/65/522932965.db2.gz IPSCVVZBDWTYPB-RDTXWAMCSA-N 1 0 290.451 3.608 20 10 CHCDRO CO[C@@H](C)[C@@H](C)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000290234600 523431299 /nfs/dbraw/zinc/43/12/99/523431299.db2.gz RZZCKOGAOBSDNJ-AGIUHOORSA-N 1 0 273.376 3.619 20 10 CHCDRO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1ccccc1O ZINC000036961158 523853069 /nfs/dbraw/zinc/85/30/69/523853069.db2.gz XQNVCDPMAPHTQA-CYBMUJFWSA-N 1 0 271.360 3.560 20 10 CHCDRO C[C@H]1COCC[C@@H]1[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000277252227 524728243 /nfs/dbraw/zinc/72/82/43/524728243.db2.gz AHOJEAGKOMCLCQ-KSSFIOAISA-N 1 0 297.398 3.574 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(C)s2)c1 ZINC000050225149 524764497 /nfs/dbraw/zinc/76/44/97/524764497.db2.gz LCTIVRXSUJGLAL-LLVKDONJSA-N 1 0 277.389 3.622 20 10 CHCDRO C[C@@H](Cc1ccsc1)[NH2+][C@@H](C)c1ccccc1O ZINC000049154512 524941787 /nfs/dbraw/zinc/94/17/87/524941787.db2.gz BKRMWDVAUHISKD-RYUDHWBXSA-N 1 0 261.390 3.736 20 10 CHCDRO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(N(C)C)cc2)c2ccccc2O1 ZINC000295100750 525266888 /nfs/dbraw/zinc/26/68/88/525266888.db2.gz SSUQUENTNHWDSC-RDTXWAMCSA-N 1 0 296.414 3.755 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H](C)c2c(F)cncc2F)cc1C ZINC000285416392 525323018 /nfs/dbraw/zinc/32/30/18/525323018.db2.gz GETVSPWHZKDUHB-NSHDSACASA-N 1 0 292.329 3.533 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C2(c3ccccc3F)CC2)c1 ZINC000076766956 525346063 /nfs/dbraw/zinc/34/60/63/525346063.db2.gz VSGFTKYKTCJNEZ-UHFFFAOYSA-N 1 0 271.335 3.619 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C(C)(C)c2cccc(F)c2)c1 ZINC000076902060 525346940 /nfs/dbraw/zinc/34/69/40/525346940.db2.gz ZUUJCNATCUVQLB-UHFFFAOYSA-N 1 0 273.351 3.865 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H](c2ccccc2)C2CC2)c1 ZINC000071407672 525351899 /nfs/dbraw/zinc/35/18/99/525351899.db2.gz HMHIGFIZFAUOPZ-SFHVURJKSA-N 1 0 267.372 3.942 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2ccc(OC(F)F)cc2)c1 ZINC000071406622 525353544 /nfs/dbraw/zinc/35/35/44/525353544.db2.gz SCLQZSMLECNOQI-UHFFFAOYSA-N 1 0 293.313 3.592 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccccc2C)c1 ZINC000037718997 525364090 /nfs/dbraw/zinc/36/40/90/525364090.db2.gz KFCBEAGDRDQBMG-AWEZNQCLSA-N 1 0 255.361 3.860 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCCCO1)c1ccc2ccccc2c1O ZINC000042812042 525500876 /nfs/dbraw/zinc/50/08/76/525500876.db2.gz RRPOGFUDVOIKIR-UKRRQHHQSA-N 1 0 285.387 3.765 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cccc(F)c1F ZINC000121870374 525526885 /nfs/dbraw/zinc/52/68/85/525526885.db2.gz VRFZWZGORAARLG-GFCCVEGCSA-N 1 0 290.357 3.882 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1ccccn1 ZINC000037218845 525608247 /nfs/dbraw/zinc/60/82/47/525608247.db2.gz GJDMBMGVBMYBJA-UONOGXRCSA-N 1 0 269.392 3.559 20 10 CHCDRO C[C@H]([NH2+][C@H]1C[C@H](c2ccccc2)C1)c1ccccc1O ZINC000280699183 525637881 /nfs/dbraw/zinc/63/78/81/525637881.db2.gz CCRZKXUMJNLOMT-BPUTZDHNSA-N 1 0 267.372 3.989 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCOc2c(F)cccc21)c1ccccc1O ZINC000188053072 525688187 /nfs/dbraw/zinc/68/81/87/525688187.db2.gz FPJBANFGHHZTDK-ABAIWWIYSA-N 1 0 287.334 3.706 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCc2c1cccc2O)c1ccc(N(C)C)cc1 ZINC000130334182 525691366 /nfs/dbraw/zinc/69/13/66/525691366.db2.gz YHOIYGFUROTYOK-ACJLOTCBSA-N 1 0 296.414 3.796 20 10 CHCDRO Cc1csc(C2([NH2+]Cc3cc(C)ccc3O)CCC2)n1 ZINC000264946702 526325537 /nfs/dbraw/zinc/32/55/37/526325537.db2.gz JBIXNIRMKDKATR-UHFFFAOYSA-N 1 0 288.416 3.635 20 10 CHCDRO Oc1ccc(C[N@@H+](Cc2ccccc2O)CC2CC2)cc1 ZINC000289539734 526345307 /nfs/dbraw/zinc/34/53/07/526345307.db2.gz WRXZJYFHAGWCQK-UHFFFAOYSA-N 1 0 283.371 3.510 20 10 CHCDRO Oc1ccccc1C[NH2+][C@@H]1CCCc2ccc(F)cc21 ZINC000279936487 526374551 /nfs/dbraw/zinc/37/45/51/526374551.db2.gz YMHSRCOTQQERMV-MRXNPFEDSA-N 1 0 271.335 3.699 20 10 CHCDRO Clc1cccc(C[NH2+]Cc2ccc3c(c2)CCO3)c1 ZINC000048400259 526976375 /nfs/dbraw/zinc/97/63/75/526976375.db2.gz APIUZKCRNGALSB-UHFFFAOYSA-N 1 0 273.763 3.565 20 10 CHCDRO Cc1cc(C[NH2+]Cc2ccc(N(C)C)cc2C)cs1 ZINC000823848274 1131444391 /nfs/dbraw/zinc/44/43/91/1131444391.db2.gz RMYUZQIGOHDVEI-UHFFFAOYSA-N 1 0 274.433 3.721 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)C1CCC1 ZINC000129006424 1118747536 /nfs/dbraw/zinc/74/75/36/1118747536.db2.gz AAKLISNMQUHXFK-AWEZNQCLSA-N 1 0 258.409 3.565 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H]2CCCc3occc32)cc1F ZINC000113320816 1125494261 /nfs/dbraw/zinc/49/42/61/1125494261.db2.gz YNTDYNUPTWYSOF-HNNXBMFYSA-N 1 0 288.366 3.652 20 10 CHCDRO Oc1ccccc1C[NH+]1CCC2(CCCCC2)CC1 ZINC000133919000 1125505798 /nfs/dbraw/zinc/50/57/98/1125505798.db2.gz GGHIQFYLOWWCQX-UHFFFAOYSA-N 1 0 259.393 3.939 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cscn1)c1cc(Cl)ccc1O ZINC000775500086 1122627483 /nfs/dbraw/zinc/62/74/83/1122627483.db2.gz NVWRGGJMMJIFKR-GFCCVEGCSA-N 1 0 282.796 3.743 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1COC(C)(C)C1)c1cc(Cl)ccc1O ZINC000850483241 1123274030 /nfs/dbraw/zinc/27/40/30/1123274030.db2.gz VLCKEIUTWODJKD-WCQYABFASA-N 1 0 283.799 3.654 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)C1(C)CC1)c1ccc(N(C)C)cc1 ZINC000776884132 1123559909 /nfs/dbraw/zinc/55/99/09/1123559909.db2.gz ZKIMEWUKEFFRPN-CZUORRHYSA-N 1 0 260.425 3.982 20 10 CHCDRO CC(C)[C@@H]1C[C@@H]([NH2+][C@@H](C)c2ccccc2O)CS1 ZINC000877758124 1125073706 /nfs/dbraw/zinc/07/37/06/1125073706.db2.gz JRPUOBGIXFNZLH-ZOWXZIJZSA-N 1 0 265.422 3.573 20 10 CHCDRO C[C@H]1CC[C@H]([N@H+](C)Cc2cc(F)ccc2O)CC1 ZINC001140056395 1131659484 /nfs/dbraw/zinc/65/94/84/1131659484.db2.gz VCNQFWWOCRLICN-YEORSEQZSA-N 1 0 251.345 3.542 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCCC(F)(F)C1)c1ccccc1O ZINC000282753119 1131892774 /nfs/dbraw/zinc/89/27/74/1131892774.db2.gz NUZSSLRJUNBSIV-NWDGAFQWSA-N 1 0 269.335 3.868 20 10 CHCDRO CC[C@H]([NH2+]CCCSc1nccs1)[C@@H]1C[C@H]1C ZINC000840720954 1132276725 /nfs/dbraw/zinc/27/67/25/1132276725.db2.gz BENSIGSOPMAWIN-UTUOFQBUSA-N 1 0 270.467 3.650 20 10 CHCDRO CCc1cnc(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)s1 ZINC000841755678 1132392346 /nfs/dbraw/zinc/39/23/46/1132392346.db2.gz QSFDKHQWOXXWPB-VIFPVBQESA-N 1 0 296.823 3.915 20 10 CHCDRO Oc1cccc2c1C[N@H+](Cc1cc(Cl)cs1)CC2 ZINC001232280047 1132448618 /nfs/dbraw/zinc/44/86/18/1132448618.db2.gz KVFVAQBDHLACEP-UHFFFAOYSA-N 1 0 279.792 3.665 20 10 CHCDRO Cc1c(Cl)cc(Nc2cc[nH+]cc2)c(O)c1Cl ZINC001173884369 1132624821 /nfs/dbraw/zinc/62/48/21/1132624821.db2.gz FXUBTIFGXNZDKM-UHFFFAOYSA-N 1 0 269.131 3.568 20 10 CHCDRO C[C@@H]1CC[C@H]([NH2+]Cc2cc(Cl)ccc2O)C[C@H]1C ZINC000251983469 1125530953 /nfs/dbraw/zinc/53/09/53/1125530953.db2.gz YVTIHNGCIJUMQJ-GYSYKLTISA-N 1 0 267.800 3.960 20 10 CHCDRO 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ZINC000293625964 1127509485 /nfs/dbraw/zinc/50/94/85/1127509485.db2.gz LAUFXWKBDPTIRP-UHFFFAOYSA-N 1 0 294.782 3.536 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CC2CC(F)(F)C2)cc1 ZINC000293712048 1127514280 /nfs/dbraw/zinc/51/42/80/1127514280.db2.gz OYELGJORKCFDBN-GFCCVEGCSA-N 1 0 282.378 3.839 20 10 CHCDRO COc1cc(Cl)cc(C[NH+](CC2CC2)CC2CC2)c1O ZINC000761203408 1127520043 /nfs/dbraw/zinc/52/00/43/1127520043.db2.gz REHGPFPKTGFQBI-UHFFFAOYSA-N 1 0 295.810 3.676 20 10 CHCDRO Nc1ccc(C[N@@H+]2CCC[C@@]3(CC=CCC3)C2)cc1 ZINC001120370990 1127521546 /nfs/dbraw/zinc/52/15/46/1127521546.db2.gz LWUQCQQQUIUNQB-KRWDZBQOSA-N 1 0 256.393 3.591 20 10 CHCDRO CC(C)([NH2+]Cc1ccc(N)cc1)c1ccc(F)c(F)c1 ZINC001120371450 1127521947 /nfs/dbraw/zinc/52/19/47/1127521947.db2.gz YWRYSPSDWIUIPD-UHFFFAOYSA-N 1 0 276.330 3.572 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@](C)(O)c2ccccc2)c(O)c1 ZINC000293922942 1127534084 /nfs/dbraw/zinc/53/40/84/1127534084.db2.gz XLNJZMOEKAGHBJ-BEFAXECRSA-N 1 0 299.414 3.567 20 10 CHCDRO CCc1nc(C)c(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)o1 ZINC000294050244 1127545424 /nfs/dbraw/zinc/54/54/24/1127545424.db2.gz GQJTWTRJUYBYQV-CYBMUJFWSA-N 1 0 288.391 3.719 20 10 CHCDRO CC[C@H](C)C[N@H+](C)Cc1cc(Cl)cc(OC)c1O ZINC000228629760 1127576580 /nfs/dbraw/zinc/57/65/80/1127576580.db2.gz PLRNPRFMKKGAEL-JTQLQIEISA-N 1 0 271.788 3.532 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]C[C@H]2CCCCC2(F)F)c1 ZINC000295134113 1127622775 /nfs/dbraw/zinc/62/27/75/1127622775.db2.gz OZGLQWMWJSKRLH-CYBMUJFWSA-N 1 0 299.361 3.706 20 10 CHCDRO C[C@H](CCO)CC[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000295200569 1127626972 /nfs/dbraw/zinc/62/69/72/1127626972.db2.gz YQIIWMLDRZIMDW-HNNXBMFYSA-N 1 0 299.414 3.557 20 10 CHCDRO CCOc1ccccc1C[NH2+][C@H]1CCc2cccc(O)c21 ZINC000295877584 1127656540 /nfs/dbraw/zinc/65/65/40/1127656540.db2.gz HNJDATDHVBFFHR-HNNXBMFYSA-N 1 0 283.371 3.568 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCC(C)(F)F)cc1 ZINC000296240630 1127665842 /nfs/dbraw/zinc/66/58/42/1127665842.db2.gz ASVATRBYXGVRID-GFCCVEGCSA-N 1 0 270.367 3.839 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1ccncc1 ZINC000296241943 1127666415 /nfs/dbraw/zinc/66/64/15/1127666415.db2.gz ATYCAGRNHNKLMQ-LSDHHAIUSA-N 1 0 268.360 3.515 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1ccncc1 ZINC000296241937 1127666607 /nfs/dbraw/zinc/66/66/07/1127666607.db2.gz ATYCAGRNHNKLMQ-HUUCEWRRSA-N 1 0 268.360 3.515 20 10 CHCDRO CC[C@@H]([NH2+]CCc1scnc1C)c1ccc(C)cc1O ZINC000296390805 1127670828 /nfs/dbraw/zinc/67/08/28/1127670828.db2.gz KBENSUYUJCAVTP-CQSZACIVSA-N 1 0 290.432 3.749 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCCc2ncccc2C)c(O)c1 ZINC000296530626 1127674691 /nfs/dbraw/zinc/67/46/91/1127674691.db2.gz QIYGVQYHQYLARJ-HNNXBMFYSA-N 1 0 284.403 3.687 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]C1(c3cccc(F)c3)CC1)CC2 ZINC000296644278 1127680152 /nfs/dbraw/zinc/68/01/52/1127680152.db2.gz DAQKWSHKTXIYGY-HNNXBMFYSA-N 1 0 283.346 3.798 20 10 CHCDRO COc1cccc(C2([NH2+][C@@H]3CCc4cccc(O)c43)CC2)c1 ZINC000297118456 1127689228 /nfs/dbraw/zinc/68/92/28/1127689228.db2.gz YKZSYICCMSOVEM-MRXNPFEDSA-N 1 0 295.382 3.667 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CC[C@@H](C)C1)c1cc(F)ccc1O ZINC000230413077 1127752115 /nfs/dbraw/zinc/75/21/15/1127752115.db2.gz WCRLUSGGDHFJDC-UTUOFQBUSA-N 1 0 251.345 3.618 20 10 CHCDRO CC(C)C[C@H](O)C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000230660046 1127771453 /nfs/dbraw/zinc/77/14/53/1127771453.db2.gz SYCVKNABKBPLRG-ZFWWWQNUSA-N 1 0 287.403 3.603 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@]2(C)CCO[C@@H]2C2CC2)c(O)c1 ZINC000372096558 1127787910 /nfs/dbraw/zinc/78/79/10/1127787910.db2.gz TVVFVUIGFJCCSA-MORSLUCNSA-N 1 0 289.419 3.556 20 10 CHCDRO C[C@H](CCCO)C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000296577964 1129222501 /nfs/dbraw/zinc/22/25/01/1129222501.db2.gz UBTPESOIDBLCAL-KGLIPLIRSA-N 1 0 287.403 3.605 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCS[C@@H](c2ccccc2)C1 ZINC000374260489 1127882134 /nfs/dbraw/zinc/88/21/34/1127882134.db2.gz WGKCUTYBZHCLFV-QGZVFWFLSA-N 1 0 285.412 3.682 20 10 CHCDRO CCSCCC[NH2+][C@H](C)c1ccc(N(C)CC)cc1 ZINC000800492301 1127900178 /nfs/dbraw/zinc/90/01/78/1127900178.db2.gz HKEHVMATSNDCIO-CQSZACIVSA-N 1 0 280.481 3.937 20 10 CHCDRO C[C@H](Cc1cccs1)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000035253932 1127904409 /nfs/dbraw/zinc/90/44/09/1127904409.db2.gz OKTIFYBEOZOTCJ-CYBMUJFWSA-N 1 0 274.433 3.535 20 10 CHCDRO CC[C@@H](C[NH2+][C@@H](C)c1ccc2ccccc2c1O)OC ZINC000290214331 1127939064 /nfs/dbraw/zinc/93/90/64/1127939064.db2.gz QEBIBHBLDLMEHJ-JSGCOSHPSA-N 1 0 273.376 3.621 20 10 CHCDRO Cc1cnc([C@H](C)[NH2+]Cc2cc(Cl)ccc2O)s1 ZINC000134906530 1128091125 /nfs/dbraw/zinc/09/11/25/1128091125.db2.gz WQGGKBFGDMZGDA-VIFPVBQESA-N 1 0 282.796 3.661 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)[C@@H]1CCc2cc(F)ccc2C1 ZINC001168444759 1128098247 /nfs/dbraw/zinc/09/82/47/1128098247.db2.gz GYFSEHOZROBKMK-GOSISDBHSA-N 1 0 299.389 3.911 20 10 CHCDRO CCC[C@H](CCO)C[NH2+][C@@H](CC)c1ccc(N(C)C)cc1 ZINC000152473878 1128127252 /nfs/dbraw/zinc/12/72/52/1128127252.db2.gz TYKWSQWODQCOLV-QAPCUYQASA-N 1 0 292.467 3.592 20 10 CHCDRO COc1ccc(C[NH2+]CCC2=CCCCC2)cc1C ZINC000035052319 1128253265 /nfs/dbraw/zinc/25/32/65/1128253265.db2.gz UKHFTYPALBIDKJ-UHFFFAOYSA-N 1 0 259.393 3.984 20 10 CHCDRO CC[C@H]([NH2+][C@H](c1cnn(C)c1)C(C)C)c1ccccc1O ZINC000927071020 1128215559 /nfs/dbraw/zinc/21/55/59/1128215559.db2.gz RUWOGLPKVKMNEG-RDJZCZTQSA-N 1 0 287.407 3.564 20 10 CHCDRO C[C@H]([NH2+]C1([C@@H]2CCCCO2)CC1)c1ccc(Cl)cc1O ZINC000927156691 1128223408 /nfs/dbraw/zinc/22/34/08/1128223408.db2.gz BETMHRSQWZUDCM-NHYWBVRUSA-N 1 0 295.810 3.798 20 10 CHCDRO COc1cc(C)c(C)cc1C[N@H+](C)Cc1ccccc1O ZINC001238768402 1131242817 /nfs/dbraw/zinc/24/28/17/1131242817.db2.gz VZKGXTNMJCGBKQ-UHFFFAOYSA-N 1 0 285.387 3.650 20 10 CHCDRO Cc1nc(C)c(C[N@H+](Cc2ccccc2O)C2CCCC2)[nH]1 ZINC000929634226 1128280847 /nfs/dbraw/zinc/28/08/47/1128280847.db2.gz BCHZHZOVYAUOEX-UHFFFAOYSA-N 1 0 299.418 3.677 20 10 CHCDRO CC[C@@H](c1cccc(OC)c1)[N@H+](C)Cc1ccccc1O ZINC000777824986 1128288679 /nfs/dbraw/zinc/28/86/79/1128288679.db2.gz MPCLTEFAULIFBH-KRWDZBQOSA-N 1 0 285.387 3.984 20 10 CHCDRO CC[C@H]1CCC[N@H+](Cc2cc3c(cc2O)CCC3)C1 ZINC000915205270 1128290772 /nfs/dbraw/zinc/29/07/72/1128290772.db2.gz AESGSXURNUVIMI-ZDUSSCGKSA-N 1 0 259.393 3.503 20 10 CHCDRO CC(C)[C@@H](C)[N@H+](C)Cc1cc(C(C)(C)C)cc(O)c1O ZINC000915209851 1128292241 /nfs/dbraw/zinc/29/22/41/1128292241.db2.gz VFFLTJFPZRORLD-GFCCVEGCSA-N 1 0 279.424 3.872 20 10 CHCDRO Cc1ccc(CC[NH2+]Cc2ccc(N3CCCCC3)cc2)o1 ZINC000915229115 1128293581 /nfs/dbraw/zinc/29/35/81/1128293581.db2.gz WDTPXGHKBZSBRI-UHFFFAOYSA-N 1 0 298.430 3.911 20 10 CHCDRO CCc1cccc(C[N@H+](C)C2CCC(F)(F)CC2)c1O ZINC000699569410 1128295160 /nfs/dbraw/zinc/29/51/60/1128295160.db2.gz KJRQHLNCHHSYCN-UHFFFAOYSA-N 1 0 283.362 3.964 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](CC)C2CCCC2)c1 ZINC000153678808 1128332817 /nfs/dbraw/zinc/33/28/17/1128332817.db2.gz OUWWIMYFANJMMI-UHFFFAOYSA-N 1 0 263.381 3.555 20 10 CHCDRO CC[N@H+](Cc1cc(C)cc(OC)c1O)C1CCCCC1 ZINC000915793496 1128338798 /nfs/dbraw/zinc/33/87/98/1128338798.db2.gz SECFMAUYTHHFII-UHFFFAOYSA-N 1 0 277.408 3.864 20 10 CHCDRO CC(C)(C)c1ccc(C[NH+]2CC3CC(C3)C2)c(O)c1 ZINC001235678141 1128347265 /nfs/dbraw/zinc/34/72/65/1128347265.db2.gz AHRKPHXUILIPKY-UHFFFAOYSA-N 1 0 259.393 3.532 20 10 CHCDRO Cc1ccc(F)c(C[NH2+][C@@H](C)c2ccccc2O)c1F ZINC000931555339 1128369060 /nfs/dbraw/zinc/36/90/60/1128369060.db2.gz XRLYKCUPEWKNQO-NSHDSACASA-N 1 0 277.314 3.830 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]C2(Cc3ccccc3)CC2)c1 ZINC000187493312 1128460602 /nfs/dbraw/zinc/46/06/02/1128460602.db2.gz OOSFRNCVRUHBDS-UHFFFAOYSA-N 1 0 297.398 3.656 20 10 CHCDRO COc1cc(C)cc(C[N@H+](C)[C@H](C)c2ccccc2)c1O ZINC000917075128 1128474783 /nfs/dbraw/zinc/47/47/83/1128474783.db2.gz HCMDFSPRKZZGQB-CQSZACIVSA-N 1 0 285.387 3.902 20 10 CHCDRO CC1CCC([N@H+](C)Cc2c(O)ccc3ccncc32)CC1 ZINC000917456716 1128501209 /nfs/dbraw/zinc/50/12/09/1128501209.db2.gz UTDJLYZSMYMMJX-UHFFFAOYSA-N 1 0 284.403 3.951 20 10 CHCDRO CCOc1cccc(C[NH2+]C[C@H]2CCCC[C@@H]2C)c1O ZINC000042857214 1128587882 /nfs/dbraw/zinc/58/78/82/1128587882.db2.gz PYMOMRGWASGQAJ-UONOGXRCSA-N 1 0 277.408 3.707 20 10 CHCDRO CN(C)c1ccc(C[NH2+]Cc2ccc(Cl)c(F)c2)cc1 ZINC000043388552 1128603587 /nfs/dbraw/zinc/60/35/87/1128603587.db2.gz SZCYHSVGSXHASP-UHFFFAOYSA-N 1 0 292.785 3.835 20 10 CHCDRO CC[C@@H]([NH2+]C[C@](C)(O)CCC(C)C)c1ccccc1O ZINC000155971604 1128621479 /nfs/dbraw/zinc/62/14/79/1128621479.db2.gz QEDWMQIUGNLSMH-NVXWUHKLSA-N 1 0 279.424 3.620 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCC[C@H]3CCC[C@@H]32)c1O ZINC000156039467 1128623530 /nfs/dbraw/zinc/62/35/30/1128623530.db2.gz HBAIIESLPVJOEN-HIFRSBDPSA-N 1 0 275.392 3.555 20 10 CHCDRO CCc1cnc(CC[NH2+][C@H](CC)c2ccccc2O)s1 ZINC000156089097 1128624794 /nfs/dbraw/zinc/62/47/94/1128624794.db2.gz ISZVXIQFNIFBNQ-CQSZACIVSA-N 1 0 290.432 3.695 20 10 CHCDRO CCc1ccc(C[N@H+](C)Cc2cc(F)ccc2O)cc1 ZINC000778993986 1128674424 /nfs/dbraw/zinc/67/44/24/1128674424.db2.gz ZZXRPFYWBMICIW-UHFFFAOYSA-N 1 0 273.351 3.726 20 10 CHCDRO C[N@@H+](Cc1cc(F)ccc1O)Cc1ccccc1Cl ZINC000778992864 1128674833 /nfs/dbraw/zinc/67/48/33/1128674833.db2.gz KZVONNFQYJTODC-UHFFFAOYSA-N 1 0 279.742 3.817 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCC[C@@H]1Cc1ccc(F)cc1 ZINC000778998139 1128675391 /nfs/dbraw/zinc/67/53/91/1128675391.db2.gz IPWXLVCDWLCLNC-QGZVFWFLSA-N 1 0 285.362 3.738 20 10 CHCDRO Cc1ccc([C@@H]([NH2+]Cc2ccccc2O)C2CC2)cc1 ZINC000134226240 1128706247 /nfs/dbraw/zinc/70/62/47/1128706247.db2.gz WMXKEAHWNCKQOM-GOSISDBHSA-N 1 0 267.372 3.942 20 10 CHCDRO c1ccc2c(c1)OCC[C@H]2[NH2+]Cc1ccc2c(c1)CCCO2 ZINC000921487147 1128709615 /nfs/dbraw/zinc/70/96/15/1128709615.db2.gz CERBYFRINNUTNT-QGZVFWFLSA-N 1 0 295.382 3.625 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+][C@@H](c1cccs1)C1CC1 ZINC000779052672 1128710252 /nfs/dbraw/zinc/71/02/52/1128710252.db2.gz RFCOKLBYDQYBSO-OAHLLOKOSA-N 1 0 277.364 3.834 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CCCSC1)c1ccc(N(C)C)cc1 ZINC000159583782 1128712149 /nfs/dbraw/zinc/71/21/49/1128712149.db2.gz FVRJYHVMFWRVDB-GOEBONIOSA-N 1 0 278.465 3.689 20 10 CHCDRO CC[C@H]([NH2+]CC(C)(C)C[C@@H](C)O)c1ccc(N(C)C)cc1 ZINC000090086216 1128718444 /nfs/dbraw/zinc/71/84/44/1128718444.db2.gz JTDSZYIGUSTHQZ-PBHICJAKSA-N 1 0 292.467 3.590 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+][C@H]2CC23CCCC3)c1O ZINC000763458870 1128730915 /nfs/dbraw/zinc/73/09/15/1128730915.db2.gz SJZZYYLOSRNMEA-ZDUSSCGKSA-N 1 0 265.784 3.776 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCc2c(F)cccc2F)c1 ZINC000185067608 1117759368 /nfs/dbraw/zinc/75/93/68/1117759368.db2.gz YYCFOQWWYBFZCO-LBPRGKRZSA-N 1 0 291.341 3.872 20 10 CHCDRO Cc1cccc(C[NH2+][C@H](C)c2cc3c(cc2O)CCCC3)n1 ZINC000185086071 1117761251 /nfs/dbraw/zinc/76/12/51/1117761251.db2.gz ZVSDLQAJQWSVQV-CQSZACIVSA-N 1 0 296.414 3.825 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C2CC2)C2CCC2)c1 ZINC000325004526 1117778645 /nfs/dbraw/zinc/77/86/45/1117778645.db2.gz BBZOZKAQBKDARH-DIFFPNOSSA-N 1 0 275.392 3.630 20 10 CHCDRO COc1ccc(C[NH2+]Cc2ccc(C(F)F)cc2)c(O)c1 ZINC000185184347 1117780023 /nfs/dbraw/zinc/78/00/23/1117780023.db2.gz XWPJCLZEJLTKJY-UHFFFAOYSA-N 1 0 293.313 3.628 20 10 CHCDRO CCc1ccc(C[NH2+]Cc2ccc(OC)c(C)c2)s1 ZINC000067693048 1117816460 /nfs/dbraw/zinc/81/64/60/1117816460.db2.gz UILPLIMHDDEWLX-UHFFFAOYSA-N 1 0 275.417 3.917 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CCOc3ccccc32)c1 ZINC000185404930 1117818193 /nfs/dbraw/zinc/81/81/93/1117818193.db2.gz ZJYSJKKJZUCFDN-HUUCEWRRSA-N 1 0 297.398 3.918 20 10 CHCDRO C[C@H]([NH2+][C@@H]1C[C@H]2CC[C@@H]1O2)c1ccc2ccccc2c1O ZINC000185460263 1117826821 /nfs/dbraw/zinc/82/68/21/1117826821.db2.gz OJVKKCOUCIWILC-AADNMHCOSA-N 1 0 283.371 3.516 20 10 CHCDRO C[C@@H]([NH2+][C@H](CC[NH+](C)C)C(C)(C)C)c1ccc(F)cc1[O-] ZINC000185471860 1117828337 /nfs/dbraw/zinc/82/83/37/1117828337.db2.gz MIRSFLJMVLYVLM-MLGOLLRUSA-N 1 0 296.430 3.548 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@](C)(O)CCC(C)C)c1 ZINC000185527761 1117838280 /nfs/dbraw/zinc/83/82/80/1117838280.db2.gz MCJPFXYVFMTXDH-RHSMWYFYSA-N 1 0 279.424 3.538 20 10 CHCDRO C[N@H+](CCSc1nccs1)Cc1ccc(F)cc1 ZINC000185688561 1117870985 /nfs/dbraw/zinc/87/09/85/1117870985.db2.gz GMLYBEKGRLJNSN-UHFFFAOYSA-N 1 0 282.409 3.506 20 10 CHCDRO COCCC1(C[NH2+][C@@H](C)c2ccc(C)cc2O)CCC1 ZINC000185753394 1117880122 /nfs/dbraw/zinc/88/01/22/1117880122.db2.gz IRZXYANTNVHFQZ-AWEZNQCLSA-N 1 0 277.408 3.558 20 10 CHCDRO C[C@H]([NH2+][C@H](CCO)C1CCCCC1)c1cc(F)ccc1O ZINC000185829575 1117914338 /nfs/dbraw/zinc/91/43/38/1117914338.db2.gz PVQRICXYYLIYQF-BLLLJJGKSA-N 1 0 295.398 3.513 20 10 CHCDRO CN(C)c1cccc([C@@H]2CCC[N@@H+]2Cc2ccccc2O)c1 ZINC000179577438 1128748836 /nfs/dbraw/zinc/74/88/36/1128748836.db2.gz FROFYSOOXBEHHE-SFHVURJKSA-N 1 0 296.414 3.795 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CCC[C@@H](C(C)C)CC2)c1 ZINC000211391275 1118023949 /nfs/dbraw/zinc/02/39/49/1118023949.db2.gz XLJTVNPEDFEVDM-CQSZACIVSA-N 1 0 277.408 3.659 20 10 CHCDRO C[C@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)CC1 ZINC000211517789 1118069586 /nfs/dbraw/zinc/06/95/86/1118069586.db2.gz NKLVXSIRSZVNIU-NSHDSACASA-N 1 0 253.773 3.668 20 10 CHCDRO C[C@@H]1CC[C@H](C)[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC000211564612 1118074092 /nfs/dbraw/zinc/07/40/92/1118074092.db2.gz DIVBQGAHOYJBMM-MNOVXSKESA-N 1 0 253.773 3.666 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](CC)Cc2cccs2)c1 ZINC000179720981 1128755836 /nfs/dbraw/zinc/75/58/36/1128755836.db2.gz LFMMLNRPPXFLGS-UHFFFAOYSA-N 1 0 291.416 3.875 20 10 CHCDRO C[C@H]([NH2+]CCN(C)c1ccccc1)c1ccc(N(C)C)cc1 ZINC000764787983 1118116579 /nfs/dbraw/zinc/11/65/79/1118116579.db2.gz HVKYPVBAKYAPOZ-INIZCTEOSA-N 1 0 297.446 3.540 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1C[C@H]1C)c1ccc(N2CCCCC2)cc1 ZINC000765336878 1118144890 /nfs/dbraw/zinc/14/48/90/1118144890.db2.gz LIUZHOPNLNGLOI-VYDXJSESSA-N 1 0 272.436 3.984 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](C)C1CC1)c1ccc(N(C)C)cc1 ZINC000765397149 1118148594 /nfs/dbraw/zinc/14/85/94/1118148594.db2.gz ZQJCDOHRNVPCKK-SUMWQHHRSA-N 1 0 260.425 3.839 20 10 CHCDRO C[C@H](CC1CCC1)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000765476613 1118154064 /nfs/dbraw/zinc/15/40/64/1118154064.db2.gz YVLGRJGQUDWXCW-GFCCVEGCSA-N 1 0 264.388 3.560 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CCC2(COC)CC2)cc1 ZINC000842895207 1118159786 /nfs/dbraw/zinc/15/97/86/1118159786.db2.gz UHQCNZUBLDQGBW-HNNXBMFYSA-N 1 0 290.451 3.610 20 10 CHCDRO Cc1ccc(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)cn1 ZINC000765571131 1118172201 /nfs/dbraw/zinc/17/22/01/1118172201.db2.gz YMFYZCOGVVSMEB-UHFFFAOYSA-N 1 0 295.430 3.621 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cccc(OC)c1 ZINC000765607344 1118181516 /nfs/dbraw/zinc/18/15/16/1118181516.db2.gz BHEJBQPHCMZRNB-GOSISDBHSA-N 1 0 297.398 3.871 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccc(N(C)C)cc1 ZINC000765608839 1118182028 /nfs/dbraw/zinc/18/20/28/1118182028.db2.gz MBVJXONJARTLDL-AWEZNQCLSA-N 1 0 296.414 3.538 20 10 CHCDRO Cc1ccsc1[C@@H](C)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000765608704 1118182403 /nfs/dbraw/zinc/18/24/03/1118182403.db2.gz JKTUKZINXIWXBX-GFCCVEGCSA-N 1 0 273.401 3.842 20 10 CHCDRO CC[C@H](C)N(C)CC[NH2+][C@@H](CC)c1ccc(N(C)C)cc1 ZINC000765657145 1118188124 /nfs/dbraw/zinc/18/81/24/1118188124.db2.gz VVBXLNISASITFZ-YJBOKZPZSA-N 1 0 291.483 3.524 20 10 CHCDRO Cc1cc(C)cc(C[NH2+]Cc2cccc(C)c2O)c1 ZINC000693130067 1118218103 /nfs/dbraw/zinc/21/81/03/1118218103.db2.gz HKUAAXJXMSLIDP-UHFFFAOYSA-N 1 0 255.361 3.607 20 10 CHCDRO CCOC[C@@H]1CC[N@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000177629876 1118260662 /nfs/dbraw/zinc/26/06/62/1118260662.db2.gz XLCFZZBNDLUBIT-OAHLLOKOSA-N 1 0 291.435 3.682 20 10 CHCDRO CC1(C[NH2+]Cc2ccc(N3CCCC3)cc2)CCCC1 ZINC000111618263 1118280479 /nfs/dbraw/zinc/28/04/79/1118280479.db2.gz NVOQDKRCXMQGPV-UHFFFAOYSA-N 1 0 272.436 3.957 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)CN(CC)CC)c1ccc(N(C)C)cc1 ZINC000765770367 1118322625 /nfs/dbraw/zinc/32/26/25/1118322625.db2.gz WRPBHXRJVVSCTO-QAPCUYQASA-N 1 0 291.483 3.524 20 10 CHCDRO CC[C@@H]([NH2+]C[C@](C)(O)C1CCCCC1)c1ccccc1O ZINC000188660424 1118326213 /nfs/dbraw/zinc/32/62/13/1118326213.db2.gz CJFAGPCKXPBMNE-AEFFLSMTSA-N 1 0 291.435 3.764 20 10 CHCDRO CC(C)[C@@H]1CCC[N@@H+]1Cc1cc(Br)ccc1O ZINC000211671204 1118332594 /nfs/dbraw/zinc/33/25/94/1118332594.db2.gz LEFWWMRNNJAJIH-ZDUSSCGKSA-N 1 0 298.224 3.775 20 10 CHCDRO COc1cccc(C[NH+]2CCC(C)(C(C)C)CC2)c1O ZINC000779190946 1128781018 /nfs/dbraw/zinc/78/10/18/1128781018.db2.gz DEJBYQJGCXZIDZ-UHFFFAOYSA-N 1 0 277.408 3.659 20 10 CHCDRO Oc1ccc(Br)cc1C[NH2+]C1CCCCCC1 ZINC000076275414 1118500774 /nfs/dbraw/zinc/50/07/74/1118500774.db2.gz BKGDPPFCCSLXTH-UHFFFAOYSA-N 1 0 298.224 3.967 20 10 CHCDRO C[C@H]([NH2+]CC1CC1)c1ccc(N2CCCCC2)cc1 ZINC000177835341 1118514609 /nfs/dbraw/zinc/51/46/09/1118514609.db2.gz OWWYPCZBRZPKHN-AWEZNQCLSA-N 1 0 258.409 3.738 20 10 CHCDRO C[C@@H]1CCCCC[C@H]1[NH2+]Cc1ccc2c(c1)CCO2 ZINC000088509481 1118521567 /nfs/dbraw/zinc/52/15/67/1118521567.db2.gz RZOITFGSWPXROZ-CZUORRHYSA-N 1 0 259.393 3.680 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1c(C)noc1C)c1ccccc1O ZINC000092327879 1118583001 /nfs/dbraw/zinc/58/30/01/1118583001.db2.gz MXXMWIQLBNGNBV-HZMBPMFUSA-N 1 0 274.364 3.799 20 10 CHCDRO C[C@@H]1CCCC[C@H]1C[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000109935213 1118591088 /nfs/dbraw/zinc/59/10/88/1118591088.db2.gz NTBABMMAXOTFEX-QAPCUYQASA-N 1 0 286.463 3.985 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]CC1CCC(F)(F)CC1)CC2 ZINC000693388356 1118614721 /nfs/dbraw/zinc/61/47/21/1118614721.db2.gz RRPVAICRHIIONH-ZDUSSCGKSA-N 1 0 281.346 3.795 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2ccc(Cl)cc2O)CCC1(F)F ZINC001140461891 1118720518 /nfs/dbraw/zinc/72/05/18/1118720518.db2.gz WZQVLUYPEDOYFO-SNVBAGLBSA-N 1 0 289.753 3.913 20 10 CHCDRO COc1cc(C)cc(C[N@@H+]2C[C@H](C)[C@@H]3CCCC[C@H]32)c1O ZINC000782275828 1118735746 /nfs/dbraw/zinc/73/57/46/1118735746.db2.gz IUEHUMKOSNNATG-CWRNSKLLSA-N 1 0 289.419 3.720 20 10 CHCDRO Oc1cc(Cl)ccc1C[N@@H+]1CCC[C@H]1c1ccncc1 ZINC001140466223 1118751578 /nfs/dbraw/zinc/75/15/78/1118751578.db2.gz BUAZNMGEZAUUKW-HNNXBMFYSA-N 1 0 288.778 3.778 20 10 CHCDRO COC[C@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1ccccc1 ZINC000089668352 1118795514 /nfs/dbraw/zinc/79/55/14/1118795514.db2.gz WOCXOGIPIUHUPO-KXBFYZLASA-N 1 0 298.430 3.791 20 10 CHCDRO CCC[N@H+](Cc1ccnn1C1CCC1)Cc1ccccc1O ZINC000891853107 1118803669 /nfs/dbraw/zinc/80/36/69/1118803669.db2.gz BJDZMWDIXVIHSQ-UHFFFAOYSA-N 1 0 299.418 3.726 20 10 CHCDRO CCC(C)(C)OCC[NH2+][C@H](C)c1cc(C)ccc1O ZINC000308747712 1118855412 /nfs/dbraw/zinc/85/54/12/1118855412.db2.gz SHLYIKWEGHHWRP-CYBMUJFWSA-N 1 0 265.397 3.556 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccn(C)c1)c1ccc(N2CCCCC2)cc1 ZINC000158438707 1119058938 /nfs/dbraw/zinc/05/89/38/1119058938.db2.gz JKRHOTRGCOYJLD-MRXNPFEDSA-N 1 0 297.446 3.866 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCc2ccccc2C1)c1ccccc1O ZINC000051630690 1119059105 /nfs/dbraw/zinc/05/91/05/1119059105.db2.gz WSXKUPGFZAHXLX-CZUORRHYSA-N 1 0 267.372 3.600 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCc2ccccc2C1)c1ccccc1O ZINC000051630632 1119059555 /nfs/dbraw/zinc/05/95/55/1119059555.db2.gz PDUOEDIFTXLFGN-WMZOPIPTSA-N 1 0 281.399 3.990 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@H](C)c2ccc(C)s2)c1 ZINC000049159268 1119087498 /nfs/dbraw/zinc/08/74/98/1119087498.db2.gz UNZIEFJWPDJKLZ-LLVKDONJSA-N 1 0 277.389 3.622 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(F)cn1 ZINC000161799312 1119384813 /nfs/dbraw/zinc/38/48/13/1119384813.db2.gz WXVXNTVIMPNZIM-INIZCTEOSA-N 1 0 287.382 3.528 20 10 CHCDRO Cc1ccc(OC[C@H](C)[NH2+]Cc2cccc(C)c2O)cc1 ZINC000158123175 1119433821 /nfs/dbraw/zinc/43/38/21/1119433821.db2.gz QPVJWRLDCFDSSB-HNNXBMFYSA-N 1 0 285.387 3.566 20 10 CHCDRO Cc1cc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2)cs1 ZINC000294304319 1119633151 /nfs/dbraw/zinc/63/31/51/1119633151.db2.gz VJQIMFYFKDYTBG-ZDUSSCGKSA-N 1 0 274.433 3.973 20 10 CHCDRO CC(C)Cc1ccc(C[NH2+]Cc2ccc(N(C)C)cc2)cn1 ZINC000892476923 1119756987 /nfs/dbraw/zinc/75/69/87/1119756987.db2.gz YUIUANLDRUHBFP-UHFFFAOYSA-N 1 0 297.446 3.636 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCCSCC2)cc1 ZINC000692468832 1119757195 /nfs/dbraw/zinc/75/71/95/1119757195.db2.gz PJKYGEJVJZDWKO-MRXNPFEDSA-N 1 0 292.492 3.908 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+](C)[C@H](C)c2ccccc2)c1 ZINC000179701991 1119757917 /nfs/dbraw/zinc/75/79/17/1119757917.db2.gz NXIWGCZTWXAAFN-CQSZACIVSA-N 1 0 255.361 3.894 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]CCCOc1ccccc1 ZINC000052091998 1119781148 /nfs/dbraw/zinc/78/11/48/1119781148.db2.gz ZKKJGHWWZGUYIQ-UHFFFAOYSA-N 1 0 291.778 3.604 20 10 CHCDRO Cc1ccc(CC[NH2+][C@H](C)c2ccccc2O)cc1 ZINC000179877666 1119787883 /nfs/dbraw/zinc/78/78/83/1119787883.db2.gz GYKSTNHOMAUSNY-CQSZACIVSA-N 1 0 255.361 3.594 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc2c(cc1O)OCO2)C1CCCCC1 ZINC000052336176 1119814523 /nfs/dbraw/zinc/81/45/23/1119814523.db2.gz BLOHYNZCGIXXNV-AWEZNQCLSA-N 1 0 291.391 3.569 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccccc1O)C1CCC(F)(F)CC1 ZINC000690786843 1119819851 /nfs/dbraw/zinc/81/98/51/1119819851.db2.gz VOUVAHZGEWKYIW-LLVKDONJSA-N 1 0 269.335 3.696 20 10 CHCDRO Cc1cccc(C[NH2+]C[C@@H]2CCCCC2(F)F)c1O ZINC000295113512 1119857549 /nfs/dbraw/zinc/85/75/49/1119857549.db2.gz LYTJPADURZLMBW-ZDUSSCGKSA-N 1 0 269.335 3.616 20 10 CHCDRO COC1(c2ccccc2)CC[NH+](Cc2ccccc2O)CC1 ZINC001203558332 1120031566 /nfs/dbraw/zinc/03/15/66/1120031566.db2.gz FOZBMEXATXNEKJ-UHFFFAOYSA-N 1 0 297.398 3.530 20 10 CHCDRO CCSCC[C@H](C)[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000168809296 1120097485 /nfs/dbraw/zinc/09/74/85/1120097485.db2.gz HHIWVUYQBJPZNQ-STQMWFEESA-N 1 0 267.438 3.883 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@H]1CCC[C@@H](C)C1 ZINC000226966366 1120106952 /nfs/dbraw/zinc/10/69/52/1120106952.db2.gz DBXXBIKLSKBWAM-PBHICJAKSA-N 1 0 260.425 3.940 20 10 CHCDRO CCC(C)(C)[C@@H](C)[NH2+][C@H](C)c1cc(OC)ccc1O ZINC000695107869 1120108204 /nfs/dbraw/zinc/10/82/04/1120108204.db2.gz PHWCAKPHOSFEJM-VXGBXAGGSA-N 1 0 265.397 3.876 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCCC(F)(F)C2)c(O)c1 ZINC000695125455 1120110672 /nfs/dbraw/zinc/11/06/72/1120110672.db2.gz ICGFJGDPFLDWGR-VXGBXAGGSA-N 1 0 269.335 3.929 20 10 CHCDRO CCc1ccc(C[NH2+][C@H](C)c2cc(OC)ccc2O)cc1 ZINC000182323000 1120117826 /nfs/dbraw/zinc/11/78/26/1120117826.db2.gz XRHOLWYTDYDHAZ-CYBMUJFWSA-N 1 0 285.387 3.814 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[C@H](C)C[C@@H]2C)c1 ZINC000252182792 1128891991 /nfs/dbraw/zinc/89/19/91/1128891991.db2.gz TWJGSZZZYUUPCJ-WFGGJUAMSA-N 1 0 277.408 3.876 20 10 CHCDRO c1ccc(C2([NH2+]Cc3ccc4c(c3)CCCO4)CC2)cc1 ZINC000921716987 1120170952 /nfs/dbraw/zinc/17/09/52/1120170952.db2.gz OOBOTFDCLBFAKH-UHFFFAOYSA-N 1 0 279.383 3.791 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCOc2ccccc2)c(O)c1C ZINC000756370401 1120260298 /nfs/dbraw/zinc/26/02/98/1120260298.db2.gz GXXWMDLUBDFQEP-HNNXBMFYSA-N 1 0 285.387 3.739 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+]CCc2cccs2)c2c1c(F)ccc2O ZINC000756373130 1120276380 /nfs/dbraw/zinc/27/63/80/1120276380.db2.gz SZTRYKSZAYZRDK-MFKMUULPSA-N 1 0 291.391 3.973 20 10 CHCDRO CC(C)C(C)(C)[NH2+]Cc1cc(Br)ccc1O ZINC000309336162 1120279643 /nfs/dbraw/zinc/27/96/43/1120279643.db2.gz JDCNDTCRWNIADE-UHFFFAOYSA-N 1 0 286.213 3.679 20 10 CHCDRO Cc1cccc(OC[C@@H](C)[NH2+][C@H](C)c2ccccc2O)c1 ZINC000183438565 1120341931 /nfs/dbraw/zinc/34/19/31/1120341931.db2.gz MODUMOCBDHBDEB-HUUCEWRRSA-N 1 0 285.387 3.819 20 10 CHCDRO COC1(C[NH2+][C@@H](C)c2cc(F)ccc2O)CCCCC1 ZINC000186508935 1120349380 /nfs/dbraw/zinc/34/93/80/1120349380.db2.gz ODXPVXFZHQNEHR-LBPRGKRZSA-N 1 0 281.371 3.531 20 10 CHCDRO Cc1noc(C)c1[C@@H](C)[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000092326526 1120356925 /nfs/dbraw/zinc/35/69/25/1120356925.db2.gz BSWCWBDLNCUZCB-VXGBXAGGSA-N 1 0 287.407 3.769 20 10 CHCDRO Cc1noc(C)c1[C@H](C)[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000092327737 1120357136 /nfs/dbraw/zinc/35/71/36/1120357136.db2.gz GBFHXWGIOKBZDM-QWRGUYRKSA-N 1 0 274.364 3.717 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(C#N)cc2F)c1 ZINC000185377836 1120375663 /nfs/dbraw/zinc/37/56/63/1120375663.db2.gz NFWJSQPNGQPYST-LBPRGKRZSA-N 1 0 284.334 3.562 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)COc1ccccc1)c1cc(F)ccc1O ZINC000756496703 1120387041 /nfs/dbraw/zinc/38/70/41/1120387041.db2.gz XLDOYJKZEXYRJY-QWHCGFSZSA-N 1 0 289.350 3.649 20 10 CHCDRO Cc1cccc(C[NH2+][C@H]2Cc3cccc(Cl)c3C2)c1O ZINC001168704591 1120411383 /nfs/dbraw/zinc/41/13/83/1120411383.db2.gz NKCDJHWTHCOTJR-AWEZNQCLSA-N 1 0 287.790 3.611 20 10 CHCDRO CCCC[N@H+](CCc1ccncc1)Cc1ccccc1O ZINC000282340927 1120466450 /nfs/dbraw/zinc/46/64/50/1120466450.db2.gz BTGOKQLYIMETTO-UHFFFAOYSA-N 1 0 284.403 3.632 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+][C@@H]2CC3CCC2CC3)c1O ZINC000312615052 1120493726 /nfs/dbraw/zinc/49/37/26/1120493726.db2.gz AOYRAQRPJADNJO-QIMFLAQGSA-N 1 0 295.810 3.723 20 10 CHCDRO Cc1cc(O)c(C[NH2+]Cc2nccc3c2CCCC3)cc1C ZINC000922466175 1120542065 /nfs/dbraw/zinc/54/20/65/1120542065.db2.gz GLFSLEIVGGWKHB-UHFFFAOYSA-N 1 0 296.414 3.573 20 10 CHCDRO Cc1csc([C@H](C)C[NH2+][C@H](C)c2ccc(C)cc2O)n1 ZINC000186573071 1120587826 /nfs/dbraw/zinc/58/78/26/1120587826.db2.gz OFDFHEKWTYTUJZ-DGCLKSJQSA-N 1 0 290.432 3.920 20 10 CHCDRO CC1(C)CC[C@H]([NH2+]Cc2cc(Cl)ccc2O)C1 ZINC000162717672 1120589898 /nfs/dbraw/zinc/58/98/98/1120589898.db2.gz AJCUBKBHDQZRTJ-LBPRGKRZSA-N 1 0 253.773 3.714 20 10 CHCDRO CSCCCCC[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000186782318 1120664510 /nfs/dbraw/zinc/66/45/10/1120664510.db2.gz BOXIMHSSRHYCMG-AWEZNQCLSA-N 1 0 280.481 3.937 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCCO[C@@H]2CC(C)C)c1 ZINC000186829195 1120675007 /nfs/dbraw/zinc/67/50/07/1120675007.db2.gz WNYLAORRVYKIBP-QILLFSRXSA-N 1 0 291.435 3.945 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[C@H](C)C[C@H]2C)c1 ZINC000070111038 1128941601 /nfs/dbraw/zinc/94/16/01/1128941601.db2.gz TWJGSZZZYUUPCJ-RSUWNVLCSA-N 1 0 277.408 3.876 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+][C@@H]1CCOC2(CCCC2)C1 ZINC000136691536 1120844291 /nfs/dbraw/zinc/84/42/91/1120844291.db2.gz HGUHJLQIWWHUOW-GFCCVEGCSA-N 1 0 295.810 3.627 20 10 CHCDRO CC[N@H+](Cc1cnc(C)s1)Cc1ccc(N(C)C)cc1 ZINC000125697343 1120890373 /nfs/dbraw/zinc/89/03/73/1120890373.db2.gz FIJWLNNAPBBQTB-UHFFFAOYSA-N 1 0 289.448 3.540 20 10 CHCDRO CCOc1cccc(C[N@@H+]2C[C@@H](C)[C@@H]2c2ccccc2)c1O ZINC000093867483 1120892168 /nfs/dbraw/zinc/89/21/68/1120892168.db2.gz PZVHFWPBAYRNFV-RDTXWAMCSA-N 1 0 297.398 3.984 20 10 CHCDRO CC1(C)C[N@H+](Cc2ccccc2O)CC[C@H]1C(F)(F)F ZINC000191658831 1128950349 /nfs/dbraw/zinc/95/03/49/1128950349.db2.gz WJEIKXSQCOJXBJ-CYBMUJFWSA-N 1 0 287.325 3.803 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]Cc2ccc(C3CC3)cc2)c1 ZINC000191682922 1128951202 /nfs/dbraw/zinc/95/12/02/1128951202.db2.gz RYBJMQQEVUNZJE-UHFFFAOYSA-N 1 0 297.398 3.958 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)COc2ccc(C)cc2)cc1C ZINC000314935730 1120981657 /nfs/dbraw/zinc/98/16/57/1120981657.db2.gz PWBLJKSNBQETQT-MRXNPFEDSA-N 1 0 299.414 3.869 20 10 CHCDRO Cc1cc(Br)cc([C@@H](C)[NH2+]CC2CC2)c1O ZINC000186979039 1121043472 /nfs/dbraw/zinc/04/34/72/1121043472.db2.gz SMPGWTGQYZHZDK-SECBINFHSA-N 1 0 284.197 3.524 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]CCc2ccc(C)cc2)c1 ZINC000182334569 1128959675 /nfs/dbraw/zinc/95/96/75/1128959675.db2.gz UOXONQRKALSAQM-CQSZACIVSA-N 1 0 285.387 3.603 20 10 CHCDRO C[C@@H]([NH2+]Cc1cc(Cl)ccc1O)C1CCCC1 ZINC000070305460 1128966061 /nfs/dbraw/zinc/96/60/61/1128966061.db2.gz COCNXIAQVLOQLF-SNVBAGLBSA-N 1 0 253.773 3.714 20 10 CHCDRO C[C@H]([NH2+]CC1CC(C)(C)C1)c1cc(F)ccc1O ZINC000701945113 1121174191 /nfs/dbraw/zinc/17/41/91/1121174191.db2.gz OROLRWBMCDSMAL-JTQLQIEISA-N 1 0 251.345 3.618 20 10 CHCDRO CC(C)O[C@H]1C[C@H]([NH2+]Cc2c(O)cccc2Cl)C1(C)C ZINC000766089316 1121209047 /nfs/dbraw/zinc/20/90/47/1121209047.db2.gz QAPKBNUDGCWRSH-GJZGRUSLSA-N 1 0 297.826 3.727 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CSC[C@@H]1C)c1ccc(N(C)C)cc1 ZINC000797064036 1121266069 /nfs/dbraw/zinc/26/60/69/1121266069.db2.gz FPOHWMQGHGFCIF-RCBQFDQVSA-N 1 0 278.465 3.545 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(N(C)C)cc1 ZINC000124045045 1121283790 /nfs/dbraw/zinc/28/37/90/1121283790.db2.gz GKGHBGXAXSAGTA-HNNXBMFYSA-N 1 0 297.446 3.669 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N2CCC(C)CC2)cc1)C1CC1 ZINC000236679647 1121363418 /nfs/dbraw/zinc/36/34/18/1121363418.db2.gz MSGOXTPVIQYVGX-HNNXBMFYSA-N 1 0 272.436 3.811 20 10 CHCDRO CCC[C@@H](Cc1ccccc1)[NH2+]Cc1cccc(OC)c1O ZINC000236887930 1121373374 /nfs/dbraw/zinc/37/33/74/1121373374.db2.gz BCUGXEXNVAJELI-KRWDZBQOSA-N 1 0 299.414 3.902 20 10 CHCDRO CCC[C@@H](C[NH2+][C@H](CC)c1ccccc1O)OCC ZINC000705317181 1121396080 /nfs/dbraw/zinc/39/60/80/1121396080.db2.gz OZANMPOICANNHA-DZGCQCFKSA-N 1 0 265.397 3.638 20 10 CHCDRO COc1cccc(C[NH2+][C@H]2C[C@@H](C)CC(C)(C)C2)c1O ZINC000708233272 1121464578 /nfs/dbraw/zinc/46/45/78/1121464578.db2.gz KNFSFYIUZZQPST-OCCSQVGLSA-N 1 0 277.408 3.705 20 10 CHCDRO C[C@H](CC1CCC1)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000710217788 1121474306 /nfs/dbraw/zinc/47/43/06/1121474306.db2.gz VMACEKBDYGWJLB-OAHLLOKOSA-N 1 0 272.436 3.955 20 10 CHCDRO C[C@@H](CC1CCC1)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000710229787 1121474529 /nfs/dbraw/zinc/47/45/29/1121474529.db2.gz VNSCBKALQGLKQF-KBPBESRZSA-N 1 0 260.425 3.982 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)CC2CCC2)c1 ZINC000710247502 1121474538 /nfs/dbraw/zinc/47/45/38/1121474538.db2.gz WBVXKIQNRDZUNF-NEPJUHHUSA-N 1 0 263.381 3.630 20 10 CHCDRO C[C@@H](CC1CCC1)[NH2+]Cc1cc(Br)ccc1O ZINC000710188616 1121474682 /nfs/dbraw/zinc/47/46/82/1121474682.db2.gz FZOCPHSDEJVEAY-JTQLQIEISA-N 1 0 298.224 3.823 20 10 CHCDRO C[C@H](CC1CCC1)[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000710229792 1121474773 /nfs/dbraw/zinc/47/47/73/1121474773.db2.gz VNSCBKALQGLKQF-ZIAGYGMSSA-N 1 0 260.425 3.982 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H](C)Cc2ccccc2C)c1O ZINC000236954903 1121511379 /nfs/dbraw/zinc/51/13/79/1121511379.db2.gz LLEXDGJSTKYJLR-HNNXBMFYSA-N 1 0 299.414 3.820 20 10 CHCDRO CSCCCC[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC000168784628 1121610469 /nfs/dbraw/zinc/61/04/69/1121610469.db2.gz OKHCJWBSMICFNK-CHWSQXEVSA-N 1 0 279.449 3.982 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](CC(F)(F)F)C(C)C)c(O)c1 ZINC000877462119 1121631873 /nfs/dbraw/zinc/63/18/73/1121631873.db2.gz KSOHMVPPJMZQED-GFCCVEGCSA-N 1 0 275.314 3.767 20 10 CHCDRO C[C@H](Cc1ccsc1)[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001177441468 1121732439 /nfs/dbraw/zinc/73/24/39/1121732439.db2.gz BZNCXRUTDKCROD-CYBMUJFWSA-N 1 0 287.428 3.794 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]C[C@H]2Cc3ccccc32)cc1 ZINC001177724610 1121745905 /nfs/dbraw/zinc/74/59/05/1121745905.db2.gz DGIYUYYQQRBGAW-DUMMIQTOSA-N 1 0 292.426 3.695 20 10 CHCDRO CCC[N@H+](CC)Cc1cc(C(C)(C)C)cc(O)c1O ZINC000727821259 1121749287 /nfs/dbraw/zinc/74/92/87/1121749287.db2.gz XGMREKQZXOWLRC-UHFFFAOYSA-N 1 0 265.397 3.627 20 10 CHCDRO CC[C@H]1CCC[N@@H+]1Cc1cc(C(C)(C)C)cc(O)c1O ZINC000727825143 1121749894 /nfs/dbraw/zinc/74/98/94/1121749894.db2.gz WWEYLNHWGUWIJO-AWEZNQCLSA-N 1 0 277.408 3.770 20 10 CHCDRO CC1(C)CCC[C@H]1C[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001178783681 1121815702 /nfs/dbraw/zinc/81/57/02/1121815702.db2.gz XSOAXVLCACZUCO-INIZCTEOSA-N 1 0 273.420 3.928 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CCC[C@@H]2c2ccc[nH]2)cc1 ZINC000773775651 1121824331 /nfs/dbraw/zinc/82/43/31/1121824331.db2.gz JAVIJLKIEOOHBO-GOSISDBHSA-N 1 0 283.419 3.808 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)CC2CC2)c2ccccc21 ZINC001204232387 1121825534 /nfs/dbraw/zinc/82/55/34/1121825534.db2.gz BTJWUIPOUOSVAR-UHFFFAOYSA-N 1 0 268.404 3.748 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2c(F)cncc2F)c(O)c1 ZINC000797128378 1121842553 /nfs/dbraw/zinc/84/25/53/1121842553.db2.gz RGBCGKXAMSIIKW-WDEREUQCSA-N 1 0 292.329 3.786 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2c(F)cncc2F)c(O)c1 ZINC000797128375 1121843875 /nfs/dbraw/zinc/84/38/75/1121843875.db2.gz RGBCGKXAMSIIKW-MNOVXSKESA-N 1 0 292.329 3.786 20 10 CHCDRO CCN(C)c1ccc(C[N@H+]2CC=C(C(F)(F)F)CC2)cc1 ZINC000773790135 1121845104 /nfs/dbraw/zinc/84/51/04/1121845104.db2.gz IIHOPYQDNOQDOH-UHFFFAOYSA-N 1 0 298.352 3.837 20 10 CHCDRO C[C@@H]1C[C@@H]([NH2+]Cc2ccc3c(c2)CCO3)c2ccccc21 ZINC000731451111 1121867536 /nfs/dbraw/zinc/86/75/36/1121867536.db2.gz QVAOMCIZSSBAMG-FZKQIMNGSA-N 1 0 279.383 3.960 20 10 CHCDRO CCN(C)c1ccc(C[N@H+](Cc2ccccn2)C2CC2)cc1 ZINC000773824416 1121902882 /nfs/dbraw/zinc/90/28/82/1121902882.db2.gz VESDVWNVFUZOEO-UHFFFAOYSA-N 1 0 295.430 3.702 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CCc3ccsc3C2)cc1 ZINC000773827267 1121909253 /nfs/dbraw/zinc/90/92/53/1121909253.db2.gz WGMMTRWFQQESGB-UHFFFAOYSA-N 1 0 286.444 3.763 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CC[C@@H](c3ccco3)C2)cc1C ZINC000732182305 1121910424 /nfs/dbraw/zinc/91/04/24/1121910424.db2.gz GFSAASXHYLHSHG-CQSZACIVSA-N 1 0 271.360 3.592 20 10 CHCDRO CC[C@@H]1C[N@H+](Cc2cc(C(C)C)c(C)cc2O)C[C@H](C)O1 ZINC000732184547 1121910537 /nfs/dbraw/zinc/91/05/37/1121910537.db2.gz CLZUIKMRSMHBPQ-GOEBONIOSA-N 1 0 291.435 3.823 20 10 CHCDRO Cc1cc(C[N@H+](Cc2ccccc2O)C2CCCC2)on1 ZINC000732205066 1121912696 /nfs/dbraw/zinc/91/26/96/1121912696.db2.gz YXOGECRMMFNTJW-UHFFFAOYSA-N 1 0 286.375 3.633 20 10 CHCDRO CSC[C@@H]1CCC[N@@H+]1Cc1c(O)cc(C)cc1Cl ZINC001179854989 1121916648 /nfs/dbraw/zinc/91/66/48/1121916648.db2.gz LXIJXIZAKLBOJG-NSHDSACASA-N 1 0 285.840 3.681 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C2CC(C)(c3ccccc3)C2)c1 ZINC000733326595 1121977482 /nfs/dbraw/zinc/97/74/82/1121977482.db2.gz NVASLCHSVLOUES-UHFFFAOYSA-N 1 0 281.399 3.911 20 10 CHCDRO Cc1ccc(C[N@H+](C)Cc2cc(F)c(F)c(F)c2)c(O)c1 ZINC001180326089 1121980030 /nfs/dbraw/zinc/98/00/30/1121980030.db2.gz GTYVYGWEGKHPFB-UHFFFAOYSA-N 1 0 295.304 3.750 20 10 CHCDRO Cc1ncoc1C[NH2+]Cc1ccc(N2CCC(C)CC2)cc1 ZINC000894250623 1122012694 /nfs/dbraw/zinc/01/26/94/1122012694.db2.gz LYWUCNIAVRANRY-UHFFFAOYSA-N 1 0 299.418 3.509 20 10 CHCDRO CC[C@H]1CC[C@H](C)[N@@H+]1Cc1ccc(Cl)cc1O ZINC001181543949 1122061658 /nfs/dbraw/zinc/06/16/58/1122061658.db2.gz IYRNOBWGQURMGT-GWCFXTLKSA-N 1 0 253.773 3.809 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]C[C@@H]1CCCCC1(F)F ZINC001182054502 1122107466 /nfs/dbraw/zinc/10/74/66/1122107466.db2.gz VIOIHOCVYNWZGS-HNNXBMFYSA-N 1 0 296.405 3.976 20 10 CHCDRO COc1ccc(N(CCCn2ccnc2)[C@H](C)C2CC2)cc1 ZINC000183189636 1129032719 /nfs/dbraw/zinc/03/27/19/1129032719.db2.gz LLTVANOBILFYQD-OAHLLOKOSA-N 1 0 299.418 3.587 20 10 CHCDRO c1ccc2c(c1)NCCC[C@@H]2[NH2+]Cc1ccc2c(c1)CCO2 ZINC000774159970 1122136222 /nfs/dbraw/zinc/13/62/22/1122136222.db2.gz AABORFWHAZSLPV-SFHVURJKSA-N 1 0 294.398 3.658 20 10 CHCDRO CC(C)C1(c2ccccc2)C[NH+](Cc2cc(F)ccc2O)C1 ZINC001182424148 1122152430 /nfs/dbraw/zinc/15/24/30/1122152430.db2.gz OYAPMQKSYOQJCG-UHFFFAOYSA-N 1 0 299.389 3.941 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)C(C)(C)O)c1cc(Cl)c(Cl)cc1[O-] ZINC000774284337 1122153591 /nfs/dbraw/zinc/15/35/91/1122153591.db2.gz FDUOHGNAMGTGBI-YUMQZZPRSA-N 1 0 292.206 3.509 20 10 CHCDRO Cc1ccc(C[N@@H+]2CC[C@H](Cc3ccc(F)cc3)C2)c(O)c1 ZINC001204347844 1122177034 /nfs/dbraw/zinc/17/70/34/1122177034.db2.gz MIALCTZDMSJLGG-MRXNPFEDSA-N 1 0 299.389 3.904 20 10 CHCDRO CCc1cccc(C[N@@H+]2CCC[C@@H](C3CCC3)C2)c1O ZINC001182959509 1122197429 /nfs/dbraw/zinc/19/74/29/1122197429.db2.gz JBEVUXDDMPLMHB-MRXNPFEDSA-N 1 0 273.420 3.967 20 10 CHCDRO Cc1cc(C[NH2+][C@@H]2CCO[C@@H]2C)c(C)n1-c1cccc(C)c1 ZINC001183268620 1122216200 /nfs/dbraw/zinc/21/62/00/1122216200.db2.gz HUMXOHJWYVCFGV-VQIMIIECSA-N 1 0 298.430 3.670 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)cc1 ZINC000273364827 1122230619 /nfs/dbraw/zinc/23/06/19/1122230619.db2.gz DVVNMYDGYAFMRY-CQSZACIVSA-N 1 0 285.387 3.868 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc([C@@H](C)O)cc2)c(O)c1C ZINC000273383905 1122230810 /nfs/dbraw/zinc/23/08/10/1122230810.db2.gz IWODSZLTXMLLIU-HUUCEWRRSA-N 1 0 299.414 3.913 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCO[C@@H](CC(C)C)C2)c(O)c1 ZINC000273451665 1122233969 /nfs/dbraw/zinc/23/39/69/1122233969.db2.gz GCMYUMHOZRULDP-JYJNAYRXSA-N 1 0 291.435 3.945 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCO[C@H](C(C)C)C2)c(O)c1C ZINC000273538272 1122237941 /nfs/dbraw/zinc/23/79/41/1122237941.db2.gz XSXXRYZFIDFKOK-UXLLHSPISA-N 1 0 291.435 3.863 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCO[C@@H](C(C)(C)C)C1)c1cc(F)ccc1O ZINC000273530928 1122238029 /nfs/dbraw/zinc/23/80/29/1122238029.db2.gz WHUCKDVBJGVNDK-NORZTCDRSA-N 1 0 295.398 3.776 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](O)c2ccccc2C)c(O)c1C ZINC000273568857 1122238327 /nfs/dbraw/zinc/23/83/27/1122238327.db2.gz KHKNZQHLWBAMSI-MAUKXSAKSA-N 1 0 299.414 3.702 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2cccc(N(C)C)c2)c1 ZINC000273565923 1122238344 /nfs/dbraw/zinc/23/83/44/1122238344.db2.gz JLYYQMYWEZPIFH-AWEZNQCLSA-N 1 0 284.403 3.617 20 10 CHCDRO CC1(C)CO[C@@H](CC[NH2+]Cc2ccc3ccccc3c2O)C1 ZINC001183789224 1122238710 /nfs/dbraw/zinc/23/87/10/1122238710.db2.gz SVCKTAZVLZRYPM-INIZCTEOSA-N 1 0 299.414 3.840 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCCSC2)c(O)c1C ZINC000273552615 1122239168 /nfs/dbraw/zinc/23/91/68/1122239168.db2.gz GFDKZRBVQGVABX-CHWSQXEVSA-N 1 0 265.422 3.555 20 10 CHCDRO Cc1noc(C)c1CC[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000273607295 1122240149 /nfs/dbraw/zinc/24/01/49/1122240149.db2.gz UOABMCUXVSQBRR-GFCCVEGCSA-N 1 0 288.391 3.507 20 10 CHCDRO CC[C@@H]1CCC[C@H](C[NH2+]Cc2c([O-])cccc2F)C1 ZINC001183920347 1122248260 /nfs/dbraw/zinc/24/82/60/1122248260.db2.gz XBHPSYVFIZGSJW-OLZOCXBDSA-N 1 0 265.372 3.837 20 10 CHCDRO C[C@@H]([NH2+]C[C@H](C1CCCCC1)N(C)C)c1ccccc1O ZINC000183425866 1129054666 /nfs/dbraw/zinc/05/46/66/1129054666.db2.gz JCOARAKJLAEOFD-RHSMWYFYSA-N 1 0 290.451 3.553 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCc2ccc(F)cc21)c1ccccc1O ZINC000775134964 1122437662 /nfs/dbraw/zinc/43/76/62/1122437662.db2.gz AOTAINRWJVEADA-BDJLRTHQSA-N 1 0 271.335 3.869 20 10 CHCDRO CCCN(Cc1ccc(N(C)C)cc1)c1ccc(C[NH3+])cc1 ZINC000775140970 1122440284 /nfs/dbraw/zinc/44/02/84/1122440284.db2.gz RGNVSKVEXRUOIU-UHFFFAOYSA-N 1 0 297.446 3.628 20 10 CHCDRO C[C@@H](Cc1ccccc1F)[NH2+][C@@H](C)c1ccccc1O ZINC000183438710 1129055231 /nfs/dbraw/zinc/05/52/31/1129055231.db2.gz JDIHTDPETNYSAQ-STQMWFEESA-N 1 0 273.351 3.813 20 10 CHCDRO COc1cccc(O)c1C[NH2+]Cc1cccc(C(C)C)c1 ZINC000775343045 1122523954 /nfs/dbraw/zinc/52/39/54/1122523954.db2.gz XFQAHQQKFONTOO-UHFFFAOYSA-N 1 0 285.387 3.814 20 10 CHCDRO C[C@H]([NH2+]CC1(c2cccc(F)c2)CC1)c1ccccc1O ZINC000183523968 1129060711 /nfs/dbraw/zinc/06/07/11/1129060711.db2.gz AAVPGDMJVIOQGA-ZDUSSCGKSA-N 1 0 285.362 3.914 20 10 CHCDRO CC(C)C[C@H]1OCCC[C@H]1[NH2+]Cc1cc(Cl)ccc1O ZINC000775373660 1122532320 /nfs/dbraw/zinc/53/23/20/1122532320.db2.gz ZLGATGURBMWEGK-GDBMZVCRSA-N 1 0 297.826 3.729 20 10 CHCDRO Cc1cccc(O[C@@H](C)C[NH2+][C@H](C)c2ccccc2O)c1 ZINC000183533733 1129061163 /nfs/dbraw/zinc/06/11/63/1129061163.db2.gz YNMMOZNNJXCJAT-LSDHHAIUSA-N 1 0 285.387 3.819 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](O)c1cc(C)cc(C)c1)c1ccccc1O ZINC000775413852 1122556297 /nfs/dbraw/zinc/55/62/97/1122556297.db2.gz CMECFDZGGQGXFH-MJGOQNOKSA-N 1 0 299.414 3.783 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](O)c1cc(C)cc(C)c1)c1ccccc1O ZINC000775413850 1122556612 /nfs/dbraw/zinc/55/66/12/1122556612.db2.gz CMECFDZGGQGXFH-HKUYNNGSSA-N 1 0 299.414 3.783 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCC[C@@H]1OC)c1ccc(N(C)C)cc1 ZINC000775417161 1122557522 /nfs/dbraw/zinc/55/75/22/1122557522.db2.gz LTTBKMJKGULNQI-SZMVWBNQSA-N 1 0 290.451 3.608 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CCC[C@H]3CCC[C@@H]32)cc1 ZINC001191085822 1122576647 /nfs/dbraw/zinc/57/66/47/1122576647.db2.gz TWNJBDKKVAYKSF-AEFFLSMTSA-N 1 0 272.436 3.907 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cccs1 ZINC000048417215 1122611607 /nfs/dbraw/zinc/61/16/07/1122611607.db2.gz DFARTASSCDMMBE-CQSZACIVSA-N 1 0 273.401 3.924 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](C)N(C)c1ccccc1)c1ccccc1O ZINC000775487022 1122616174 /nfs/dbraw/zinc/61/61/74/1122616174.db2.gz GAQORXMILILJDU-YJBOKZPZSA-N 1 0 298.430 3.958 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)CN1CCC[C@H](C)C1)c1ccccc1O ZINC000775488018 1122616793 /nfs/dbraw/zinc/61/67/93/1122616793.db2.gz GAJMGAVRXNMTHJ-ZOBUZTSGSA-N 1 0 290.451 3.553 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1COc2ccccc2C1)c1ccccc1O ZINC000775487491 1122618685 /nfs/dbraw/zinc/61/86/85/1122618685.db2.gz CHYMYUQCQRVMGS-WMLDXEAASA-N 1 0 297.398 3.684 20 10 CHCDRO CC[C@@H]([NH2+]CC1CCC1)c1cc(Cl)ccc1O ZINC000775491170 1122619650 /nfs/dbraw/zinc/61/96/50/1122619650.db2.gz ZCLBQUKRGZXUSL-CYBMUJFWSA-N 1 0 253.773 3.886 20 10 CHCDRO CC[C@H]([NH2+]Cc1cccc(C)n1)c1cc(Cl)ccc1O ZINC000775490313 1122620609 /nfs/dbraw/zinc/62/06/09/1122620609.db2.gz BQPGRCFHBPCTMK-HNNXBMFYSA-N 1 0 290.794 3.990 20 10 CHCDRO CC[C@@H]([NH2+]CCN(C)[C@@H](C)CC)c1cc(Cl)ccc1O ZINC000775501935 1122628669 /nfs/dbraw/zinc/62/86/69/1122628669.db2.gz URDPIWVHSUYVPP-SWLSCSKDSA-N 1 0 298.858 3.817 20 10 CHCDRO CCC[C@](C)(O)C[NH2+][C@@H](CC)c1cc(Cl)ccc1O ZINC000775503246 1122628665 /nfs/dbraw/zinc/62/86/65/1122628665.db2.gz DVLSFPRBHVSDPN-ZFWWWQNUSA-N 1 0 285.815 3.637 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCC[C@H](O)C1)c1cc(Cl)ccc1O ZINC000775508376 1122631256 /nfs/dbraw/zinc/63/12/56/1122631256.db2.gz BOTLXBFAWXZTFF-WHOFXGATSA-N 1 0 297.826 3.637 20 10 CHCDRO CC[C@@H]([NH2+]CCN(CC)C(C)C)c1cc(Cl)ccc1O ZINC000775502827 1122631339 /nfs/dbraw/zinc/63/13/39/1122631339.db2.gz ZQKAURXMLOZXJG-OAHLLOKOSA-N 1 0 298.858 3.817 20 10 CHCDRO CC[C@H]([NH2+]CCNc1ccccc1)c1ccccc1O ZINC000775512896 1122634403 /nfs/dbraw/zinc/63/44/03/1122634403.db2.gz RWJRFFHRQHKELG-INIZCTEOSA-N 1 0 270.376 3.545 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1cnccc1C)c1ccccc1O ZINC000775519609 1122638750 /nfs/dbraw/zinc/63/87/50/1122638750.db2.gz MSLSCFBDWBCPQP-CZUORRHYSA-N 1 0 270.376 3.898 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1cn[nH]c1)c1cc(Cl)ccc1O ZINC000775522932 1122639562 /nfs/dbraw/zinc/63/95/62/1122639562.db2.gz BYHGELQOQKIYFD-RNCFNFMXSA-N 1 0 279.771 3.571 20 10 CHCDRO CC[C@@H]([NH2+][C@H](CO)CC(C)(C)C)c1cc(Cl)ccc1O ZINC000775522608 1122639946 /nfs/dbraw/zinc/63/99/46/1122639946.db2.gz VPWFPNUDJNTOBV-GXTWGEPZSA-N 1 0 299.842 3.883 20 10 CHCDRO CC[C@@H](O)CCC[NH2+][C@H](CC)c1cc(Cl)ccc1O ZINC000775524935 1122641983 /nfs/dbraw/zinc/64/19/83/1122641983.db2.gz CTXHIXYCCDHGLL-TZMCWYRMSA-N 1 0 285.815 3.637 20 10 CHCDRO CC[C@H]([NH2+]CC1(C)CC1)c1cc(Cl)ccc1O ZINC000775524481 1122642661 /nfs/dbraw/zinc/64/26/61/1122642661.db2.gz ADWQQADKAZWSPO-LBPRGKRZSA-N 1 0 253.773 3.886 20 10 CHCDRO CCOc1ccccc1CC[NH2+][C@@H](C)c1ccccc1O ZINC000183596310 1129068528 /nfs/dbraw/zinc/06/85/28/1129068528.db2.gz POFSTYJROUGINE-AWEZNQCLSA-N 1 0 285.387 3.684 20 10 CHCDRO CC[C@H]([NH2+]CCOC1CCC1)c1cc(Cl)ccc1O ZINC000775534405 1122650543 /nfs/dbraw/zinc/65/05/43/1122650543.db2.gz DWRYXEQPMOYXBO-AWEZNQCLSA-N 1 0 283.799 3.655 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1C[C@@H]1c1ccccc1)c1ccccc1O ZINC000183600065 1129068848 /nfs/dbraw/zinc/06/88/48/1129068848.db2.gz UKWFVBPAEDYNPA-JLJPHGGASA-N 1 0 267.372 3.847 20 10 CHCDRO CC[C@H](Nc1cnn(-c2cc[nH+]cc2)c1)c1ccccc1O ZINC000775542511 1122655560 /nfs/dbraw/zinc/65/55/60/1122655560.db2.gz PWBDELBSTLHKPO-INIZCTEOSA-N 1 0 294.358 3.536 20 10 CHCDRO CC[C@H]([NH2+]CC[C@@H]1CCOC1)c1cc(Cl)ccc1O ZINC000775552477 1122661828 /nfs/dbraw/zinc/66/18/28/1122661828.db2.gz VQSLIALKKNTYBG-RISCZKNCSA-N 1 0 283.799 3.513 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H]2C[C@@H](C)Oc3ccccc32)c1O ZINC000295108928 1122742614 /nfs/dbraw/zinc/74/26/14/1122742614.db2.gz USBJHMZAXOHMDY-CZUORRHYSA-N 1 0 283.371 3.703 20 10 CHCDRO Cc1cc(C[N@H+]2C[C@@H](C)[C@H]2C)ccc1N1CCCCC1 ZINC001194702080 1122789481 /nfs/dbraw/zinc/78/94/81/1122789481.db2.gz OTGQCBLHNGTCGM-HZPDHXFCSA-N 1 0 272.436 3.826 20 10 CHCDRO Cc1csc([C@H](C)[NH2+][C@H](C)c2cc(C)ccc2O)n1 ZINC000080270199 1129079904 /nfs/dbraw/zinc/07/99/04/1129079904.db2.gz DUMGTTJHONUXDT-NEPJUHHUSA-N 1 0 276.405 3.877 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CCC[C@H]2CC(C)(C)C)c1 ZINC000775664842 1122875179 /nfs/dbraw/zinc/87/51/79/1122875179.db2.gz BTOMLEIHDIGAAY-AWEZNQCLSA-N 1 0 277.408 3.801 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+](C)C(C2CC2)C2CC2)c1O ZINC000775667199 1122881386 /nfs/dbraw/zinc/88/13/86/1122881386.db2.gz FKERQQIDJTXWCR-UHFFFAOYSA-N 1 0 279.811 3.974 20 10 CHCDRO COc1cc(C)cc(C[NH2+][C@H](C)c2ccsc2)c1O ZINC000894675778 1122888753 /nfs/dbraw/zinc/88/87/53/1122888753.db2.gz JFAQQXRUIFDQQD-LLVKDONJSA-N 1 0 277.389 3.622 20 10 CHCDRO Cc1cccc(C[N@@H+]2[C@H](C)C[C@@H]3CCCC[C@@H]32)c1O ZINC000775701325 1122911952 /nfs/dbraw/zinc/91/19/52/1122911952.db2.gz KICDQJHAJIBREY-YCPHGPKFSA-N 1 0 259.393 3.854 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H](C3CCC3)C2)cc1 ZINC001196253383 1122913169 /nfs/dbraw/zinc/91/31/69/1122913169.db2.gz CWDWRRBRRZMSMT-QGZVFWFLSA-N 1 0 272.436 3.765 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+]2CCS[C@@H](C)[C@H]2C)c1O ZINC000775702383 1122914534 /nfs/dbraw/zinc/91/45/34/1122914534.db2.gz RZDMJBLKPBJJJA-MNOVXSKESA-N 1 0 285.840 3.680 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+]2[C@H](C)CC[C@@H]2C)c1O ZINC000775737469 1122928274 /nfs/dbraw/zinc/92/82/74/1122928274.db2.gz HVRAGKHXKSBLLE-PHIMTYICSA-N 1 0 253.773 3.727 20 10 CHCDRO C[C@H]1[C@@H](C(F)(F)F)CCC[N@@H+]1Cc1ccccc1O ZINC000776014050 1123034867 /nfs/dbraw/zinc/03/48/67/1123034867.db2.gz QGVSAHASFPGBQN-JQWIXIFHSA-N 1 0 273.298 3.555 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+]CCSC(F)(F)F)c1O ZINC000776014667 1123034820 /nfs/dbraw/zinc/03/48/20/1123034820.db2.gz AZTCKSVBJDNQIB-UHFFFAOYSA-N 1 0 299.745 3.697 20 10 CHCDRO COc1cc(C)cc(C[NH2+]C23CCC(CC2)CC3)c1O ZINC000894904957 1123076433 /nfs/dbraw/zinc/07/64/33/1123076433.db2.gz BSXJPHIKRZRMRY-UHFFFAOYSA-N 1 0 275.392 3.522 20 10 CHCDRO Clc1cscc1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000776154303 1123086429 /nfs/dbraw/zinc/08/64/29/1123086429.db2.gz TZIGUIZLWHLWIB-UHFFFAOYSA-N 1 0 279.792 3.626 20 10 CHCDRO COc1cc(C)cc(C[NH2+]C2(C3CCC3)CCC2)c1O ZINC000894983199 1123099078 /nfs/dbraw/zinc/09/90/78/1123099078.db2.gz APJTZAYCUCLZBP-UHFFFAOYSA-N 1 0 275.392 3.522 20 10 CHCDRO CC[N@@H+](Cc1ccc(N(C)C)cc1)C[C@H]1CC=CCC1 ZINC001201428517 1123100288 /nfs/dbraw/zinc/10/02/88/1123100288.db2.gz QMKRMOGOIMPZHI-INIZCTEOSA-N 1 0 272.436 3.931 20 10 CHCDRO CN(C)c1cc(F)c(C[NH2+][C@@H]2CCC(C)(C)C2)cc1F ZINC001201490943 1123109513 /nfs/dbraw/zinc/10/95/13/1123109513.db2.gz GCPLSABNGGITGN-GFCCVEGCSA-N 1 0 282.378 3.699 20 10 CHCDRO Cc1cccc(C[NH2+]C[C@@H]2SCCc3ccccc32)c1O ZINC000776222187 1123157062 /nfs/dbraw/zinc/15/70/62/1123157062.db2.gz IAVWBBDRBYXBKH-KRWDZBQOSA-N 1 0 299.439 3.821 20 10 CHCDRO COc1cccc(C[NH2+]CCCC2CCCCC2)c1O ZINC000237192878 1123179153 /nfs/dbraw/zinc/17/91/53/1123179153.db2.gz GSALOQXYYUJUSY-UHFFFAOYSA-N 1 0 277.408 3.851 20 10 CHCDRO COc1cccc(C[NH2+]C2CCC(C(C)C)CC2)c1O ZINC000776251651 1123179775 /nfs/dbraw/zinc/17/97/75/1123179775.db2.gz QKUKXYJOYKACGE-UHFFFAOYSA-N 1 0 277.408 3.705 20 10 CHCDRO C[C@@H]([NH2+]CCN1CCCCC1)c1ccc2ccccc2c1O ZINC000193684335 1129104692 /nfs/dbraw/zinc/10/46/92/1129104692.db2.gz WMTOJLIAQLDWIW-OAHLLOKOSA-N 1 0 298.430 3.682 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H](C)[C@H]2CCCOC2)cc1 ZINC000780747101 1123226567 /nfs/dbraw/zinc/22/65/67/1123226567.db2.gz WMUBQBRDJREOTA-UXLLHSPISA-N 1 0 290.451 3.608 20 10 CHCDRO CC[C@@](C)([NH2+]Cc1cccc(OC)c1O)c1ccccc1 ZINC000107717805 1123226727 /nfs/dbraw/zinc/22/67/27/1123226727.db2.gz YGUIEMLRCPLFSL-GOSISDBHSA-N 1 0 285.387 3.816 20 10 CHCDRO CC[C@H]([NH2+]C1CC2(C1)COC(C)(C)C2)c1ccccc1O ZINC000895134422 1123248161 /nfs/dbraw/zinc/24/81/61/1123248161.db2.gz XNQDEZTWUNOWQG-DBQDNQAGSA-N 1 0 289.419 3.781 20 10 CHCDRO C[C@H](C[NH2+]C/C=C\c1ccc(N(C)C)cc1)c1ccccn1 ZINC000850342302 1123254885 /nfs/dbraw/zinc/25/48/85/1123254885.db2.gz KPLTVXCSSJGUKU-MWWKQMNYSA-N 1 0 295.430 3.554 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]CCc2cn(C)c3ccccc23)c1 ZINC000850380648 1123260409 /nfs/dbraw/zinc/26/04/09/1123260409.db2.gz ZWYNNBXZSMHFOE-UHFFFAOYSA-N 1 0 294.398 3.525 20 10 CHCDRO C[C@@]1(CC[NH2+]Cc2c(O)cccc2Cl)CC1(F)F ZINC000850380120 1123260626 /nfs/dbraw/zinc/26/06/26/1123260626.db2.gz BWTDZSFDSVPNIQ-GFCCVEGCSA-N 1 0 275.726 3.571 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CC[C@@]2(C)CC2(F)F)c(Cl)c1 ZINC000850380983 1123261350 /nfs/dbraw/zinc/26/13/50/1123261350.db2.gz SGLNFCURTOJNLF-ZDUSSCGKSA-N 1 0 289.753 3.879 20 10 CHCDRO CCSC1(C[NH2+]Cc2c(O)cc(C)cc2Cl)CC1 ZINC000850394422 1123261643 /nfs/dbraw/zinc/26/16/43/1123261643.db2.gz QOKVXBNEKWLBCR-UHFFFAOYSA-N 1 0 285.840 3.729 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2C)C(C)(C)C(F)F ZINC000850430681 1123266001 /nfs/dbraw/zinc/26/60/01/1123266001.db2.gz OFNFJOLXNUUPKX-GFCCVEGCSA-N 1 0 296.405 3.838 20 10 CHCDRO C[C@@H]([NH2+]C[C@H](C)c1ccccn1)c1cc(Cl)ccc1O ZINC000850482343 1123273100 /nfs/dbraw/zinc/27/31/00/1123273100.db2.gz OSTMTGOYHZUXGY-NWDGAFQWSA-N 1 0 290.794 3.895 20 10 CHCDRO CC[C@H]([NH2+]CCC1CC(OC)C1)c1ccc(N(C)C)cc1 ZINC000850481280 1123273118 /nfs/dbraw/zinc/27/31/18/1123273118.db2.gz IQTHATCXGYHDQM-UYJHFMRCSA-N 1 0 290.451 3.608 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2COC(C)(C)C2)c1O ZINC000850482592 1123273258 /nfs/dbraw/zinc/27/32/58/1123273258.db2.gz PZWRACBAHWLHEM-JQWIXIFHSA-N 1 0 283.799 3.572 20 10 CHCDRO C[C@@H](C[NH2+][C@@H](C)c1cc(Cl)ccc1O)c1ccccn1 ZINC000850482346 1123273284 /nfs/dbraw/zinc/27/32/84/1123273284.db2.gz OSTMTGOYHZUXGY-RYUDHWBXSA-N 1 0 290.794 3.895 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H](C)c2ccccn2)cc1 ZINC000850482394 1123273470 /nfs/dbraw/zinc/27/34/70/1123273470.db2.gz OYCSIDPQPLJWLE-CVEARBPZSA-N 1 0 297.446 3.992 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCN(C(C)(C)C)C1)c1ccc(C)cc1O ZINC000850492210 1123274157 /nfs/dbraw/zinc/27/41/57/1123274157.db2.gz BQKLXRZMJRZHAS-ZBFHGGJFSA-N 1 0 290.451 3.614 20 10 CHCDRO CC[C@H](COCC1CC1)[NH2+][C@H](CC)c1ccccc1O ZINC000850494118 1123275292 /nfs/dbraw/zinc/27/52/92/1123275292.db2.gz MZONSUVYKCQHGF-GDBMZVCRSA-N 1 0 277.408 3.638 20 10 CHCDRO CCC(O)(CC)C(C)(C)C[NH2+][C@H](C)c1cc(C)ccc1O ZINC000850500903 1123275401 /nfs/dbraw/zinc/27/54/01/1123275401.db2.gz IGKGQBHHRHUENY-CQSZACIVSA-N 1 0 293.451 3.929 20 10 CHCDRO C[C@H]1c2ccccc2C[C@H]1[NH2+][C@H]1CCc2cccc(O)c21 ZINC000850518662 1123279081 /nfs/dbraw/zinc/27/90/81/1123279081.db2.gz SMVJBFMSMBGHGU-AFAVFJNCSA-N 1 0 279.383 3.698 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2COC3(CCC3)C2)cc1 ZINC000850524517 1123280690 /nfs/dbraw/zinc/28/06/90/1123280690.db2.gz GTJOVUUGBHNJPK-HOCLYGCPSA-N 1 0 288.435 3.505 20 10 CHCDRO C[C@@H]([NH2+][C@H]1COC2(CCC2)C1)c1ccc2ccccc2c1O ZINC000850525081 1123280837 /nfs/dbraw/zinc/28/08/37/1123280837.db2.gz KYGCOUWPAYIGCM-UKRRQHHQSA-N 1 0 297.398 3.908 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCC[C@@H](C)O1)c1cc(Cl)ccc1O ZINC000850535310 1123286792 /nfs/dbraw/zinc/28/67/92/1123286792.db2.gz UWDPDLVNEVRBLC-MDZLAQPJSA-N 1 0 283.799 3.654 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@@]2(C)CC2(F)F)cc1 ZINC000850535379 1123287245 /nfs/dbraw/zinc/28/72/45/1123287245.db2.gz VSJOXUNQSPWIQD-IUODEOHRSA-N 1 0 282.378 3.839 20 10 CHCDRO C[C@H]1C[C@@H]([NH2+]C[C@H]2CCC[C@@H](C)O2)c2c1c(F)ccc2O ZINC000850535689 1123287350 /nfs/dbraw/zinc/28/73/50/1123287350.db2.gz ZHMZGIAWAPVMPB-FMCLSXCISA-N 1 0 293.382 3.627 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@]2(C)CC2(F)F)c(O)c1C ZINC000850538009 1123287882 /nfs/dbraw/zinc/28/78/82/1123287882.db2.gz ZYGOZQLISMGWJG-FZMZJTMJSA-N 1 0 269.335 3.705 20 10 CHCDRO CCSC1(C[NH2+][C@H](C)c2cc(Cl)ccc2O)CC1 ZINC000850553542 1123289919 /nfs/dbraw/zinc/28/99/19/1123289919.db2.gz YMDPEBBZEMMICY-SNVBAGLBSA-N 1 0 285.840 3.982 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1C(C)(C)C1(F)F)c1ccc(N(C)C)cc1 ZINC000850552669 1123290076 /nfs/dbraw/zinc/29/00/76/1123290076.db2.gz PHPNQAXRFJTJJG-SMDDNHRTSA-N 1 0 282.378 3.695 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCOC1(C)C)c1cc(Cl)ccc1O ZINC000850570195 1123294003 /nfs/dbraw/zinc/29/40/03/1123294003.db2.gz FPUZJCDLCCNTBQ-WDEREUQCSA-N 1 0 283.799 3.511 20 10 CHCDRO CO[C@H](C[NH2+][C@@H]1CCc2cccc(O)c21)C1CCCCC1 ZINC000850569596 1123294180 /nfs/dbraw/zinc/29/41/80/1123294180.db2.gz KADRQYCTMDRBRO-NVXWUHKLSA-N 1 0 289.419 3.564 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CCCc2ccco2)c(O)c1 ZINC000850569541 1123294368 /nfs/dbraw/zinc/29/43/68/1123294368.db2.gz HPJLHRIQOFJXBT-CQSZACIVSA-N 1 0 273.376 3.885 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@H]2CCOC2(C)C)cc1 ZINC000850571728 1123294938 /nfs/dbraw/zinc/29/49/38/1123294938.db2.gz VEBBUZBTHJPTRE-GOEBONIOSA-N 1 0 290.451 3.608 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H](O)[C@H](C)c2ccccc2)c(O)c1 ZINC000850573460 1123294993 /nfs/dbraw/zinc/29/49/93/1123294993.db2.gz MIRKEEXRLBQZNW-VCBZYWHSSA-N 1 0 299.414 3.516 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCOC1(C)C)c1cc(Cl)ccc1O ZINC000850572010 1123294998 /nfs/dbraw/zinc/29/49/98/1123294998.db2.gz XWFBOJUCPNBLEP-RISCZKNCSA-N 1 0 297.826 3.901 20 10 CHCDRO CCN(C)c1ccc(C[NH+]2CCC(c3ccon3)CC2)cc1 ZINC000852673314 1123411873 /nfs/dbraw/zinc/41/18/73/1123411873.db2.gz PTVASOAWSIJLPZ-UHFFFAOYSA-N 1 0 299.418 3.510 20 10 CHCDRO CCn1nccc1C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000853241456 1123429207 /nfs/dbraw/zinc/42/92/07/1123429207.db2.gz VKSISULCOOIVLX-CYBMUJFWSA-N 1 0 295.386 3.613 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@H](CCF)C2)cc1C ZINC000853564653 1123443551 /nfs/dbraw/zinc/44/35/51/1123443551.db2.gz RJHNEKKNZSULDG-AWEZNQCLSA-N 1 0 265.372 3.581 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)CC2=CCCOC2)cc1C(C)C ZINC000853561856 1123443775 /nfs/dbraw/zinc/44/37/75/1123443775.db2.gz SUWJFRIDXNWTAH-UHFFFAOYSA-N 1 0 289.419 3.603 20 10 CHCDRO CC(C)CCn1cccc1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000738430944 1123449804 /nfs/dbraw/zinc/44/98/04/1123449804.db2.gz VLNBAMMNRQAUCW-UHFFFAOYSA-N 1 0 298.430 3.759 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cccc(N)c1)c1cc(Cl)ccc1O ZINC000854217358 1123477775 /nfs/dbraw/zinc/47/77/75/1123477775.db2.gz LAYYXLMUNYDKDW-OAHLLOKOSA-N 1 0 290.794 3.869 20 10 CHCDRO Cc1cc(C[NH2+]Cc2ocnc2C)c(C)n1-c1ccccc1 ZINC000895404303 1123477878 /nfs/dbraw/zinc/47/78/78/1123477878.db2.gz DEFVQKSXYNWOQG-UHFFFAOYSA-N 1 0 295.386 3.680 20 10 CHCDRO Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(N(C)C)cc1)CC2 ZINC000113310459 1123518786 /nfs/dbraw/zinc/51/87/86/1123518786.db2.gz SMPKDWPCYIIGSK-LJQANCHMSA-N 1 0 280.415 3.838 20 10 CHCDRO CCCOc1ccc(C[NH2+]Cc2cc(C)ccc2O)cc1 ZINC000113323536 1123521449 /nfs/dbraw/zinc/52/14/49/1123521449.db2.gz SGBJYSJFCAHDOW-UHFFFAOYSA-N 1 0 285.387 3.779 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CC[C@H]2CC2(Cl)Cl)cc1C ZINC000856807408 1123570005 /nfs/dbraw/zinc/57/00/05/1123570005.db2.gz OBLRVMSANSFJHJ-LBPRGKRZSA-N 1 0 288.218 3.683 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]CC[C@H]1CC1(Cl)Cl)CC2 ZINC000857080441 1123584789 /nfs/dbraw/zinc/58/47/89/1123584789.db2.gz GMZPYJFFPITURH-QWRGUYRKSA-N 1 0 286.202 3.553 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CC[C@H]2CC2(F)F)cc1 ZINC000857081458 1123585789 /nfs/dbraw/zinc/58/57/89/1123585789.db2.gz PDMPXYRKCBTSBB-OCCSQVGLSA-N 1 0 282.378 3.839 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CC[C@@H]2CC2(F)F)cc1 ZINC000857081459 1123585817 /nfs/dbraw/zinc/58/58/17/1123585817.db2.gz PDMPXYRKCBTSBB-TZMCWYRMSA-N 1 0 282.378 3.839 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC[C@@H]2CC2(Cl)Cl)c(O)c1 ZINC000857082297 1123586099 /nfs/dbraw/zinc/58/60/99/1123586099.db2.gz MJOBFTXJSWCOIB-GHMZBOCLSA-N 1 0 288.218 3.935 20 10 CHCDRO CC(C)C[C@H]1C[C@H]([NH2+]Cc2cc(Cl)ccc2O)CCO1 ZINC000776951620 1123612632 /nfs/dbraw/zinc/61/26/32/1123612632.db2.gz XRQKULFJMKHMPA-CABCVRRESA-N 1 0 297.826 3.729 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2ccc(N(C)C)cc2C)cc1 ZINC000115629584 1123620280 /nfs/dbraw/zinc/62/02/80/1123620280.db2.gz MQZPPPTXYZSZDW-UHFFFAOYSA-N 1 0 268.404 3.659 20 10 CHCDRO Cc1cccc(C[NH2+][C@H](C)c2ccc(F)cc2C)c1O ZINC000896800696 1123628708 /nfs/dbraw/zinc/62/87/08/1123628708.db2.gz IFASJPHLEBCTNY-CYBMUJFWSA-N 1 0 273.351 3.999 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2cccn2CCC(C)C)c1 ZINC000858238380 1123639426 /nfs/dbraw/zinc/63/94/26/1123639426.db2.gz YSWSOADHWXUYIF-UHFFFAOYSA-N 1 0 286.419 3.838 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@]2(C)C[C@H]3C[C@H]3C2)c1 ZINC000858538331 1123660865 /nfs/dbraw/zinc/66/08/65/1123660865.db2.gz UEJWHKUDLFYXJG-ZJOBFFGXSA-N 1 0 259.393 3.787 20 10 CHCDRO C[C@H]([NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F)c1ccns1 ZINC000858576477 1123664903 /nfs/dbraw/zinc/66/49/03/1123664903.db2.gz KXHPPLUUAYRLAX-WCABBAIRSA-N 1 0 292.379 3.887 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1C[C@@H](OC)C1)c1cc(Cl)ccc1O ZINC000858592597 1123666024 /nfs/dbraw/zinc/66/60/24/1123666024.db2.gz GUADRYDTXROLDW-SCDSUCTJSA-N 1 0 283.799 3.511 20 10 CHCDRO CCOc1cccc(C[NH2+]C[C@H]2CCCC(F)(F)C2)c1O ZINC000281924023 1123750214 /nfs/dbraw/zinc/75/02/14/1123750214.db2.gz GZPPYZBMCMXGOS-LBPRGKRZSA-N 1 0 299.361 3.706 20 10 CHCDRO CCOCc1cc(C[NH2+]CCc2ccccc2)ccc1OC ZINC000195264281 1129143660 /nfs/dbraw/zinc/14/36/60/1129143660.db2.gz FMNZALXYFARLQO-UHFFFAOYSA-N 1 0 299.414 3.564 20 10 CHCDRO C[N@H+](Cc1cc(F)cc(Cl)c1)Cc1ccccc1O ZINC000777222313 1123786188 /nfs/dbraw/zinc/78/61/88/1123786188.db2.gz QLYOEHDPTQNQAQ-UHFFFAOYSA-N 1 0 279.742 3.817 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C2Cc3ccccc3C2)c(O)c1 ZINC000184005917 1129145403 /nfs/dbraw/zinc/14/54/03/1129145403.db2.gz LEQIITBBBNKGMR-ZDUSSCGKSA-N 1 0 267.372 3.519 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H]2CCC(F)(F)C2)cc1 ZINC000777240906 1123796061 /nfs/dbraw/zinc/79/60/61/1123796061.db2.gz FERBNARPYRHRIH-OCCSQVGLSA-N 1 0 282.378 3.981 20 10 CHCDRO CCOc1cccc(C[NH+]2C[C@@H](C)C(F)(F)[C@H](C)C2)c1O ZINC000862438380 1123809856 /nfs/dbraw/zinc/80/98/56/1123809856.db2.gz ALNAHDCAKUXXLK-VXGBXAGGSA-N 1 0 299.361 3.514 20 10 CHCDRO CCc1cccc(C[NH+]2C[C@H](C)C(F)(F)[C@@H](C)C2)c1O ZINC000862442048 1123810047 /nfs/dbraw/zinc/81/00/47/1123810047.db2.gz GHLGZYRQWFVKFG-RYUDHWBXSA-N 1 0 283.362 3.678 20 10 CHCDRO COC1CCC([NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)CC1 ZINC000840793403 1123810973 /nfs/dbraw/zinc/81/09/73/1123810973.db2.gz ZOOQBBCIBGBOCJ-NPZBDFSRSA-N 1 0 293.382 3.627 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000862473421 1123813162 /nfs/dbraw/zinc/81/31/62/1123813162.db2.gz PWKZRFMLBUEZBP-OLZOCXBDSA-N 1 0 283.824 3.516 20 10 CHCDRO COc1cc(C)ccc1C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000119822546 1123914734 /nfs/dbraw/zinc/91/47/34/1123914734.db2.gz POHJKBFWERDDTE-HNNXBMFYSA-N 1 0 298.430 3.920 20 10 CHCDRO CCOc1cccc(C[N@H+](CC)Cc2cccs2)c1O ZINC000119995551 1123923758 /nfs/dbraw/zinc/92/37/58/1123923758.db2.gz KYHKNCZGEFAQMK-UHFFFAOYSA-N 1 0 291.416 3.875 20 10 CHCDRO Nc1ccc(CC[NH2+]Cc2cccc(C(F)(F)F)c2)cc1 ZINC000084882015 1129154719 /nfs/dbraw/zinc/15/47/19/1129154719.db2.gz YGPIXSCBCDJWQS-UHFFFAOYSA-N 1 0 294.320 3.620 20 10 CHCDRO Oc1ccc2ccncc2c1C[N@H+](CC1CC1)CC1CCC1 ZINC000794711121 1123942112 /nfs/dbraw/zinc/94/21/12/1123942112.db2.gz PMKJTRBAUHWFEY-UHFFFAOYSA-N 1 0 296.414 3.953 20 10 CHCDRO C[C@@H](CCCC(F)(F)F)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000163232980 1123949412 /nfs/dbraw/zinc/94/94/12/1123949412.db2.gz CEHVWUYNBUDXNN-LBPRGKRZSA-N 1 0 288.357 3.963 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](CC)N1CCCC1)c1ccc(C)cc1O ZINC000794796999 1123949858 /nfs/dbraw/zinc/94/98/58/1123949858.db2.gz LPKLNEDHEKQQBB-DOTOQJQBSA-N 1 0 290.451 3.616 20 10 CHCDRO C[C@H](CCCC(F)(F)F)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000163233078 1123949996 /nfs/dbraw/zinc/94/99/96/1123949996.db2.gz CEHVWUYNBUDXNN-GFCCVEGCSA-N 1 0 288.357 3.963 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc([C@@H](C)O)cc1)c1ccc(C)cc1O ZINC000794801684 1123950330 /nfs/dbraw/zinc/95/03/30/1123950330.db2.gz JWTKUVDISCBWOU-RDTXWAMCSA-N 1 0 299.414 3.995 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1Cc2ccccc2O1)c1ccc(C)cc1O ZINC000794793521 1123950683 /nfs/dbraw/zinc/95/06/83/1123950683.db2.gz OWPGJYWEWYFRHD-NVXWUHKLSA-N 1 0 297.398 3.745 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](O)c1ccc(C)cc1)c1ccc(C)cc1O ZINC000794802499 1123950769 /nfs/dbraw/zinc/95/07/69/1123950769.db2.gz NNWGJFXGCOJDBK-PKOBYXMFSA-N 1 0 299.414 3.783 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)Cc1ccncc1)c1ccc(C)cc1O ZINC000794799975 1123950786 /nfs/dbraw/zinc/95/07/86/1123950786.db2.gz ASYDBTZTPCUUHI-WMLDXEAASA-N 1 0 284.403 3.768 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccn(C(C)C)n1)c1ccc(C)cc1O ZINC000794801597 1123951070 /nfs/dbraw/zinc/95/10/70/1123951070.db2.gz JTCRFQXLJCCHJL-MRXNPFEDSA-N 1 0 287.407 3.719 20 10 CHCDRO CC[C@@H]([NH2+][C@H](CC)C1CCOCC1)c1ccc(C)cc1O ZINC000794805611 1123955383 /nfs/dbraw/zinc/95/53/83/1123955383.db2.gz XWHSDGDQYFVWKB-IAGOWNOFSA-N 1 0 291.435 3.947 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H]2CC[C@H](C)[C@H](C)C2)c1O ZINC000085042232 1129155919 /nfs/dbraw/zinc/15/59/19/1129155919.db2.gz UOPDHVSXPPRQFG-GZBFAFLISA-N 1 0 277.408 3.705 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](O)c1cccc(C)c1)c1ccc(C)cc1O ZINC000794817030 1123959591 /nfs/dbraw/zinc/95/95/91/1123959591.db2.gz OHRLIJIPGMQYFX-HKUYNNGSSA-N 1 0 299.414 3.783 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)C[C@H]1CCOC1)c1ccc(C)cc1O ZINC000794811922 1123960102 /nfs/dbraw/zinc/96/01/02/1123960102.db2.gz UTNHRGDYIKGPQR-LZWOXQAQSA-N 1 0 277.408 3.556 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1CCC(C)(C)O1)c1ccc(C)cc1O ZINC000794818971 1123960993 /nfs/dbraw/zinc/96/09/93/1123960993.db2.gz ZWSOTYIGKUXIIK-DZGCQCFKSA-N 1 0 277.408 3.699 20 10 CHCDRO C[C@@H]([NH2+][C@@H](CO)CC1CCC1)c1ccc2ccccc2c1O ZINC000794833793 1123965989 /nfs/dbraw/zinc/96/59/89/1123965989.db2.gz LBQGRSDIJMYNJC-CZUORRHYSA-N 1 0 299.414 3.747 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)nc1C ZINC000314717417 1123993601 /nfs/dbraw/zinc/99/36/01/1123993601.db2.gz DUFKKWATRJOUHL-OAHLLOKOSA-N 1 0 283.419 3.615 20 10 CHCDRO COc1ccc2c(c1)CC[C@H]2[NH2+]Cc1ccc(N(C)C)cc1 ZINC000866218540 1124038775 /nfs/dbraw/zinc/03/87/75/1124038775.db2.gz RBXAGYIRKSCVAS-LJQANCHMSA-N 1 0 296.414 3.538 20 10 CHCDRO Cc1ncc([C@H](C)[NH2+][C@H](C)c2cc(F)ccc2O)s1 ZINC000866455461 1124067986 /nfs/dbraw/zinc/06/79/86/1124067986.db2.gz LUNYBMCKXYSGAN-BDAKNGLRSA-N 1 0 280.368 3.708 20 10 CHCDRO Cc1ncc([C@@H](C)[NH2+][C@@H](C)c2cc(C)ccc2O)s1 ZINC000866455699 1124068083 /nfs/dbraw/zinc/06/80/83/1124068083.db2.gz OSXLWHWPFACPCH-WDEREUQCSA-N 1 0 276.405 3.877 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@H](C)c2cnc(C)s2)c1O ZINC000866454398 1124068145 /nfs/dbraw/zinc/06/81/45/1124068145.db2.gz BEOMUSVQTAOHMH-NXEZZACHSA-N 1 0 292.404 3.578 20 10 CHCDRO CC[C@H]([NH2+]CCC(C)(C)OC)c1ccc(C)cc1O ZINC000866505540 1124074744 /nfs/dbraw/zinc/07/47/44/1124074744.db2.gz OBLKAQWOEPNSGE-AWEZNQCLSA-N 1 0 265.397 3.556 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@H](CF)c1ccc(F)cc1)CC2 ZINC000866597085 1124085806 /nfs/dbraw/zinc/08/58/06/1124085806.db2.gz MRNZWNMWJSSEBG-HUUCEWRRSA-N 1 0 289.325 3.819 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CCCn2nccc21)c1ccc(N(C)C)cc1 ZINC000866632721 1124091779 /nfs/dbraw/zinc/09/17/79/1124091779.db2.gz ORMZXCJXQVTDIN-IAGOWNOFSA-N 1 0 298.434 3.525 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CCc2ccc3[nH]ccc3c2)cc1C ZINC000799348745 1129166672 /nfs/dbraw/zinc/16/66/72/1129166672.db2.gz NJPGTAOAALFTHL-UHFFFAOYSA-N 1 0 294.398 3.823 20 10 CHCDRO COc1ccccc1[C@H](C)[NH2+]Cc1ccc(N(C)C)cc1C ZINC000122705232 1124524234 /nfs/dbraw/zinc/52/42/34/1124524234.db2.gz ZXROWPYFJSWJHG-HNNXBMFYSA-N 1 0 298.430 3.920 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H]2C[C@H](c3ccccc3F)C2)cc1 ZINC000797877113 1124589712 /nfs/dbraw/zinc/58/97/12/1124589712.db2.gz WNLKOIDWHJMUOB-WKILWMFISA-N 1 0 298.405 3.928 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1C[C@H]2CCC[C@@H]2O1)c1ccc(C)cc1O ZINC000872105730 1124683833 /nfs/dbraw/zinc/68/38/33/1124683833.db2.gz BDIDVTHRKCDQOE-OAOQPFQOSA-N 1 0 289.419 3.699 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2C[C@H]3CCC[C@H]3O2)c(O)c1C ZINC000872109334 1124685813 /nfs/dbraw/zinc/68/58/13/1124685813.db2.gz LMEUYRBBZIUGSL-QSJFSLAZSA-N 1 0 289.419 3.617 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ncc(Cl)s2)c(O)c1C ZINC000872116115 1124687208 /nfs/dbraw/zinc/68/72/08/1124687208.db2.gz OJHMFRAWLGLZPG-JTQLQIEISA-N 1 0 296.823 3.970 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1ccc(C)cc1O)[C@@H](O)c1ccccc1 ZINC000872133305 1124692435 /nfs/dbraw/zinc/69/24/35/1124692435.db2.gz PGJZOZJANRPQFF-LJHODMEESA-N 1 0 299.414 3.863 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2nccnc2C)c(O)c1C ZINC000872134333 1124692748 /nfs/dbraw/zinc/69/27/48/1124692748.db2.gz RKVKNYSNZZOGPI-TZMCWYRMSA-N 1 0 285.391 3.519 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CC[C@@H]2CNc3ccccc32)c1 ZINC000873237914 1124755228 /nfs/dbraw/zinc/75/52/28/1124755228.db2.gz VMLDOBULAXWCNN-LSDHHAIUSA-N 1 0 296.414 3.951 20 10 CHCDRO CNc1ccc(Nc2ccc([C@H]3CCC[NH2+]3)cc2)cc1 ZINC001159827790 1131294772 /nfs/dbraw/zinc/29/47/72/1131294772.db2.gz WDHFSRJKAGQRNO-QGZVFWFLSA-N 1 0 267.376 3.896 20 10 CHCDRO COc1ccccc1[C@@H](C)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000020096562 1124805128 /nfs/dbraw/zinc/80/51/28/1124805128.db2.gz VCKVIHDKARVCJD-CQSZACIVSA-N 1 0 284.403 3.612 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H]2CCCc3ccccc32)cc1 ZINC000020133401 1124808035 /nfs/dbraw/zinc/80/80/35/1124808035.db2.gz KSRGIKKXIOEGEM-IBGZPJMESA-N 1 0 280.415 3.920 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)CCc2ccco2)c(O)c1 ZINC000020145206 1124808294 /nfs/dbraw/zinc/80/82/94/1124808294.db2.gz FKCDXODLXFUTFN-UONOGXRCSA-N 1 0 273.376 3.966 20 10 CHCDRO Cc1cccc(C[NH2+]Cc2ccc(F)c(Cl)c2)c1O ZINC000124758477 1124810531 /nfs/dbraw/zinc/81/05/31/1124810531.db2.gz SHGHGHIJFCKVLB-UHFFFAOYSA-N 1 0 279.742 3.783 20 10 CHCDRO Cc1cccc(C[NH2+]CC(C)(C)c2cccs2)c1O ZINC000124823566 1124817885 /nfs/dbraw/zinc/81/78/85/1124817885.db2.gz FBZNDGVNTFRQIF-UHFFFAOYSA-N 1 0 275.417 3.830 20 10 CHCDRO COc1cccc(C[N@@H+]2CCC[C@H]2Cc2ccccc2)c1O ZINC000124974259 1124828843 /nfs/dbraw/zinc/82/88/43/1124828843.db2.gz JBWLLZJLGZPBRF-KRWDZBQOSA-N 1 0 297.398 3.608 20 10 CHCDRO Cc1ccc(C[N@@H+](Cc2ccccn2)C(C)C)c(O)c1 ZINC000876624086 1124966839 /nfs/dbraw/zinc/96/68/39/1124966839.db2.gz FVJYNPUSENBHGC-UHFFFAOYSA-N 1 0 270.376 3.506 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CC2(C(F)(F)F)CC2)cc1Cl ZINC000825893364 1124970406 /nfs/dbraw/zinc/97/04/06/1124970406.db2.gz XJZKTDQJFLQXLH-UHFFFAOYSA-N 1 0 293.716 3.786 20 10 CHCDRO COc1ccccc1[C@H]1CC[N@H+](Cc2ccc(C)cc2O)C1 ZINC000876756915 1124975278 /nfs/dbraw/zinc/97/52/78/1124975278.db2.gz ACFQWHDDIGNISW-HNNXBMFYSA-N 1 0 297.398 3.699 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)c2ccc(F)cc2F)c(O)c1 ZINC000876905832 1124988399 /nfs/dbraw/zinc/98/83/99/1124988399.db2.gz LKNOQFQEIHBLEG-LLVKDONJSA-N 1 0 277.314 3.830 20 10 CHCDRO CC(C)O[C@@H](C[NH2+]Cc1ccccc1O)c1ccccc1 ZINC000876996057 1124996588 /nfs/dbraw/zinc/99/65/88/1124996588.db2.gz MUDINKBUSYMRKL-SFHVURJKSA-N 1 0 285.387 3.648 20 10 CHCDRO Cc1ccc(C[NH2+]C2(c3ccc(F)cc3)CC2)c(O)c1 ZINC000877021779 1124997878 /nfs/dbraw/zinc/99/78/78/1124997878.db2.gz GIMGNMSUEXAERU-UHFFFAOYSA-N 1 0 271.335 3.619 20 10 CHCDRO Cc1ccc(C[NH2+][C@H]2CCc3c2cccc3C)c(O)c1 ZINC000877015260 1124998129 /nfs/dbraw/zinc/99/81/29/1124998129.db2.gz JGOMCGFYQNIQDV-KRWDZBQOSA-N 1 0 267.372 3.786 20 10 CHCDRO COc1cccc(F)c1[C@@H](C)[NH2+]Cc1ccc(C)cc1O ZINC000877041324 1125001556 /nfs/dbraw/zinc/00/15/56/1125001556.db2.gz FJFCHNRDVORHAN-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO COc1cc(Cl)ccc1C[NH2+]Cc1ccc(C)cc1O ZINC000877046134 1125001855 /nfs/dbraw/zinc/00/18/55/1125001855.db2.gz JAZVUUHJORKANY-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO CCOc1cc(C)ccc1C[NH2+]Cc1c(C)cccc1O ZINC000877087890 1125007908 /nfs/dbraw/zinc/00/79/08/1125007908.db2.gz VVUCTPNJWRXUSX-UHFFFAOYSA-N 1 0 285.387 3.698 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]Cc1nc(C(C)C)cs1 ZINC000877108631 1125009658 /nfs/dbraw/zinc/00/96/58/1125009658.db2.gz UGEZENBQJQJJHY-UHFFFAOYSA-N 1 0 276.405 3.570 20 10 CHCDRO CCc1cnccc1[C@H](C)[NH2+]Cc1ccc(C)cc1O ZINC000877134554 1125013242 /nfs/dbraw/zinc/01/32/42/1125013242.db2.gz SZWZGYXFCZRAKP-ZDUSSCGKSA-N 1 0 270.376 3.509 20 10 CHCDRO CCC(CC)[C@H]1C[C@@H]([NH2+]Cc2c(C)cccc2O)CCO1 ZINC000877167485 1125016117 /nfs/dbraw/zinc/01/61/17/1125016117.db2.gz ZOCXYQPRFNBMOK-MAUKXSAKSA-N 1 0 291.435 3.774 20 10 CHCDRO Cc1nc2c(s1)[C@H]([NH2+]Cc1ccc(C)cc1O)CCC2 ZINC000877183098 1125019516 /nfs/dbraw/zinc/01/95/16/1125019516.db2.gz YCARUOWYSDEZQS-CYBMUJFWSA-N 1 0 288.416 3.633 20 10 CHCDRO Cc1cccc(O)c1C[NH2+][C@H]1CCO[C@H](c2ccccc2)C1 ZINC000877376541 1125023734 /nfs/dbraw/zinc/02/37/34/1125023734.db2.gz JLMJIBWXKHVIMQ-LPHOPBHVSA-N 1 0 297.398 3.711 20 10 CHCDRO CC[C@H](c1ccncc1)[N@H+](C)Cc1ccc(C)cc1O ZINC000877532744 1125040209 /nfs/dbraw/zinc/04/02/09/1125040209.db2.gz WUSYSOSFQQNAPS-MRXNPFEDSA-N 1 0 270.376 3.679 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@@H](C)[C@@H]1CC1(F)F ZINC000877592650 1125050723 /nfs/dbraw/zinc/05/07/23/1125050723.db2.gz RIZDJRARIHCSNT-XEZPLFJOSA-N 1 0 296.405 3.625 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000877595197 1125052732 /nfs/dbraw/zinc/05/27/32/1125052732.db2.gz UVZHDGNDARDRDN-LBPRGKRZSA-N 1 0 287.325 3.865 20 10 CHCDRO COc1cccc(C)c1C[NH2+]Cc1cc(Cl)ccc1O ZINC000877613057 1125054695 /nfs/dbraw/zinc/05/46/95/1125054695.db2.gz VITXTEGVEMBXCM-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO CSC1CC[NH+](C/C=C/c2ccc(N(C)C)cc2)CC1 ZINC000877663186 1125060306 /nfs/dbraw/zinc/06/03/06/1125060306.db2.gz JYXXXQCMTGRDFR-SNAWJCMRSA-N 1 0 290.476 3.593 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]Cc1ccc(C(C)(C)C)o1 ZINC000877735016 1125070844 /nfs/dbraw/zinc/07/08/44/1125070844.db2.gz MZHGPVYDNYENCK-UHFFFAOYSA-N 1 0 273.376 3.881 20 10 CHCDRO Cc1cc(C[NH2+][C@H](C)c2ccccc2O)cc(Cl)n1 ZINC000877755625 1125071310 /nfs/dbraw/zinc/07/13/10/1125071310.db2.gz INGAZZOBMWAZND-LLVKDONJSA-N 1 0 276.767 3.600 20 10 CHCDRO CCO[P@@](C)(=O)CC[C@H](C)[NH2+][C@H](C)c1ccccc1O ZINC000877755920 1125072300 /nfs/dbraw/zinc/07/23/00/1125072300.db2.gz SVSVRXSGVQCLMY-MRRFBWAASA-N 1 0 299.351 3.766 20 10 CHCDRO Cc1cc(C[NH2+][C@H](C)c2ccccc2O)cc(C)c1O ZINC000877755432 1125073539 /nfs/dbraw/zinc/07/35/39/1125073539.db2.gz BAUPGOZJLOCRON-CYBMUJFWSA-N 1 0 271.360 3.565 20 10 CHCDRO Cc1cc(C[NH2+][C@@H](C)c2ccccc2O)cc(Cl)n1 ZINC000877758093 1125074000 /nfs/dbraw/zinc/07/40/00/1125074000.db2.gz INGAZZOBMWAZND-NSHDSACASA-N 1 0 276.767 3.600 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CC(C)(C)O2)c1ccccc1O ZINC000877757097 1125074247 /nfs/dbraw/zinc/07/42/47/1125074247.db2.gz FVUMZJUGBLGABQ-ZDUSSCGKSA-N 1 0 297.398 3.957 20 10 CHCDRO CC(C)Cc1ncc(C[NH2+][C@@H](C)c2ccccc2O)s1 ZINC000877757137 1125075109 /nfs/dbraw/zinc/07/51/09/1125075109.db2.gz IRGGGSPERWAHFO-LBPRGKRZSA-N 1 0 290.432 3.898 20 10 CHCDRO COc1ccc(C[C@H](C)[NH2+][C@@H](C)c2ccccc2O)cc1 ZINC000877757119 1125075419 /nfs/dbraw/zinc/07/54/19/1125075419.db2.gz IADFUTDRGZYQCX-KBPBESRZSA-N 1 0 285.387 3.683 20 10 CHCDRO CCc1cccc(C[NH2+][C@@H](C)c2ccccc2O)c1O ZINC000877758358 1125075566 /nfs/dbraw/zinc/07/55/66/1125075566.db2.gz VPIHDSPFQTYOPJ-LBPRGKRZSA-N 1 0 271.360 3.511 20 10 CHCDRO C[C@H]([NH2+]CC[C@H]1CCC2(CCC2)O1)c1ccccc1O ZINC000717108813 1125151859 /nfs/dbraw/zinc/15/18/59/1125151859.db2.gz GJLHTJGZGWOIKF-UONOGXRCSA-N 1 0 275.392 3.535 20 10 CHCDRO C[C@H]([NH2+]Cc1cccc2cccnc21)c1ccccc1O ZINC000127658114 1125209592 /nfs/dbraw/zinc/20/95/92/1125209592.db2.gz IHDKWKLEPGHJPJ-ZDUSSCGKSA-N 1 0 278.355 3.791 20 10 CHCDRO CCCc1nc(C[NH2+][C@H](C)c2ccccc2O)cs1 ZINC000879649301 1125222566 /nfs/dbraw/zinc/22/25/66/1125222566.db2.gz PZTXJJWWKBNOSX-LLVKDONJSA-N 1 0 276.405 3.652 20 10 CHCDRO CO[C@](C)([C@@H](C)[NH2+]Cc1cc(Cl)c(C)cc1O)C1CC1 ZINC000826120893 1125225487 /nfs/dbraw/zinc/22/54/87/1125225487.db2.gz LAHXFNZIENBLQA-BDJLRTHQSA-N 1 0 297.826 3.647 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)c2cccs2)cc1C ZINC000035052631 1125234213 /nfs/dbraw/zinc/23/42/13/1125234213.db2.gz FEVMYOUYGZCLMU-GFCCVEGCSA-N 1 0 261.390 3.916 20 10 CHCDRO Fc1ccccc1C1([NH2+]Cc2ccc3c(c2)CCO3)CC1 ZINC000130522212 1125362790 /nfs/dbraw/zinc/36/27/90/1125362790.db2.gz PZDFWYNALZZWHT-UHFFFAOYSA-N 1 0 283.346 3.540 20 10 CHCDRO Cc1ccccc1C1([NH2+]Cc2cc(F)cc(F)c2[O-])CC1 ZINC000883152567 1125373561 /nfs/dbraw/zinc/37/35/61/1125373561.db2.gz ZVZGUSLCDXNAIU-UHFFFAOYSA-N 1 0 289.325 3.758 20 10 CHCDRO C[C@@H]([NH2+]C[C@]1(C)OCCc2ccccc21)c1ccccc1O ZINC000883339971 1125397959 /nfs/dbraw/zinc/39/79/59/1125397959.db2.gz GNGKWDHMLZGUMQ-KUHUBIRLSA-N 1 0 297.398 3.531 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCC2(CCC2)O1)c1ccc(C)cc1O ZINC000883357024 1125401365 /nfs/dbraw/zinc/40/13/65/1125401365.db2.gz BBTOBHYITRFXDW-ZBFHGGJFSA-N 1 0 289.419 3.843 20 10 CHCDRO CCOc1cccc(C[NH2+]C2(c3ccccc3)CCC2)c1O ZINC000171129262 1125403379 /nfs/dbraw/zinc/40/33/79/1125403379.db2.gz LKNCJXVNJYOGQO-UHFFFAOYSA-N 1 0 297.398 3.960 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]CC[C@H]1CCC2(CCC2)O1 ZINC000717174134 1125422145 /nfs/dbraw/zinc/42/21/45/1125422145.db2.gz QSWAFWMTBQUSBH-CQSZACIVSA-N 1 0 295.810 3.627 20 10 CHCDRO CC/C=C/C[NH2+]Cc1ccc(N(CC)CC)c(F)c1 ZINC001202561395 1125430574 /nfs/dbraw/zinc/43/05/74/1125430574.db2.gz VLCNLPGKIYLHFC-BQYQJAHWSA-N 1 0 264.388 3.728 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1C[C@@H](C)O[C@@H](C)C1)c1ccc(N(C)C)cc1 ZINC000245584222 1129212601 /nfs/dbraw/zinc/21/26/01/1129212601.db2.gz IQCVLLGJQGYALP-KPEUIFRASA-N 1 0 290.451 3.749 20 10 CHCDRO CCOCc1ccccc1C[NH2+][C@H]1CCc2cccc(O)c21 ZINC000295861517 1129219226 /nfs/dbraw/zinc/21/92/26/1129219226.db2.gz GOAWMUKKUZCLAF-KRWDZBQOSA-N 1 0 297.398 3.706 20 10 CHCDRO CCOc1cccc(C[NH2+][C@H]2CCc3cccc(O)c32)c1 ZINC000295977002 1129220948 /nfs/dbraw/zinc/22/09/48/1129220948.db2.gz MZLQQDWRDQUNJH-INIZCTEOSA-N 1 0 283.371 3.568 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]C[C@H]1CCCCC1(F)F)CC2 ZINC000297211816 1129225462 /nfs/dbraw/zinc/22/54/62/1129225462.db2.gz GRNLYSRGFRLSDI-OLZOCXBDSA-N 1 0 281.346 3.795 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(F)c(C)c2)c1 ZINC000184911762 1129261588 /nfs/dbraw/zinc/26/15/88/1129261588.db2.gz NKQFXFRGJSVOTK-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO CCC[C@H](C[NH2+]Cc1ccc(N2CCCCC2)cc1)OC ZINC000378858515 1129284507 /nfs/dbraw/zinc/28/45/07/1129284507.db2.gz ZJDKEMSIPJHUOP-GOSISDBHSA-N 1 0 290.451 3.582 20 10 CHCDRO CC[N@H+](Cc1c(O)ccc2ccc(OC)cc21)C1CCC1 ZINC000738051597 1129389522 /nfs/dbraw/zinc/38/95/22/1129389522.db2.gz ATRYRHREMPAWHJ-UHFFFAOYSA-N 1 0 285.387 3.928 20 10 CHCDRO COc1cc(C)cc(C[N@@H+]2CCC=C(c3ccco3)C2)c1O ZINC000795651835 1129408757 /nfs/dbraw/zinc/40/87/57/1129408757.db2.gz SNOUZLGRHSCTQR-UHFFFAOYSA-N 1 0 299.370 3.592 20 10 CHCDRO COc1ccc(C[NH2+]C2(c3cccc(F)c3)CC2)cc1C ZINC000740018476 1129410362 /nfs/dbraw/zinc/41/03/62/1129410362.db2.gz UOERYRAXYJDBKF-UHFFFAOYSA-N 1 0 285.362 3.922 20 10 CHCDRO CC[N@H+](Cc1ccoc1)Cc1cc(C)c(C)cc1O ZINC000092935845 1129412274 /nfs/dbraw/zinc/41/22/74/1129412274.db2.gz VYDSGSXAEOCIIM-UHFFFAOYSA-N 1 0 259.349 3.624 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCO[C@H]1c1ccccc1)c1ccccc1O ZINC000248389510 1129415989 /nfs/dbraw/zinc/41/59/89/1129415989.db2.gz SFBPYOXTQGWWDC-XCRHUMRWSA-N 1 0 283.371 3.573 20 10 CHCDRO CCN1CCC[C@H]1C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000248527207 1129420460 /nfs/dbraw/zinc/42/04/60/1129420460.db2.gz GXHQODOJEUVJCW-ZBFHGGJFSA-N 1 0 298.430 3.680 20 10 CHCDRO C[C@H](c1cccc(O)c1)[N@H+](C)Cc1cc(Cl)ccc1O ZINC000093315669 1129420953 /nfs/dbraw/zinc/42/09/53/1129420953.db2.gz CWMZJBJNVOWOIM-LLVKDONJSA-N 1 0 291.778 3.944 20 10 CHCDRO C[C@H](Cc1ccc(O)cc1)[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC000093324533 1129421180 /nfs/dbraw/zinc/42/11/80/1129421180.db2.gz UYHOYHMXYNWAJQ-OAHLLOKOSA-N 1 0 298.430 3.521 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCO[C@H](c3ccccc3C)C2)c1 ZINC000093478530 1129424738 /nfs/dbraw/zinc/42/47/38/1129424738.db2.gz KSXFFSPAJXJTGP-IBGZPJMESA-N 1 0 297.398 3.583 20 10 CHCDRO C[C@@H](Cc1ccsc1)[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000094617881 1129448262 /nfs/dbraw/zinc/44/82/62/1129448262.db2.gz CKBYQARLIPUVJS-QWRGUYRKSA-N 1 0 279.380 3.875 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H]2CCC[C@H](C3CC3)C2)c1 ZINC000742377078 1129475589 /nfs/dbraw/zinc/47/55/89/1129475589.db2.gz LVJOPXUXRAFKGX-GOEBONIOSA-N 1 0 259.393 3.759 20 10 CHCDRO COc1ccc(C[NH2+]C[C@@H](C)Oc2cccc(C)c2)cc1C ZINC000742378068 1129476022 /nfs/dbraw/zinc/47/60/22/1129476022.db2.gz AVTCXSGSXALMHH-MRXNPFEDSA-N 1 0 299.414 3.869 20 10 CHCDRO Oc1cc2c(cc1C[N@@H+]1CC[C@H]1c1cccc(F)c1)CCC2 ZINC000743391701 1129522047 /nfs/dbraw/zinc/52/20/47/1129522047.db2.gz WSXIVBUIFPWIGV-SFHVURJKSA-N 1 0 297.373 3.967 20 10 CHCDRO COc1cc(C)c(C[NH2+]CC2C[C@@H](C)C[C@H](C)C2)c(O)c1 ZINC001206612463 1129522898 /nfs/dbraw/zinc/52/28/98/1129522898.db2.gz JZJGYGUCXPLCHQ-STQMWFEESA-N 1 0 291.435 3.871 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CC(C)(C)SC)cc1F ZINC000743500302 1129527736 /nfs/dbraw/zinc/52/77/36/1129527736.db2.gz WARRTPQXGAVXMO-UHFFFAOYSA-N 1 0 298.471 3.903 20 10 CHCDRO Oc1cc(OCc2ccccc2)ccc1C[NH2+][C@H]1CC12CC2 ZINC000822498250 1131385178 /nfs/dbraw/zinc/38/51/78/1131385178.db2.gz WVASVEJMAZKOTQ-SFHVURJKSA-N 1 0 295.382 3.613 20 10 CHCDRO CC[C@H](C)C[C@H](C)[NH2+][C@H](C)c1cc(OC)ccc1O ZINC000251963097 1129547529 /nfs/dbraw/zinc/54/75/29/1129547529.db2.gz VXJAGCRRFLBDPC-RWMBFGLXSA-N 1 0 265.397 3.876 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(C2=CCC[N@@H+](C)C2)cc1 ZINC001241570219 1129583636 /nfs/dbraw/zinc/58/36/36/1129583636.db2.gz XUMYPDJUDXNSCU-UHFFFAOYSA-N 1 0 266.388 3.813 20 10 CHCDRO CC[N@@H+](Cc1c(O)ccc2ccccc21)C[C@H]1CCCO1 ZINC000098051746 1129642584 /nfs/dbraw/zinc/64/25/84/1129642584.db2.gz YANKRJIUYATYGF-OAHLLOKOSA-N 1 0 285.387 3.546 20 10 CHCDRO C[C@H]([NH2+]CC1=CCCOC1)c1ccc2ccccc2c1O ZINC000379735740 1129652738 /nfs/dbraw/zinc/65/27/38/1129652738.db2.gz JQVWPVXUBRGGER-ZDUSSCGKSA-N 1 0 283.371 3.543 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H]2CCCSC2)cc1 ZINC000766447649 1129666033 /nfs/dbraw/zinc/66/60/33/1129666033.db2.gz XPPYVOAACQBALM-ZFWWWQNUSA-N 1 0 278.465 3.689 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H](C)c2ccncc2)cc1 ZINC000766491243 1129669439 /nfs/dbraw/zinc/66/94/39/1129669439.db2.gz YREXPOQKJCFWAL-CVEARBPZSA-N 1 0 297.446 3.992 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](C)c1ccncc1)c1ccc(N(C)C)cc1 ZINC000766487758 1129669578 /nfs/dbraw/zinc/66/95/78/1129669578.db2.gz KDTPGLNDDNOZMD-BEFAXECRSA-N 1 0 297.446 3.992 20 10 CHCDRO CC[C@H]([NH2+]CCNc1ccccc1)c1ccc(N(C)C)cc1 ZINC000766516240 1129678805 /nfs/dbraw/zinc/67/88/05/1129678805.db2.gz STPVULYCHXSQBD-IBGZPJMESA-N 1 0 297.446 3.905 20 10 CHCDRO COc1cc(Cl)cc(C[N@H+]2C[C@@H]3CCCC[C@@H]3C2)c1O ZINC000380325623 1129739568 /nfs/dbraw/zinc/73/95/68/1129739568.db2.gz PMUZFXYLQIISTB-TXEJJXNPSA-N 1 0 295.810 3.676 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C[C@@H]2C[C@H]2c2ccccc2)cc1F ZINC000767363965 1129789251 /nfs/dbraw/zinc/78/92/51/1129789251.db2.gz NDIAACYFQJNSRL-IRXDYDNUSA-N 1 0 298.405 3.785 20 10 CHCDRO C[N@H+](CCOC(C)(C)C)Cc1c(O)ccc2ccccc21 ZINC000767771939 1129812652 /nfs/dbraw/zinc/81/26/52/1129812652.db2.gz MLQBDJNWTQHKLA-UHFFFAOYSA-N 1 0 287.403 3.792 20 10 CHCDRO CCOC1(C[NH2+][C@@H](C)c2cc(C)ccc2O)CCCC1 ZINC000380515320 1129831158 /nfs/dbraw/zinc/83/11/58/1129831158.db2.gz APBBWAXQTQIBNH-AWEZNQCLSA-N 1 0 277.408 3.701 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2csc(C)c2)c1 ZINC000381298940 1129836708 /nfs/dbraw/zinc/83/67/08/1129836708.db2.gz QHVCCZZRLQAFNQ-NSHDSACASA-N 1 0 277.389 3.622 20 10 CHCDRO Cc1cc(C[NH2+]Cc2cc(Cl)ccc2O)c(C)o1 ZINC000114504869 1129839925 /nfs/dbraw/zinc/83/99/25/1129839925.db2.gz ASVNOTUYURJRJS-UHFFFAOYSA-N 1 0 265.740 3.545 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)Cc2ccoc2)cc1 ZINC000768207292 1129840418 /nfs/dbraw/zinc/84/04/18/1129840418.db2.gz AUCONSOJDMURIT-UHFFFAOYSA-N 1 0 272.392 3.758 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCc3sccc3[C@H]2C)c1 ZINC000768206766 1129840834 /nfs/dbraw/zinc/84/08/34/1129840834.db2.gz GJHHDJJTGSDMBH-GFCCVEGCSA-N 1 0 273.401 3.881 20 10 CHCDRO CCOc1ccc(C[N@H+]2Cc3ccccc3[C@@H](C)C2)c(O)c1 ZINC000768195635 1129841829 /nfs/dbraw/zinc/84/18/29/1129841829.db2.gz PESKWVSBQFCKGE-AWEZNQCLSA-N 1 0 297.398 3.910 20 10 CHCDRO COc1cccc(O)c1C[N@@H+]1CCC[C@@H]1c1ccccc1 ZINC000768228404 1129845190 /nfs/dbraw/zinc/84/51/90/1129845190.db2.gz IMJSLKPZVONJPA-MRXNPFEDSA-N 1 0 283.371 3.738 20 10 CHCDRO CCOc1ccc(C[N@H+](CCC(C)C)C2CC2)c(O)c1 ZINC000768258796 1129847183 /nfs/dbraw/zinc/84/71/83/1129847183.db2.gz XCSYWMMSLKSGSD-UHFFFAOYSA-N 1 0 277.408 3.801 20 10 CHCDRO CN(C)c1ccc(C[N@H+](Cc2ccsc2)C2CC2)cc1 ZINC000768258215 1129849040 /nfs/dbraw/zinc/84/90/40/1129849040.db2.gz VCMLSXNWGXIRBT-UHFFFAOYSA-N 1 0 286.444 3.979 20 10 CHCDRO C[C@H](F)CC[NH2+][C@@H](C)c1cc(Br)ccc1O ZINC000382155178 1129854736 /nfs/dbraw/zinc/85/47/36/1129854736.db2.gz QZBJXBYRVGLUSW-IUCAKERBSA-N 1 0 290.176 3.553 20 10 CHCDRO CC[N@H+](Cc1cc(OC)c(C)cc1O)C1CCCCC1 ZINC000768438703 1129856674 /nfs/dbraw/zinc/85/66/74/1129856674.db2.gz XEGJTFOQUSAQKX-UHFFFAOYSA-N 1 0 277.408 3.864 20 10 CHCDRO CCc1cccc(C[NH2+]Cc2ccc(Cl)cc2)c1O ZINC000691450720 1129858183 /nfs/dbraw/zinc/85/81/83/1129858183.db2.gz YHNUPMBTCRALKJ-UHFFFAOYSA-N 1 0 275.779 3.898 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCc3cc(F)ccc3C2)cc1C ZINC000768482075 1129858221 /nfs/dbraw/zinc/85/82/21/1129858221.db2.gz PQAJODHLEOWLEE-UHFFFAOYSA-N 1 0 285.362 3.706 20 10 CHCDRO CCC1(CC)C[N@H+](Cc2cccc(C)c2O)CCS1 ZINC000768528362 1129860079 /nfs/dbraw/zinc/86/00/79/1129860079.db2.gz IZAAPOZOVCKXHS-UHFFFAOYSA-N 1 0 279.449 3.808 20 10 CHCDRO CC(C)C[N@H+](Cc1cc(Br)ccc1O)C1CC1 ZINC000768539968 1129860774 /nfs/dbraw/zinc/86/07/74/1129860774.db2.gz XXAJZRGLACUTSG-UHFFFAOYSA-N 1 0 298.224 3.775 20 10 CHCDRO CC(C)[N@H+](Cc1ccccn1)Cc1c(O)cccc1Cl ZINC000768927523 1129881287 /nfs/dbraw/zinc/88/12/87/1129881287.db2.gz WISGHDFWSIUXEB-UHFFFAOYSA-N 1 0 290.794 3.851 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)CCc2ccc(F)cc2)cc1 ZINC000768921226 1129881662 /nfs/dbraw/zinc/88/16/62/1129881662.db2.gz PGUYYINVLWOLNK-UHFFFAOYSA-N 1 0 286.394 3.566 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+][C@@H](C)c2ccsc2)c1 ZINC000800889326 1129897210 /nfs/dbraw/zinc/89/72/10/1129897210.db2.gz NDJCWAJRDWVUQY-NSHDSACASA-N 1 0 277.389 3.703 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2CC[C@H]2C2CCC2)cc1F ZINC000800969645 1129900783 /nfs/dbraw/zinc/90/07/83/1129900783.db2.gz SSBIJHMTWIKVPA-GOEBONIOSA-N 1 0 276.399 3.560 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCc3ccccc3OC2)c1 ZINC000800986517 1129902658 /nfs/dbraw/zinc/90/26/58/1129902658.db2.gz GWQIFFSBVTVFBJ-ZBFHGGJFSA-N 1 0 297.398 3.745 20 10 CHCDRO CCC[N@@H+](Cc1c(O)cccc1Cl)C[C@@H]1CCCCO1 ZINC000769337644 1129903455 /nfs/dbraw/zinc/90/34/55/1129903455.db2.gz GQRUTMXOBIZAST-ZDUSSCGKSA-N 1 0 297.826 3.827 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2[C@H](C)C[C@H]3CCCC[C@@H]32)c1 ZINC000769404166 1129906957 /nfs/dbraw/zinc/90/69/57/1129906957.db2.gz KCPOFQSWTJOMMY-CPUCHLNUSA-N 1 0 289.419 3.944 20 10 CHCDRO CCOc1ccc(C[N@@H+]2[C@H](C)C[C@H]3CCCC[C@@H]32)c(O)c1 ZINC000769403301 1129906981 /nfs/dbraw/zinc/90/69/81/1129906981.db2.gz BUHGTQJVKLJULG-CPUCHLNUSA-N 1 0 289.419 3.944 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCc3cccc(F)c3[C@H]2C)c1 ZINC000769426660 1129908116 /nfs/dbraw/zinc/90/81/16/1129908116.db2.gz VTLKCQHWOGSPOW-CYBMUJFWSA-N 1 0 285.362 3.959 20 10 CHCDRO COc1cccc(C[N@H+](C)[C@@H](C)Cc2ccc(C)cc2)c1O ZINC000769462004 1129911668 /nfs/dbraw/zinc/91/16/68/1129911668.db2.gz FBVRVNSCSBHMMW-HNNXBMFYSA-N 1 0 299.414 3.772 20 10 CHCDRO CCOc1ccc(C[N@@H+]2C[C@@H](C)[C@H]2c2ccccc2)c(O)c1 ZINC000769540458 1129913231 /nfs/dbraw/zinc/91/32/31/1129913231.db2.gz PZPBMULNHSFILF-KUHUBIRLSA-N 1 0 297.398 3.984 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CCS[C@@H]2CCCC[C@H]21 ZINC000769497893 1129913632 /nfs/dbraw/zinc/91/36/32/1129913632.db2.gz HBWDNDVRDNFYOZ-UKRRQHHQSA-N 1 0 297.851 3.906 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCSC3(CCCCC3)C2)c1 ZINC000769501687 1129913726 /nfs/dbraw/zinc/91/37/26/1129913726.db2.gz NAZNPBLOVBWSDA-UHFFFAOYSA-N 1 0 291.460 3.952 20 10 CHCDRO Cc1cc(O)c(C[NH+]2C3CCCC2CCC3)cc1C ZINC000769497753 1129913870 /nfs/dbraw/zinc/91/38/70/1129913870.db2.gz ANWCONCXSHUBOJ-UHFFFAOYSA-N 1 0 259.393 3.916 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CCS[C@H]2CCCC[C@@H]21 ZINC000769497432 1129914156 /nfs/dbraw/zinc/91/41/56/1129914156.db2.gz DOGRWRZGNSYTNB-ZFWWWQNUSA-N 1 0 297.851 3.906 20 10 CHCDRO COc1cccc(O)c1C[N@@H+]1C[C@H](C)[C@@H]1c1ccccc1 ZINC000769542064 1129916556 /nfs/dbraw/zinc/91/65/56/1129916556.db2.gz ZBHKIUAKEUHDQL-SCLBCKFNSA-N 1 0 283.371 3.594 20 10 CHCDRO CCc1cccc(C[NH2+]Cc2ccc(F)cc2F)c1O ZINC000691466493 1129920311 /nfs/dbraw/zinc/92/03/11/1129920311.db2.gz OKHXNQDMTFEGML-UHFFFAOYSA-N 1 0 277.314 3.523 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+](C)[C@@H](C)[C@H]2Cc3ccccc3O2)c1 ZINC000770349841 1129946045 /nfs/dbraw/zinc/94/60/45/1129946045.db2.gz NLCKDUGRVIICAC-IFXJQAMLSA-N 1 0 297.398 3.525 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC000770509642 1129949301 /nfs/dbraw/zinc/94/93/01/1129949301.db2.gz QAAUFCDWNKHPOW-INIZCTEOSA-N 1 0 271.335 3.868 20 10 CHCDRO CCC[N@@H+](Cc1ccccc1O)C[C@@H](OC)c1ccccc1 ZINC000801925280 1129960155 /nfs/dbraw/zinc/96/01/55/1129960155.db2.gz KSMJBOGVZHMORX-LJQANCHMSA-N 1 0 299.414 3.992 20 10 CHCDRO CCc1cccc(C[NH2+][C@@H](C)c2ccccc2)c1O ZINC000691509546 1130021078 /nfs/dbraw/zinc/02/10/78/1130021078.db2.gz WWNIPDMIGYZQBI-ZDUSSCGKSA-N 1 0 255.361 3.805 20 10 CHCDRO CCNc1ccccc1C[NH2+][C@@H](C)c1ccccc1O ZINC000902643236 1130034338 /nfs/dbraw/zinc/03/43/38/1130034338.db2.gz KZHTZYXZJNOSNU-ZDUSSCGKSA-N 1 0 270.376 3.675 20 10 CHCDRO Cc1cscc1C[NH2+]Cc1cc(C)c(C)cc1O ZINC000785520752 1130038196 /nfs/dbraw/zinc/03/81/96/1130038196.db2.gz BSOSITDJVMMXPT-UHFFFAOYSA-N 1 0 261.390 3.669 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+][C@H]2CCCC(C)(C)C2)c1 ZINC000785548530 1130039324 /nfs/dbraw/zinc/03/93/24/1130039324.db2.gz MQXROKQFHNYVPU-AWEZNQCLSA-N 1 0 277.408 3.849 20 10 CHCDRO CCOc1cccc(C[NH2+]Cc2cccc3cc[nH]c32)c1O ZINC000786162213 1130081212 /nfs/dbraw/zinc/08/12/12/1130081212.db2.gz VQCHJHUOCIXCHD-UHFFFAOYSA-N 1 0 296.370 3.562 20 10 CHCDRO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)C[C@@H]1CCSC1 ZINC000787091555 1130131113 /nfs/dbraw/zinc/13/11/13/1130131113.db2.gz UBDKFKSDYNRWBB-INIZCTEOSA-N 1 0 292.492 3.716 20 10 CHCDRO COc1c(Cl)cccc1C[NH2+][C@H](C)c1ccccc1O ZINC000903245820 1130135501 /nfs/dbraw/zinc/13/55/01/1130135501.db2.gz JHQWAOYWLOSBGX-LLVKDONJSA-N 1 0 291.778 3.905 20 10 CHCDRO Oc1ccccc1C[N@H+](CC[C@H]1CCCO1)C1CCCC1 ZINC000787244639 1130140101 /nfs/dbraw/zinc/14/01/01/1130140101.db2.gz AOIQOKQDDGFBIM-QGZVFWFLSA-N 1 0 289.419 3.706 20 10 CHCDRO CCc1cccc(C[NH2+][C@@H](C)c2ccccc2O)c1 ZINC000787280274 1130142754 /nfs/dbraw/zinc/14/27/54/1130142754.db2.gz VTQAQTKUEIIZQB-ZDUSSCGKSA-N 1 0 255.361 3.805 20 10 CHCDRO CC1(C)C[C@@H]([NH2+][C@@H]2CCc3cccc(O)c32)CCS1 ZINC000903281821 1130144781 /nfs/dbraw/zinc/14/47/81/1130144781.db2.gz INEIOACEPDDKKQ-QWHCGFSZSA-N 1 0 277.433 3.643 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C2CC3(C2)CO[C@@H](C)C3)c(O)c1 ZINC000903281164 1130145347 /nfs/dbraw/zinc/14/53/47/1130145347.db2.gz FOBRYHLTXIUXES-KZGGZSBBSA-N 1 0 289.419 3.617 20 10 CHCDRO COC(C)(C)[C@@H](C)[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000903329955 1130156783 /nfs/dbraw/zinc/15/67/83/1130156783.db2.gz GECRHBNATDHQHW-VHSXEESVSA-N 1 0 271.788 3.510 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](c2ccncc2)C2CC2)c1 ZINC000903426599 1130175051 /nfs/dbraw/zinc/17/50/51/1130175051.db2.gz BFGLPWIPXSUZPR-FZKQIMNGSA-N 1 0 282.387 3.898 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H](C(C)C)[C@@H](O)c2ccccc2)c1 ZINC000788537961 1130193680 /nfs/dbraw/zinc/19/36/80/1130193680.db2.gz ZZCPYDLFELPTAK-MOPGFXCFSA-N 1 0 299.414 3.548 20 10 CHCDRO CC1(C)CC([NH2+]Cc2ccc(N3CCSCC3)cc2)C1 ZINC000788576497 1130195539 /nfs/dbraw/zinc/19/55/39/1130195539.db2.gz LOAOOOTZDIBUAC-UHFFFAOYSA-N 1 0 290.476 3.518 20 10 CHCDRO CSC1(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)CCC1 ZINC000788606953 1130196912 /nfs/dbraw/zinc/19/69/12/1130196912.db2.gz SJEMZUSTFPKZTL-ZDUSSCGKSA-N 1 0 279.449 3.945 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCC[C@@H](OC)C2)cc1 ZINC000746753337 1130198633 /nfs/dbraw/zinc/19/86/33/1130198633.db2.gz FEZNESDQJWDKFJ-SJLPKXTDSA-N 1 0 290.451 3.580 20 10 CHCDRO CC(C)[C@H]([NH2+][C@@H](C)c1ccccc1O)[C@@H](O)c1ccccc1 ZINC000788624885 1130199223 /nfs/dbraw/zinc/19/92/23/1130199223.db2.gz HCUKQVYEZQNOBK-JVPBZIDWSA-N 1 0 299.414 3.801 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+][C@@H]2C[C@@H](C)O[C@@H](C)C2)c(O)c1 ZINC000788684198 1130199900 /nfs/dbraw/zinc/19/99/00/1130199900.db2.gz BMVNWZKJLFSSCH-LXTVHRRPSA-N 1 0 277.408 3.616 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H]2c3ccccc3NC2(C)C)c1 ZINC000903949182 1130211953 /nfs/dbraw/zinc/21/19/53/1130211953.db2.gz ZTTZWCMUZKOMCZ-QGZVFWFLSA-N 1 0 282.387 3.736 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2c3ccccc3NC2(C)C)cc1 ZINC000903948573 1130212170 /nfs/dbraw/zinc/21/21/70/1130212170.db2.gz RPKXQOUWBJBRML-GOSISDBHSA-N 1 0 295.430 3.788 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2cnc(C)cc2C)c1 ZINC000396974444 1130216734 /nfs/dbraw/zinc/21/67/34/1130216734.db2.gz IVSATCLMGLLVLF-CQSZACIVSA-N 1 0 270.376 3.563 20 10 CHCDRO CCOC[C@H]([NH2+][C@H](C)c1ccc(N(C)CC)cc1)C(C)C ZINC000788985203 1130221975 /nfs/dbraw/zinc/22/19/75/1130221975.db2.gz OPTPGDXTKHAKFW-QAPCUYQASA-N 1 0 292.467 3.854 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)C1CCC(F)(F)CC1 ZINC001254224899 1130230437 /nfs/dbraw/zinc/23/04/37/1130230437.db2.gz DJYDLJUJVYFAFW-UHFFFAOYSA-N 1 0 269.335 3.792 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2ccnc3ccccc23)c1 ZINC000749110967 1130264337 /nfs/dbraw/zinc/26/43/37/1130264337.db2.gz WGKYWKQYDIDZSV-UHFFFAOYSA-N 1 0 278.355 3.539 20 10 CHCDRO Cc1cc(C)[nH+]c(NCc2c(O)ccc(Cl)c2F)c1 ZINC000790242490 1130300668 /nfs/dbraw/zinc/30/06/68/1130300668.db2.gz HEWRPEKHLYPRGJ-UHFFFAOYSA-N 1 0 280.730 3.809 20 10 CHCDRO CCn1ccc(C[N@H+](C)Cc2c(O)ccc3ccccc32)c1 ZINC000790452077 1130313671 /nfs/dbraw/zinc/31/36/71/1130313671.db2.gz RULYCYWRBIIWMO-UHFFFAOYSA-N 1 0 294.398 3.999 20 10 CHCDRO COc1cc(C[N@@H+]2CCc3cc(C)ccc3C2)c(O)cc1C ZINC000790452004 1130314659 /nfs/dbraw/zinc/31/46/59/1130314659.db2.gz OCNSUJIRPMQFMB-UHFFFAOYSA-N 1 0 297.398 3.576 20 10 CHCDRO CC[N@H+](Cc1cc2ccccc2[nH]1)Cc1ccccc1O ZINC001137320006 1130345300 /nfs/dbraw/zinc/34/53/00/1130345300.db2.gz UGJTURVFFDHTFK-UHFFFAOYSA-N 1 0 280.371 3.896 20 10 CHCDRO Cn1ccc2c1cc[nH+]c2-c1ccc(N2CCCCC2)nc1 ZINC001240582130 1130371405 /nfs/dbraw/zinc/37/14/05/1130371405.db2.gz BEJQFSISXUKEGS-UHFFFAOYSA-N 1 0 292.386 3.626 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]C[C@@H]1CCC2(CCCCC2)O1 ZINC000792192853 1130438013 /nfs/dbraw/zinc/43/80/13/1130438013.db2.gz RLPVWJFTRZQHAQ-HNNXBMFYSA-N 1 0 293.382 3.503 20 10 CHCDRO CC[NH+](CC)Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000792759314 1130495778 /nfs/dbraw/zinc/49/57/78/1130495778.db2.gz AXIUBOBSBHFBPA-UHFFFAOYSA-N 1 0 274.330 3.613 20 10 CHCDRO C[C@@H]1C[C@H]1C[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000792917865 1130506328 /nfs/dbraw/zinc/50/63/28/1130506328.db2.gz LNYSNFDRCFFLKZ-PWSUYJOCSA-N 1 0 286.341 3.517 20 10 CHCDRO COc1ccc([C@@H](C)[C@@H](C)[NH2+]Cc2cc(C)ccc2O)cc1 ZINC000747100329 1130517337 /nfs/dbraw/zinc/51/73/37/1130517337.db2.gz XCDORORDGGZGOB-LSDHHAIUSA-N 1 0 299.414 3.991 20 10 CHCDRO COCCC[C@H](Cc1ccccc1)[NH2+]Cc1ccccc1O ZINC000793233879 1130532392 /nfs/dbraw/zinc/53/23/92/1130532392.db2.gz WEZSZUHMDFVBCP-GOSISDBHSA-N 1 0 299.414 3.520 20 10 CHCDRO CN(C)c1ccc(C[N@H+](CC2CC2)C2CCC2)cc1F ZINC000793395726 1130552890 /nfs/dbraw/zinc/55/28/90/1130552890.db2.gz SAAQAAFIESCUJG-UHFFFAOYSA-N 1 0 276.399 3.656 20 10 CHCDRO CC(C)(C[NH2+]Cc1cc(Cl)ccc1O)[C@H]1CCCCO1 ZINC000758500420 1130615183 /nfs/dbraw/zinc/61/51/83/1130615183.db2.gz ZPDVWDSVXIHBJN-OAHLLOKOSA-N 1 0 297.826 3.731 20 10 CHCDRO CC(C)(C[NH2+]Cc1c(O)cccc1Cl)[C@H]1CCCCO1 ZINC000758498766 1130615371 /nfs/dbraw/zinc/61/53/71/1130615371.db2.gz NDCSKHNKRJXGPL-OAHLLOKOSA-N 1 0 297.826 3.731 20 10 CHCDRO C[C@@H](C[NH2+]Cc1ccccc1O)Oc1ccc(Cl)cc1 ZINC000758497023 1130615418 /nfs/dbraw/zinc/61/54/18/1130615418.db2.gz XPELUQCTLAPCID-LBPRGKRZSA-N 1 0 291.778 3.603 20 10 CHCDRO COc1cccc(C[NH2+]C2CCC3(CCCC3)CC2)c1O ZINC000811506771 1130617308 /nfs/dbraw/zinc/61/73/08/1130617308.db2.gz FCUTVQQRAFVMBY-UHFFFAOYSA-N 1 0 289.419 3.993 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CC2(CCC2)[C@@H]1C1CC1 ZINC000811513365 1130619048 /nfs/dbraw/zinc/61/90/48/1130619048.db2.gz HBNOMFLVGNUDAN-HNNXBMFYSA-N 1 0 277.795 3.810 20 10 CHCDRO COc1ccc2ccc(O)c(C[NH+]3CC4(C3)CCCC4)c2c1 ZINC001234526496 1130654631 /nfs/dbraw/zinc/65/46/31/1130654631.db2.gz WLSQVBSORKKDAI-UHFFFAOYSA-N 1 0 297.398 3.930 20 10 CHCDRO COc1ccc2ccc(O)c(C[N@@H+]3C[C@@H](C)CC34CC4)c2c1 ZINC001234569096 1130657046 /nfs/dbraw/zinc/65/70/46/1130657046.db2.gz JKSDPEJJTFIHHF-ZDUSSCGKSA-N 1 0 297.398 3.928 20 10 CHCDRO Cc1cc(O)c(CNc2cc3c(c[nH+]2)CCCC3)cc1C ZINC000812345683 1130686771 /nfs/dbraw/zinc/68/67/71/1130686771.db2.gz JJRADXPKFSZOME-UHFFFAOYSA-N 1 0 282.387 3.895 20 10 CHCDRO C[C@@H]1COCC[N@H+](Cc2cccc(-c3ccccc3)c2O)C1 ZINC001234989286 1130699742 /nfs/dbraw/zinc/69/97/42/1130699742.db2.gz CGRDVGSKNPPXME-HNNXBMFYSA-N 1 0 297.398 3.528 20 10 CHCDRO COC1CC[NH+](Cc2cccc(-c3ccccc3)c2O)CC1 ZINC001234989589 1130700260 /nfs/dbraw/zinc/70/02/60/1130700260.db2.gz FAKDZQCYNVBDOU-UHFFFAOYSA-N 1 0 297.398 3.670 20 10 CHCDRO C=Cc1ccc(CC[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC000812772459 1130712733 /nfs/dbraw/zinc/71/27/33/1130712733.db2.gz FEOKJJLLZWSSCL-UHFFFAOYSA-N 1 0 279.383 3.597 20 10 CHCDRO CCOc1ccc(O)c(CNc2cc3c(c[nH+]2)CCCC3)c1 ZINC000812782242 1130713671 /nfs/dbraw/zinc/71/36/71/1130713671.db2.gz SZVYZGSXXBCQQU-UHFFFAOYSA-N 1 0 298.386 3.677 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CC[C@]3(CC[C@@H](C)C3)C2)c1 ZINC000781927823 1130750400 /nfs/dbraw/zinc/75/04/00/1130750400.db2.gz HRQOYVDMGBWTBH-KDOFPFPSSA-N 1 0 289.419 3.803 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCc2ccccc2C1)c1ccccc1O ZINC000782053100 1130753003 /nfs/dbraw/zinc/75/30/03/1130753003.db2.gz OSSRJPQJRWDACH-CABCVRRESA-N 1 0 281.399 3.848 20 10 CHCDRO CC(C)(C)c1ccc(C[N@@H+]2CCc3cccnc3C2)c(O)c1 ZINC001235678033 1130765891 /nfs/dbraw/zinc/76/58/91/1130765891.db2.gz INRCZVOUYPKPJC-UHFFFAOYSA-N 1 0 296.414 3.643 20 10 CHCDRO CC(C)(C)c1ccc(C[NH+]2CCC(CF)CC2)c(O)c1 ZINC001235686209 1130767625 /nfs/dbraw/zinc/76/76/25/1130767625.db2.gz YPIAUWLYAIBZQS-UHFFFAOYSA-N 1 0 279.399 3.871 20 10 CHCDRO CC(C)(C)c1ccc(C[N@@H+]2CC[C@]3(CC3(F)F)C2)c(O)c1 ZINC001235685567 1130768097 /nfs/dbraw/zinc/76/80/97/1130768097.db2.gz QUDXQQSDTVPNNR-INIZCTEOSA-N 1 0 295.373 3.921 20 10 CHCDRO COc1cccc2c1CC[N@H+](Cc1cc(C)cc(C)c1O)C2 ZINC000782291768 1130769665 /nfs/dbraw/zinc/76/96/65/1130769665.db2.gz WHNVJQGVVDKMTI-UHFFFAOYSA-N 1 0 297.398 3.576 20 10 CHCDRO CCCc1nc(C)c(C[NH2+][C@@H](CC)c2ccccc2O)o1 ZINC000813886101 1130795016 /nfs/dbraw/zinc/79/50/16/1130795016.db2.gz VXUMVAPCMZBZLD-AWEZNQCLSA-N 1 0 288.391 3.882 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CC[C@@H](C)C1)c1ccc(Br)cc1O ZINC000783311587 1130814775 /nfs/dbraw/zinc/81/47/75/1130814775.db2.gz XQPVLJZEMSYELR-JFGNBEQYSA-N 1 0 298.224 3.994 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CC[C@@H](C)C1)c1cc(Cl)ccc1O ZINC000783308224 1130815785 /nfs/dbraw/zinc/81/57/85/1130815785.db2.gz CJLLIKCIHGSVOR-FOGDFJRCSA-N 1 0 253.773 3.885 20 10 CHCDRO C[C@H](CCc1cccc(F)c1)[N@H+](C)Cc1ccccc1O ZINC000783424589 1130823803 /nfs/dbraw/zinc/82/38/03/1130823803.db2.gz PBDYXAVBUPGNTO-CQSZACIVSA-N 1 0 287.378 3.984 20 10 CHCDRO CC(C)CCC[N@@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000783507967 1130830518 /nfs/dbraw/zinc/83/05/18/1130830518.db2.gz KRHSKVZCJUBPTJ-KRWDZBQOSA-N 1 0 291.435 3.809 20 10 CHCDRO C[C@@H](C[NH2+][C@H](C)c1ccccc1O)c1cccc(F)c1 ZINC000783500448 1130830579 /nfs/dbraw/zinc/83/05/79/1130830579.db2.gz GQXDJWKGXBCCNN-QWHCGFSZSA-N 1 0 273.351 3.986 20 10 CHCDRO CCN(CC)[C@H](C[NH2+][C@H](C)c1ccccc1O)CC(C)C ZINC000783500517 1130831144 /nfs/dbraw/zinc/83/11/44/1130831144.db2.gz WOXDURGVLCKMOU-CVEARBPZSA-N 1 0 292.467 3.799 20 10 CHCDRO C[C@@H](C[NH2+][C@@H](C)c1ccccc1O)c1ccc(F)cc1 ZINC000783508744 1130831279 /nfs/dbraw/zinc/83/12/79/1130831279.db2.gz KQTZGACBWVIIDO-STQMWFEESA-N 1 0 273.351 3.986 20 10 CHCDRO Cc1cccc(C)c1CC[NH2+][C@@H](C)c1ccccc1O ZINC000783517748 1130832184 /nfs/dbraw/zinc/83/21/84/1130832184.db2.gz IFNBUCUBHCBRCO-HNNXBMFYSA-N 1 0 269.388 3.902 20 10 CHCDRO C[C@H]([NH2+][C@@H]1c2ccccc2C[C@@H]1C)c1ccccc1O ZINC000783522543 1130833694 /nfs/dbraw/zinc/83/36/94/1130833694.db2.gz PFRFMCZHAWJXET-LXIYXOSZSA-N 1 0 267.372 3.976 20 10 CHCDRO C[C@H]([NH2+][C@H](c1cccnc1)C1CC1)c1ccccc1O ZINC000783526054 1130834819 /nfs/dbraw/zinc/83/48/19/1130834819.db2.gz RGAXDWVQTXPHPC-SJCJKPOMSA-N 1 0 268.360 3.589 20 10 CHCDRO CO[C@H]1C[N@H+](Cc2cc(C(C)C)c(C)cc2O)CC[C@@H]1C ZINC000783969003 1130866067 /nfs/dbraw/zinc/86/60/67/1130866067.db2.gz SHSKAPHEGDCJDC-UGSOOPFHSA-N 1 0 291.435 3.681 20 10 CHCDRO COc1cc(C)cc(C[N@@H+]2CC[C@H](C(C)(C)C)C2)c1O ZINC000784037699 1130871128 /nfs/dbraw/zinc/87/11/28/1130871128.db2.gz YUWNZMUMUOLHHN-AWEZNQCLSA-N 1 0 277.408 3.577 20 10 CHCDRO Cc1[nH+]c2ccccc2c(NCc2ccccc2O)c1C ZINC000784160061 1130886222 /nfs/dbraw/zinc/88/62/22/1130886222.db2.gz QPYJZRNSIVEQSM-UHFFFAOYSA-N 1 0 278.355 3.591 20 10 CHCDRO CS[C@@H](C[NH2+]Cc1cc(C)c(C)cc1O)C(C)(C)C ZINC000784625893 1130913852 /nfs/dbraw/zinc/91/38/52/1130913852.db2.gz KWMGUZQFVVTMDE-HNNXBMFYSA-N 1 0 281.465 3.876 20 10 CHCDRO Cc1cc(C[N@@H+]2CCc3sccc3C2)ccc1N(C)C ZINC000815014346 1130950688 /nfs/dbraw/zinc/95/06/88/1130950688.db2.gz LJLDNMRBBFWSFZ-UHFFFAOYSA-N 1 0 286.444 3.681 20 10 CHCDRO Cc1cc(C[NH+]2Cc3ccccc3C2)ccc1N(C)C ZINC000815041451 1130954744 /nfs/dbraw/zinc/95/47/44/1130954744.db2.gz RBMGPHWUZUJAER-UHFFFAOYSA-N 1 0 266.388 3.577 20 10 CHCDRO CCOCC(C)(C)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000815148339 1130966966 /nfs/dbraw/zinc/96/69/66/1130966966.db2.gz SPOKJFGNFVRHFN-UHFFFAOYSA-N 1 0 299.414 3.964 20 10 CHCDRO C[C@H](F)CC[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000815149721 1130967530 /nfs/dbraw/zinc/96/75/30/1130967530.db2.gz XKJAOLYPTRMONH-JTQLQIEISA-N 1 0 292.320 3.609 20 10 CHCDRO CC[NH2+][C@H](CCc1ccccc1)c1ccccc1O ZINC000815555290 1130998259 /nfs/dbraw/zinc/99/82/59/1130998259.db2.gz VNXPDLHOQVSEEI-MRXNPFEDSA-N 1 0 255.361 3.676 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CCN2CCCC[C@H]2C)c(O)c1 ZINC000815559869 1130999446 /nfs/dbraw/zinc/99/94/46/1130999446.db2.gz RTKZCJLSRDRGJJ-HZPDHXFCSA-N 1 0 290.451 3.534 20 10 CHCDRO CCc1nc(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)cs1 ZINC000815578815 1131002771 /nfs/dbraw/zinc/00/27/71/1131002771.db2.gz XUGNKPGGVBQZQK-GFCCVEGCSA-N 1 0 290.432 3.879 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CCOCc2ccccc2)c(O)c1 ZINC000815585531 1131003999 /nfs/dbraw/zinc/00/39/99/1131003999.db2.gz KEEPYOYUDCEKCH-MRXNPFEDSA-N 1 0 299.414 3.876 20 10 CHCDRO CCc1ccc(C[N@@H+]2CCC[C@@H]3CCC[C@H]32)c(O)c1 ZINC001236787245 1131005818 /nfs/dbraw/zinc/00/58/18/1131005818.db2.gz APSULZJHMJSYTI-GOEBONIOSA-N 1 0 259.393 3.719 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccc3c(c2)COC3)c(O)c1 ZINC000815596726 1131005982 /nfs/dbraw/zinc/00/59/82/1131005982.db2.gz CKWNJFTTZYPOOU-CQSZACIVSA-N 1 0 297.398 3.890 20 10 CHCDRO CCc1ccc(C[N@H+](C)Cc2cccc(F)c2F)c(O)c1 ZINC001236789458 1131006066 /nfs/dbraw/zinc/00/60/66/1131006066.db2.gz WYKOYQQFOVGWHQ-UHFFFAOYSA-N 1 0 291.341 3.865 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CC(C)(C)[C@@H](O)C(C)C)c(O)c1 ZINC000815598013 1131006575 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CC1=C[C@H](C)C[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816598035 1131114754 /nfs/dbraw/zinc/11/47/54/1131114754.db2.gz NUCGGQOHIGRCJZ-ZDUSSCGKSA-N 1 0 267.372 3.943 20 10 CHCDRO Oc1c(C[NH2+]CCC2(F)CCC2)ccc2ccccc21 ZINC000816612570 1131115823 /nfs/dbraw/zinc/11/58/23/1131115823.db2.gz SLNSFNONXHEYAD-UHFFFAOYSA-N 1 0 273.351 3.917 20 10 CHCDRO CCOC1CC([N@H+](C)Cc2ccc3ccccc3c2O)C1 ZINC000816611925 1131116404 /nfs/dbraw/zinc/11/64/04/1131116404.db2.gz ASPSLPPVJBJDJS-UHFFFAOYSA-N 1 0 285.387 3.545 20 10 CHCDRO COc1cccc(C[N@@H+]2CCC[C@H](c3ccccc3)C2)c1O ZINC000816619849 1131118125 /nfs/dbraw/zinc/11/81/25/1131118125.db2.gz XXCBBHGZSLBPGM-INIZCTEOSA-N 1 0 297.398 3.780 20 10 CHCDRO CC[N@H+](Cc1cccnc1)Cc1cc(Cl)cc(C)c1O ZINC001237685496 1131126713 /nfs/dbraw/zinc/12/67/13/1131126713.db2.gz DCYHIHKADFNCHF-UHFFFAOYSA-N 1 0 290.794 3.771 20 10 CHCDRO CC[N@H+](Cc1ccccn1)Cc1cc(F)cc(Cl)c1[O-] ZINC001237798207 1131140446 /nfs/dbraw/zinc/14/04/46/1131140446.db2.gz AHJAYJDBARCLBZ-UHFFFAOYSA-N 1 0 294.757 3.602 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SRVGBQRDOQBIAS-UHFFFAOYSA-N 1 0 297.185 3.726 20 10 CHCDRO CCn1ccc(C[N@H+](C)Cc2ccc(N3CCCC3)cc2)c1 ZINC001116771941 1131163808 /nfs/dbraw/zinc/16/38/08/1131163808.db2.gz WDJWNNAVRYLPNY-UHFFFAOYSA-N 1 0 297.446 3.740 20 10 CHCDRO CC[N@H+](Cc1ccccc1)Cc1cc(F)cc(C)c1O ZINC001238055738 1131164551 /nfs/dbraw/zinc/16/45/51/1131164551.db2.gz CVURQXKNXBPKKQ-UHFFFAOYSA-N 1 0 273.351 3.862 20 10 CHCDRO Cc1cc(F)cc(C[N@@H+]2CC[C@H](c3ccccc3)C2)c1O ZINC001238056374 1131165707 /nfs/dbraw/zinc/16/57/07/1131165707.db2.gz HTESCPOZTUKUQX-HNNXBMFYSA-N 1 0 285.362 3.829 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccncc1Cl ZINC000817576724 1131171465 /nfs/dbraw/zinc/17/14/65/1131171465.db2.gz VRVGVPZWAUKLFO-GFCCVEGCSA-N 1 0 289.810 3.652 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CC12CCSCC2)c1ccccc1O ZINC000817590663 1131175396 /nfs/dbraw/zinc/17/53/96/1131175396.db2.gz ZOXZNMYCHBQCKV-STQMWFEESA-N 1 0 277.433 3.576 20 10 CHCDRO C[C@H]([NH2+]CCc1ccc(N)cc1)c1csc(Cl)c1 ZINC000817956661 1131190207 /nfs/dbraw/zinc/19/02/07/1131190207.db2.gz AALIYLIZROOCFW-JTQLQIEISA-N 1 0 280.824 3.877 20 10 CHCDRO CCC[C@@H]([NH2+]CCc1ccc(N)cc1)c1ccccc1 ZINC000817955695 1131190572 /nfs/dbraw/zinc/19/05/72/1131190572.db2.gz FQCBRHBZBUZIJF-GOSISDBHSA-N 1 0 268.404 3.942 20 10 CHCDRO CCC[C@@H]([NH2+]CCc1ccc(N)cc1)C1CCCC1 ZINC000817956744 1131191123 /nfs/dbraw/zinc/19/11/23/1131191123.db2.gz BUVLUCOIDMCOJQ-QGZVFWFLSA-N 1 0 260.425 3.760 20 10 CHCDRO Cc1cc(N)cc(C[NH2+][C@H](C)c2cc(Cl)ccc2O)c1 ZINC000817981115 1131195082 /nfs/dbraw/zinc/19/50/82/1131195082.db2.gz QFACUKSCEHEPLB-LLVKDONJSA-N 1 0 290.794 3.787 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCCN3)c(O)c1 ZINC000817977971 1131195654 /nfs/dbraw/zinc/19/56/54/1131195654.db2.gz SFWZQHUNSFSESS-CQSZACIVSA-N 1 0 296.414 3.910 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@@H]1C[C@@H](C)O[C@@H]1C ZINC001118005826 1131207901 /nfs/dbraw/zinc/20/79/01/1131207901.db2.gz CRVDQFJJBISXOI-ZSAUSMIDSA-N 1 0 289.419 3.652 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCC[C@H](F)C2)c1 ZINC001118176396 1131214025 /nfs/dbraw/zinc/21/40/25/1131214025.db2.gz AZFIZULQJBEJDF-RWMBFGLXSA-N 1 0 251.345 3.632 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCC3)c1O ZINC001118246060 1131215920 /nfs/dbraw/zinc/21/59/20/1131215920.db2.gz MHCIYIZQIAWSJS-CYBMUJFWSA-N 1 0 297.398 3.740 20 10 CHCDRO Cc1cc(C[N@@H+](C)Cc2ccccc2O)cnc1C1CC1 ZINC001238626095 1131224921 /nfs/dbraw/zinc/22/49/21/1131224921.db2.gz VGWZBPKTJIKINY-UHFFFAOYSA-N 1 0 282.387 3.605 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)C2CCC(F)(F)CC2)cc1 ZINC000805840520 1131443084 /nfs/dbraw/zinc/44/30/84/1131443084.db2.gz RTEIUGYFIRBPPX-UHFFFAOYSA-N 1 0 282.378 3.762 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]C[C@H]1CSc2ccccc21 ZINC000824483855 1131470477 /nfs/dbraw/zinc/47/04/77/1131470477.db2.gz VTDNRHOTIKTZPH-LBPRGKRZSA-N 1 0 289.375 3.510 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+]CCCC2CCOCC2)c1O ZINC000824477381 1131470596 /nfs/dbraw/zinc/47/05/96/1131470596.db2.gz QXQDQMBZZDDPLL-UHFFFAOYSA-N 1 0 297.826 3.650 20 10 CHCDRO Fc1ccc(C2CC2)cc1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000824549067 1131473480 /nfs/dbraw/zinc/47/34/80/1131473480.db2.gz XTLHJPOLWAXVEA-UHFFFAOYSA-N 1 0 297.373 3.928 20 10 CHCDRO Oc1cc(OCc2ccccc2)ccc1C[NH+]1CC2(CC2)C1 ZINC000824533667 1131473538 /nfs/dbraw/zinc/47/35/38/1131473538.db2.gz JIECDUIGYLHNHH-UHFFFAOYSA-N 1 0 295.382 3.567 20 10 CHCDRO CN(Cc1cccs1)c1ccc(C[NH+]2CC3(CC3)C2)cc1 ZINC000824533730 1131473625 /nfs/dbraw/zinc/47/36/25/1131473625.db2.gz LOSJKIAOBIOTAY-UHFFFAOYSA-N 1 0 298.455 3.980 20 10 CHCDRO Cc1cccc(C[NH2+][C@H](C)c2ccc(F)c(C)c2)c1O ZINC000824548317 1131475022 /nfs/dbraw/zinc/47/50/22/1131475022.db2.gz FQDJZQCIKZKDDA-CYBMUJFWSA-N 1 0 273.351 3.999 20 10 CHCDRO COc1ccc(C[NH2+]C[C@]2(C)CC2(Cl)Cl)cc1C ZINC000824764731 1131481388 /nfs/dbraw/zinc/48/13/88/1131481388.db2.gz CRIILRSUNYYXIQ-ZDUSSCGKSA-N 1 0 288.218 3.677 20 10 CHCDRO Cc1c(CN2CC[C@H](C)C(F)(F)C2)c2ccccc2n1C ZINC001138252642 1131482129 /nfs/dbraw/zinc/48/21/29/1131482129.db2.gz OFCPPJYPRADIAF-LBPRGKRZSA-N 1 0 292.373 3.964 20 10 CHCDRO Cc1c(C[N@@H+]2CC[C@](C)(CF)C2)c2ccccc2n1C ZINC001138252464 1131482442 /nfs/dbraw/zinc/48/24/42/1131482442.db2.gz IAECJOPQANSHIM-QGZVFWFLSA-N 1 0 274.383 3.668 20 10 CHCDRO Cc1c(C[N@@H+]2CCc3ncsc3C2)c2ccccc2n1C ZINC001138258315 1131483395 /nfs/dbraw/zinc/48/33/95/1131483395.db2.gz PPXYIVDGTHSLPO-UHFFFAOYSA-N 1 0 297.427 3.502 20 10 CHCDRO CC(C)[C@@H]1C[C@@H](C[NH2+]Cc2cc(Cl)ccc2O)CCO1 ZINC000824798546 1131485188 /nfs/dbraw/zinc/48/51/88/1131485188.db2.gz DRWMZJHQDZJLMG-LRDDRELGSA-N 1 0 297.826 3.586 20 10 CHCDRO Oc1cc(Br)ccc1C[N@@H+]1CCC2(CCC2)C1 ZINC000824819790 1131485695 /nfs/dbraw/zinc/48/56/95/1131485695.db2.gz SNDCOOJBFXZNKJ-UHFFFAOYSA-N 1 0 296.208 3.531 20 10 CHCDRO Cc1cc(O)c(C[NH+]2CCC(C(F)F)CC2)cc1Cl ZINC000824825138 1131487532 /nfs/dbraw/zinc/48/75/32/1131487532.db2.gz NHNAGSRDUMVEHV-UHFFFAOYSA-N 1 0 289.753 3.831 20 10 CHCDRO CCC1([NH2+]Cc2cc(OC)c(OC)cc2O)CCCCC1 ZINC000824926189 1131489694 /nfs/dbraw/zinc/48/96/94/1131489694.db2.gz MBVMAEZIBCVFMD-UHFFFAOYSA-N 1 0 293.407 3.612 20 10 CHCDRO CCn1ccnc1[C@@H](C)[NH2+]Cc1ccc2ccccc2c1O ZINC000825005555 1131491762 /nfs/dbraw/zinc/49/17/62/1131491762.db2.gz OUIPFDZBTAVNNB-CYBMUJFWSA-N 1 0 295.386 3.613 20 10 CHCDRO CN1CCCc2cc(C[N@@H+]3CCC34CCCC4)ccc21 ZINC001138354853 1131494211 /nfs/dbraw/zinc/49/42/11/1131494211.db2.gz WTXSZPHIIAQLQQ-UHFFFAOYSA-N 1 0 270.420 3.588 20 10 CHCDRO COc1ccc(C[NH2+]Cc2cc(Cl)c(C)cc2O)cc1 ZINC000825044531 1131494477 /nfs/dbraw/zinc/49/44/77/1131494477.db2.gz WXWNJCTZACMCEI-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO CCOCc1cc(C[NH2+]C2(C3(C)CC3)CC2)ccc1OC ZINC000825123636 1131500005 /nfs/dbraw/zinc/50/00/05/1131500005.db2.gz BASFMBYYXZHGJA-UHFFFAOYSA-N 1 0 289.419 3.654 20 10 CHCDRO CC[C@H]([NH2+]CC1(COC)CCCC1)c1ccccc1O ZINC000825244891 1131504638 /nfs/dbraw/zinc/50/46/38/1131504638.db2.gz AJPKZAITVVNANS-HNNXBMFYSA-N 1 0 277.408 3.640 20 10 CHCDRO CCC1(C[NH2+]Cc2cc(Cl)c(C)cc2O)CCOCC1 ZINC000825320360 1131506422 /nfs/dbraw/zinc/50/64/22/1131506422.db2.gz JRNFGKWMVJKVDL-UHFFFAOYSA-N 1 0 297.826 3.650 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H]2CCOC3(CCC3)C2)cc1Cl ZINC000825341282 1131507840 /nfs/dbraw/zinc/50/78/40/1131507840.db2.gz FTIJEEHCFLWWBL-CYBMUJFWSA-N 1 0 295.810 3.545 20 10 CHCDRO Cc1ccncc1[C@H](C)[NH2+]Cc1cc(Cl)c(C)cc1O ZINC000825405310 1131510132 /nfs/dbraw/zinc/51/01/32/1131510132.db2.gz GXPVTTOXYJHGAZ-LBPRGKRZSA-N 1 0 290.794 3.908 20 10 CHCDRO Cc1ccncc1[C@@H](C)[NH2+]Cc1cc(Cl)c(C)cc1O ZINC000825405309 1131510403 /nfs/dbraw/zinc/51/04/03/1131510403.db2.gz GXPVTTOXYJHGAZ-GFCCVEGCSA-N 1 0 290.794 3.908 20 10 CHCDRO CCCOc1ccc(C[NH2+][C@H](CO)C[C@H](C)CC)cc1C ZINC001202922905 1131602235 /nfs/dbraw/zinc/60/22/35/1131602235.db2.gz VFHURSQBJGDPTP-PBHICJAKSA-N 1 0 293.451 3.671 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]CC[C@H]2CCc3ccccc3N2)c1 ZINC000844904789 1131606592 /nfs/dbraw/zinc/60/65/92/1131606592.db2.gz QVYXUYYKKSXGRR-QGZVFWFLSA-N 1 0 296.414 3.607 20 10 CHCDRO C[C@@H]([NH2+]CC[C@@H]1CCc2ccccc2N1)c1ccccc1O ZINC000844924561 1131608505 /nfs/dbraw/zinc/60/85/05/1131608505.db2.gz LXAIIQXBMWQGMY-ZBFHGGJFSA-N 1 0 296.414 3.860 20 10 CHCDRO Cc1cc(C[N@H+]2[C@H](C)CCC[C@@H]2C)ccc1N(C)C ZINC001139669992 1131627200 /nfs/dbraw/zinc/62/72/00/1131627200.db2.gz UAGXLURETLVNSF-GASCZTMLSA-N 1 0 260.425 3.824 20 10 CHCDRO CC(C)[NH+](Cc1c(O)cccc1Br)C(C)C ZINC001140099098 1131663955 /nfs/dbraw/zinc/66/39/55/1131663955.db2.gz WPXYDVUWEONVPV-UHFFFAOYSA-N 1 0 286.213 3.774 20 10 CHCDRO Cc1ccc(C)c(C[N@H+](C)Cc2ccccc2)c1O ZINC001140181111 1131672791 /nfs/dbraw/zinc/67/27/91/1131672791.db2.gz VCKICWVSFWVGEX-UHFFFAOYSA-N 1 0 255.361 3.641 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCC[C@@H](C(F)(F)F)C2)c1O ZINC001140180129 1131673176 /nfs/dbraw/zinc/67/31/76/1131673176.db2.gz SSYXEWSHOQNZCB-GFCCVEGCSA-N 1 0 287.325 3.783 20 10 CHCDRO COc1ccc(C[N@H+](C)Cc2c(C)ccc(C)c2O)cc1 ZINC001140181210 1131673475 /nfs/dbraw/zinc/67/34/75/1131673475.db2.gz QHQGFSDOUOPDIR-UHFFFAOYSA-N 1 0 285.387 3.650 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCC[C@@H](c3ccccn3)C2)c1O ZINC001140182682 1131674016 /nfs/dbraw/zinc/67/40/16/1131674016.db2.gz XFFOWVQVDPOIIR-MRXNPFEDSA-N 1 0 296.414 3.784 20 10 CHCDRO COc1ccc(CC[N@H+](C)Cc2c(C)ccc(C)c2O)cc1 ZINC001140182668 1131674243 /nfs/dbraw/zinc/67/42/43/1131674243.db2.gz WTUXVUJLACENMB-UHFFFAOYSA-N 1 0 299.414 3.692 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC=C(C)CC2)c1 ZINC000845973083 1131674936 /nfs/dbraw/zinc/67/49/36/1131674936.db2.gz WVUYISUIVBIQNV-QWHCGFSZSA-N 1 0 261.365 3.550 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CCC12CCCC2 ZINC000845998257 1131676975 /nfs/dbraw/zinc/67/69/75/1131676975.db2.gz ASIGFHUGHTVZBS-UHFFFAOYSA-N 1 0 251.757 3.564 20 10 CHCDRO CCc1cccc(C[NH2+]Cc2cc(Cl)ccc2O)c1 ZINC000846055524 1131685708 /nfs/dbraw/zinc/68/57/08/1131685708.db2.gz MZBRIXNROFWUTG-UHFFFAOYSA-N 1 0 275.779 3.898 20 10 CHCDRO Cc1ccc(CC[C@H](C)[NH2+][C@@H]2CCc3cccc(O)c32)o1 ZINC000834602540 1131686620 /nfs/dbraw/zinc/68/66/20/1131686620.db2.gz RYACVLIHSJGXFS-BLLLJJGKSA-N 1 0 285.387 3.892 20 10 CHCDRO Cc1cccc(C[NH2+]CCC[C@@H]2CC2(Cl)Cl)c1O ZINC000846111114 1131687779 /nfs/dbraw/zinc/68/77/79/1131687779.db2.gz QOYXATPQTNYKIP-GFCCVEGCSA-N 1 0 288.218 3.764 20 10 CHCDRO CCc1cccc(C[NH2+]Cc2cc(C)ccc2O)c1 ZINC000846099984 1131689232 /nfs/dbraw/zinc/68/92/32/1131689232.db2.gz GMPKNNBPDKBVBU-UHFFFAOYSA-N 1 0 255.361 3.553 20 10 CHCDRO CCOCc1cc(C[NH2+]C2CC3(CCC3)C2)ccc1OC ZINC000846106668 1131691015 /nfs/dbraw/zinc/69/10/15/1131691015.db2.gz HTKRLWBDDYVNMV-UHFFFAOYSA-N 1 0 289.419 3.654 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CC2(C)CCCC2)c1O ZINC000846150813 1131691242 /nfs/dbraw/zinc/69/12/42/1131691242.db2.gz PHWDKZWJEZUBQH-LBPRGKRZSA-N 1 0 263.381 3.632 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]C2CC(C(C)(C)C)C2)c1O ZINC000846169034 1131693186 /nfs/dbraw/zinc/69/31/86/1131693186.db2.gz FIOLKORRRNDMOS-PNESKVBLSA-N 1 0 277.408 3.876 20 10 CHCDRO CC(C)(C[NH2+][C@@H]1CCc2cccc(O)c21)[C@@H]1CCCCO1 ZINC000834680628 1131693639 /nfs/dbraw/zinc/69/36/39/1131693639.db2.gz CYDLMTYWJCUSEO-ZBFHGGJFSA-N 1 0 289.419 3.564 20 10 CHCDRO CCCCCC[NH2+][C@@H](C)c1cccc(OC)c1O ZINC000846138565 1131693745 /nfs/dbraw/zinc/69/37/45/1131693745.db2.gz WIIZLOIDQVISCJ-LBPRGKRZSA-N 1 0 251.370 3.632 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H](C)c2ccsc2)c1O ZINC000846169285 1131693813 /nfs/dbraw/zinc/69/38/13/1131693813.db2.gz ZQQSKAMBQTYYOZ-QWRGUYRKSA-N 1 0 277.389 3.874 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@@H](C)c2ccsc2)c1O ZINC000846169286 1131694141 /nfs/dbraw/zinc/69/41/41/1131694141.db2.gz ZQQSKAMBQTYYOZ-WDEREUQCSA-N 1 0 277.389 3.874 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@H](C)Cc2ccccc2C)c1O ZINC000846141324 1131694897 /nfs/dbraw/zinc/69/48/97/1131694897.db2.gz HSHSFUOFSJMNAQ-HUUCEWRRSA-N 1 0 299.414 3.991 20 10 CHCDRO C[C@H]([NH2+]CC[C@]1(C)C[C@]1(F)Cl)c1cc(F)ccc1O ZINC000846185227 1131697885 /nfs/dbraw/zinc/69/78/85/1131697885.db2.gz RESCNIYONLGIMF-CUOATXAZSA-N 1 0 289.753 3.887 20 10 CHCDRO C[C@]1(CC[NH2+][C@@H]2CCc3cccc(O)c32)C[C@@]1(F)Cl ZINC000846184292 1131697932 /nfs/dbraw/zinc/69/79/32/1131697932.db2.gz JLMWVOXKMZKOTB-UGFHNGPFSA-N 1 0 283.774 3.674 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CCCC[C@H]1OC)c1ccc(C)cc1O ZINC000846201037 1131699894 /nfs/dbraw/zinc/69/98/94/1131699894.db2.gz INVNABVUUOAAHR-BFYDXBDKSA-N 1 0 277.408 3.699 20 10 CHCDRO Oc1cccc(Cl)c1C[N@H+]1C[C@H]2[C@H](CCC2(F)F)C1 ZINC001140338794 1131702453 /nfs/dbraw/zinc/70/24/53/1131702453.db2.gz QAEQWMBGYIIXOV-KOLCDFICSA-N 1 0 287.737 3.523 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CC[C@H](F)C(F)(F)CC1 ZINC001140338115 1131702520 /nfs/dbraw/zinc/70/25/20/1131702520.db2.gz VRIICMFNYKICFY-LBPRGKRZSA-N 1 0 293.716 3.615 20 10 CHCDRO Oc1cc2c(cc1C[NH+]1CCC(C3CC3)CC1)CCC2 ZINC000793633194 1131705553 /nfs/dbraw/zinc/70/55/53/1131705553.db2.gz ZHFXZZVBBVTHMC-UHFFFAOYSA-N 1 0 271.404 3.503 20 10 CHCDRO CSc1ccc(CC[NH2+][C@@H]2CCc3cccc(O)c32)cc1 ZINC000834790559 1131705712 /nfs/dbraw/zinc/70/57/12/1131705712.db2.gz RXSOGXBYCHIYDK-MRXNPFEDSA-N 1 0 299.439 3.934 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CSc2ccccc21)c1ccccc1O ZINC000834817875 1131707887 /nfs/dbraw/zinc/70/78/87/1131707887.db2.gz DTAHJKBGBIAZFN-QWHCGFSZSA-N 1 0 285.412 3.932 20 10 CHCDRO CC(C)C[C@@H](CN1CCCC1)[NH2+][C@H](C)c1ccccc1O ZINC000834843801 1131711926 /nfs/dbraw/zinc/71/19/26/1131711926.db2.gz MBQWWKBGWPMNGP-CVEARBPZSA-N 1 0 290.451 3.553 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccnc(C)c2)cc1 ZINC000834859924 1131712916 /nfs/dbraw/zinc/71/29/16/1131712916.db2.gz LYZZYDILGURISP-OAHLLOKOSA-N 1 0 283.419 3.697 20 10 CHCDRO CC[C@H](C)[C@H](C[NH2+][C@@H](C)c1c(C)cc(C)cc1O)OC ZINC000834860611 1131713359 /nfs/dbraw/zinc/71/33/59/1131713359.db2.gz SUTKXOWLBPDRRC-NOLJZWGESA-N 1 0 279.424 3.721 20 10 CHCDRO CC[C@H](C)[C@H](C[NH2+][C@H](C)c1c(C)cc(C)cc1O)OC ZINC000834860606 1131713398 /nfs/dbraw/zinc/71/33/98/1131713398.db2.gz SUTKXOWLBPDRRC-BJJXKVORSA-N 1 0 279.424 3.721 20 10 CHCDRO CCC1([NH2+][C@H](C)c2ccc(Br)cc2O)CC1 ZINC000834874792 1131715079 /nfs/dbraw/zinc/71/50/79/1131715079.db2.gz GWVWUJLCQJRBLV-SECBINFHSA-N 1 0 284.197 3.748 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCCc2ncccc2C)c(O)c1C ZINC000834883385 1131717331 /nfs/dbraw/zinc/71/73/31/1131717331.db2.gz KEUYZHGCUYRFJN-MRXNPFEDSA-N 1 0 298.430 3.996 20 10 CHCDRO C[C@]1(C[NH2+][C@H]2CCc3cccc(O)c32)CC1(Cl)Cl ZINC000834884050 1131717753 /nfs/dbraw/zinc/71/77/53/1131717753.db2.gz IRVJOGHYFHNFAC-GXFFZTMASA-N 1 0 286.202 3.553 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2cnccc2C)cc1 ZINC000834886298 1131718297 /nfs/dbraw/zinc/71/82/97/1131718297.db2.gz BIWXOMAXVFXOAP-OAHLLOKOSA-N 1 0 283.419 3.697 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1C[C@@H](C)n2ccnc21)c1ccc(N(C)C)cc1 ZINC000834897581 1131721399 /nfs/dbraw/zinc/72/13/99/1131721399.db2.gz UQFYEPDNMQAGCR-XOKHGSTOSA-N 1 0 298.434 3.696 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCOC(C)(C)C1)c1cc(Cl)ccc1O ZINC000834908932 1131729785 /nfs/dbraw/zinc/72/97/85/1131729785.db2.gz ISXCHWTYAFGMNG-VXGBXAGGSA-N 1 0 297.826 3.901 20 10 CHCDRO CCO[C@@H]1CCC[C@H]1[NH2+][C@H](CC)c1ccc(C)cc1O ZINC000834914810 1131733233 /nfs/dbraw/zinc/73/32/33/1131733233.db2.gz WNXJWQVKBBVSGW-BFYDXBDKSA-N 1 0 277.408 3.699 20 10 CHCDRO Oc1cc(Cl)ccc1C[NH+]1CCC2(CCC2)CC1 ZINC001140462964 1131749212 /nfs/dbraw/zinc/74/92/12/1131749212.db2.gz QBJGMDNNUPMJHC-UHFFFAOYSA-N 1 0 265.784 3.812 20 10 CHCDRO COC(C)(C)C[C@H](C)[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC000835040226 1131762504 /nfs/dbraw/zinc/76/25/04/1131762504.db2.gz OHHVXSRPIYYNFC-KIUWMYQTSA-N 1 0 290.451 3.559 20 10 CHCDRO C[C@@H](CC(F)(F)F)[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC000835046740 1131764339 /nfs/dbraw/zinc/76/43/39/1131764339.db2.gz MLWLYDFLKPNBHR-RXNFCKPNSA-N 1 0 286.341 3.696 20 10 CHCDRO C[C@H](c1cccnc1)[N@H+](C)C/C=C\c1ccc(N(C)C)cc1 ZINC000835048545 1131765711 /nfs/dbraw/zinc/76/57/11/1131765711.db2.gz UJMVUKKRJVRYRS-MWWKQMNYSA-N 1 0 295.430 3.854 20 10 CHCDRO CC[N@H+](C/C=C/c1ccc(N(C)C)cc1)Cc1ccncc1 ZINC000835054828 1131766776 /nfs/dbraw/zinc/76/67/76/1131766776.db2.gz ZKALTQKUCAPAFY-AATRIKPKSA-N 1 0 295.430 3.683 20 10 CHCDRO Cc1cc(C[NH2+][C@H](C)c2ccsc2)ccc1N(C)C ZINC000772994837 1131873429 /nfs/dbraw/zinc/87/34/29/1131873429.db2.gz BSKUDTBBMFFJSJ-CYBMUJFWSA-N 1 0 274.433 3.973 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCCC(F)(F)C1)c1ccccc1O ZINC000282753118 1131892916 /nfs/dbraw/zinc/89/29/16/1131892916.db2.gz NUZSSLRJUNBSIV-NEPJUHHUSA-N 1 0 269.335 3.868 20 10 CHCDRO CCC[C@@H]1CCCC[N@@H+]1Cc1ccc(O)c(C)c1O ZINC001140746008 1131905599 /nfs/dbraw/zinc/90/55/99/1131905599.db2.gz SBYYUQBXIWRGHA-CQSZACIVSA-N 1 0 263.381 3.561 20 10 CHCDRO Cc1c(O)ccc(C[N@@H+]2CCCC3(CC(F)C3)CC2)c1O ZINC001140747784 1131906383 /nfs/dbraw/zinc/90/63/83/1131906383.db2.gz LZQGGPFKXLJTPZ-UHFFFAOYSA-N 1 0 293.382 3.510 20 10 CHCDRO Cc1cc(C[NH2+][C@@H](C)c2ccccc2)ccc1N(C)C ZINC000772999563 1131913397 /nfs/dbraw/zinc/91/33/97/1131913397.db2.gz MQCNEDBMODVVQV-HNNXBMFYSA-N 1 0 268.404 3.912 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CC=CCC1)c1ccc(N(C)C)cc1 ZINC000773001093 1131914738 /nfs/dbraw/zinc/91/47/38/1131914738.db2.gz NDOCELIJPDXPPV-DOTOQJQBSA-N 1 0 258.409 3.902 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)C1CCC1)c1ccc(N(C)C)cc1 ZINC000773102066 1131946377 /nfs/dbraw/zinc/94/63/77/1131946377.db2.gz FLGJCKREUJYDOY-DYVFJYSZSA-N 1 0 260.425 3.982 20 10 CHCDRO CCN(CC)c1ccc(C[NH+]2C[C@@H](C)C[C@H](C)C2)c(O)c1 ZINC001140856044 1131948840 /nfs/dbraw/zinc/94/88/40/1131948840.db2.gz PTEINOZBRNTWKF-GJZGRUSLSA-N 1 0 290.451 3.716 20 10 CHCDRO CC[N@H+](Cc1[nH]cc(C)c1C)Cc1ccc(N(C)C)cc1 ZINC001140864304 1131952796 /nfs/dbraw/zinc/95/27/96/1131952796.db2.gz MUDODDQNDQAJRK-UHFFFAOYSA-N 1 0 285.435 3.720 20 10 CHCDRO Cc1cc(NCc2cc3ccccc3cc2O)cc(C)[nH+]1 ZINC001171405138 1131971690 /nfs/dbraw/zinc/97/16/90/1131971690.db2.gz QBATYJBPJJIBKO-UHFFFAOYSA-N 1 0 278.355 3.591 20 10 CHCDRO CC[N@H+](Cc1cccc(F)c1)Cc1ccc(C)cc1O ZINC001140958147 1131973670 /nfs/dbraw/zinc/97/36/70/1131973670.db2.gz SNMLPSSWGHELJL-UHFFFAOYSA-N 1 0 273.351 3.862 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CC12CC2)c1cc(Br)ccc1O ZINC000715222391 1131981396 /nfs/dbraw/zinc/98/13/96/1131981396.db2.gz IZYBXJQYLPJJEH-WCQYABFASA-N 1 0 296.208 3.748 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]CC1C[C@H]2CC[C@@H](C1)S2 ZINC000716041761 1132002902 /nfs/dbraw/zinc/00/29/02/1132002902.db2.gz JLTKWIBEAJXXOI-FTNCPSPGSA-N 1 0 297.851 3.809 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2ccns2)cc1 ZINC000716045338 1132003255 /nfs/dbraw/zinc/00/32/55/1132003255.db2.gz ARNUBKONXOFFRP-ZDUSSCGKSA-N 1 0 289.448 3.840 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]CC1C[C@H]3CC[C@@H](C1)S3)CC2 ZINC000716059074 1132004181 /nfs/dbraw/zinc/00/41/81/1132004181.db2.gz IDMXPWXMKNODKX-FBAPMCOASA-N 1 0 289.444 3.643 20 10 CHCDRO CC1(C)CCC[N@@H+]1Cc1cc2c3c(c1)CCCN3CCC2 ZINC001141074601 1132005835 /nfs/dbraw/zinc/00/58/35/1132005835.db2.gz NNMILCXCPHSFLX-UHFFFAOYSA-N 1 0 284.447 3.760 20 10 CHCDRO C[N@H+](Cc1ccccc1O)[C@@H]1CCc2c(F)cccc2C1 ZINC001171436872 1132014991 /nfs/dbraw/zinc/01/49/91/1132014991.db2.gz GZGZXQQHJUVWJJ-OAHLLOKOSA-N 1 0 285.362 3.521 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(F)cc1)c1ccc(N(C)C)cc1 ZINC000037211078 1132021922 /nfs/dbraw/zinc/02/19/22/1132021922.db2.gz BACRCZURTLZASS-CYBMUJFWSA-N 1 0 272.367 3.743 20 10 CHCDRO C[C@H]([NH2+]C(C1CC1)C1CC1)c1ccc(N(C)C)cc1 ZINC000037230167 1132024131 /nfs/dbraw/zinc/02/41/31/1132024131.db2.gz RILJKECYJAXOOE-LBPRGKRZSA-N 1 0 258.409 3.592 20 10 CHCDRO c1cc(N2CCCCC2)ccc1C[NH2+]CC1CCCC1 ZINC000037252197 1132025663 /nfs/dbraw/zinc/02/56/63/1132025663.db2.gz XOSRBVDNLIEBHG-UHFFFAOYSA-N 1 0 272.436 3.957 20 10 CHCDRO CCC[N@H+](Cc1ccc2c(c1)OCCN2C)[C@@H](C)CC ZINC001141138901 1132025921 /nfs/dbraw/zinc/02/59/21/1132025921.db2.gz CORLEXJXCPITAX-AWEZNQCLSA-N 1 0 276.424 3.526 20 10 CHCDRO Cc1ccccc1[C@H]1CCC[N@@H+]1Cc1cc(O)ccc1O ZINC001141157919 1132029418 /nfs/dbraw/zinc/02/94/18/1132029418.db2.gz QGZXCRXVXOOKJN-QGZVFWFLSA-N 1 0 283.371 3.743 20 10 CHCDRO C[C@H](CCc1ccccc1)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000037362836 1132031092 /nfs/dbraw/zinc/03/10/92/1132031092.db2.gz WZRPALGTAZEDSQ-OAHLLOKOSA-N 1 0 281.399 3.732 20 10 CHCDRO CC[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc2c(c1)CCO2 ZINC000037363323 1132031155 /nfs/dbraw/zinc/03/11/55/1132031155.db2.gz KQMFJXMIXSBONM-HOCLYGCPSA-N 1 0 259.393 3.680 20 10 CHCDRO CC[C@H]1c2ccccc2CC[N@H+]1Cc1cc(O)ccc1O ZINC001141160569 1132031492 /nfs/dbraw/zinc/03/14/92/1132031492.db2.gz FCOCJPDFCYGOED-KRWDZBQOSA-N 1 0 283.371 3.607 20 10 CHCDRO C[C@H]([NH2+][C@H]1CSc2ccccc2C1)c1ccccc1O ZINC001172188747 1132137573 /nfs/dbraw/zinc/13/75/73/1132137573.db2.gz WDEDXLPGOVMSFL-GXTWGEPZSA-N 1 0 285.412 3.760 20 10 CHCDRO C[N@H+](Cc1ccccc1O)[C@@H]1CSc2ccccc2C1 ZINC001172206333 1132140737 /nfs/dbraw/zinc/14/07/37/1132140737.db2.gz OQUYIILFLMYUSQ-HNNXBMFYSA-N 1 0 285.412 3.541 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)[C@H]1CSc2ccccc2C1 ZINC001172206568 1132140783 /nfs/dbraw/zinc/14/07/83/1132140783.db2.gz ROWSJTXYMFCXCA-MRXNPFEDSA-N 1 0 299.439 3.931 20 10 CHCDRO CC[C@H](C)OCC[C@@H](C)[NH2+]Cc1c(C)cc(C)cc1O ZINC001172340105 1132176905 /nfs/dbraw/zinc/17/69/05/1132176905.db2.gz VYJGGJHZJNOKHP-CABCVRRESA-N 1 0 279.424 3.692 20 10 CHCDRO Oc1c(C[NH+]2CC(CC(F)(F)F)C2)ccc2ccccc21 ZINC000839137316 1132183121 /nfs/dbraw/zinc/18/31/21/1132183121.db2.gz DWRNCDVSPQOOJK-UHFFFAOYSA-N 1 0 295.304 3.930 20 10 CHCDRO CCOCC[C@@H](C)[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001172428525 1132205440 /nfs/dbraw/zinc/20/54/40/1132205440.db2.gz ITABEQJDBWUYGG-MRXNPFEDSA-N 1 0 290.451 3.534 20 10 CHCDRO CC(C)COCC[C@@H](C)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC001172462925 1132243357 /nfs/dbraw/zinc/24/33/57/1132243357.db2.gz HCLQTYFIEYCREC-CVEARBPZSA-N 1 0 292.467 3.854 20 10 CHCDRO Oc1cccc2c1C[N@H+](Cc1coc3ccc(F)cc13)CC2 ZINC001141856815 1132257725 /nfs/dbraw/zinc/25/77/25/1132257725.db2.gz SGPYBSPPWRBEDV-UHFFFAOYSA-N 1 0 297.329 3.836 20 10 CHCDRO COc1ccc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCO3)c(C)c1 ZINC000840721206 1132277628 /nfs/dbraw/zinc/27/76/28/1132277628.db2.gz UBZBFAUKAQTCNC-CQSZACIVSA-N 1 0 297.398 3.789 20 10 CHCDRO CO[C@@H]1C[C@H]([NH2+][C@H](C)c2c(C)cc(C)cc2O)C12CCC2 ZINC000840805862 1132289145 /nfs/dbraw/zinc/28/91/45/1132289145.db2.gz CCFXKQRYTGMCGY-VNQPRFMTSA-N 1 0 289.419 3.617 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CS[C@@H](C)C1)c1ccc(N(C)C)cc1 ZINC000840857256 1132296144 /nfs/dbraw/zinc/29/61/44/1132296144.db2.gz WMUVALSSYNRJNQ-NOLJZWGESA-N 1 0 278.465 3.687 20 10 CHCDRO CO[C@@](C)([C@@H](C)[NH2+][C@H](C)c1ccc(N(C)C)cc1)C1CC1 ZINC000840861370 1132296943 /nfs/dbraw/zinc/29/69/43/1132296943.db2.gz VGHFJGGGKDGDEN-LBTNJELSSA-N 1 0 290.451 3.607 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CC)c1cccc(Cl)c1[O-])[C@H](O)C(C)C ZINC000840880774 1132300638 /nfs/dbraw/zinc/30/06/38/1132300638.db2.gz FACQXOBVIDULLS-RRFJBIMHSA-N 1 0 299.842 3.882 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC(C)(C)OCC2CC2)c(O)c1C ZINC000840877068 1132301257 /nfs/dbraw/zinc/30/12/57/1132301257.db2.gz SKXFJOOFVHPMAR-CQSZACIVSA-N 1 0 291.435 3.865 20 10 CHCDRO COc1cccc([C@@H]2C[C@H]2C[NH2+][C@H](C)c2ccccc2O)c1 ZINC000840889625 1132303880 /nfs/dbraw/zinc/30/38/80/1132303880.db2.gz SSDZFMORASZSED-XUWXXGDYSA-N 1 0 297.398 3.855 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CC[C@@H]2CCO[C@@H](C)C2)c(Cl)c1 ZINC000840939983 1132312021 /nfs/dbraw/zinc/31/20/21/1132312021.db2.gz STBZBFGGYBEARX-QWHCGFSZSA-N 1 0 297.826 3.649 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]CCCC(C)(F)F ZINC000840949216 1132312237 /nfs/dbraw/zinc/31/22/37/1132312237.db2.gz RILUMLYSBGEHLY-UHFFFAOYSA-N 1 0 270.367 3.586 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@@H]1c1ccncc1 ZINC000840946933 1132312279 /nfs/dbraw/zinc/31/22/79/1132312279.db2.gz XTGAAAHEOGJBAV-LJQANCHMSA-N 1 0 295.430 3.793 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CCSC2(CCC2)CC1 ZINC000840955345 1132313270 /nfs/dbraw/zinc/31/32/70/1132313270.db2.gz VLDLCJUIGICLHS-UHFFFAOYSA-N 1 0 297.851 3.907 20 10 CHCDRO CC1(C)C[N@H+](Cc2c(O)ccc3ccccc32)[C@](C)(CO)C1 ZINC001231587617 1132318544 /nfs/dbraw/zinc/31/85/44/1132318544.db2.gz WSCZROIFCKLRNX-IBGZPJMESA-N 1 0 299.414 3.528 20 10 CHCDRO COC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1c(O)ccc2ccccc21 ZINC001231591079 1132319588 /nfs/dbraw/zinc/31/95/88/1132319588.db2.gz SGULNBCMIDOQEK-XYPWUTKMSA-N 1 0 297.398 3.687 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2cccc(C)c2O)cc1C ZINC001231594055 1132320399 /nfs/dbraw/zinc/32/03/99/1132320399.db2.gz CLXYUFRJTDPSMH-UHFFFAOYSA-N 1 0 269.388 3.949 20 10 CHCDRO Cc1ccc(CC[N@@H+](C)Cc2cccc(C)c2O)cc1 ZINC001231592333 1132320868 /nfs/dbraw/zinc/32/08/68/1132320868.db2.gz KIBDVMUTMLPBBY-UHFFFAOYSA-N 1 0 269.388 3.684 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCc3ccc(Cl)cc3C2)c1O ZINC001231591270 1132321480 /nfs/dbraw/zinc/32/14/80/1132321480.db2.gz YKUWBKYOBFRPGR-UHFFFAOYSA-N 1 0 287.790 3.912 20 10 CHCDRO CC[N@H+](CCc1ccc(OC)cc1)Cc1cccc(C)c1O ZINC001231595366 1132322225 /nfs/dbraw/zinc/32/22/25/1132322225.db2.gz YIBDLSPQTFQFOW-UHFFFAOYSA-N 1 0 299.414 3.774 20 10 CHCDRO Nc1ccc(CC[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2)cc1 ZINC000841037070 1132323145 /nfs/dbraw/zinc/32/31/45/1132323145.db2.gz YDYFFKLMRDZJGL-QUCCMNQESA-N 1 0 294.442 3.812 20 10 CHCDRO CC[N@H+](Cc1ccc(Cl)c(O)c1)Cc1ccccc1O ZINC001231737570 1132348934 /nfs/dbraw/zinc/34/89/34/1132348934.db2.gz UAAWUJWJRFPZIW-UHFFFAOYSA-N 1 0 291.778 3.773 20 10 CHCDRO Cc1cc(C)c(C[N@H+](C)CCc2ccccc2)c(O)c1 ZINC001231842887 1132377390 /nfs/dbraw/zinc/37/73/90/1132377390.db2.gz YCNHSUAYAYBPNC-UHFFFAOYSA-N 1 0 269.388 3.684 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCC3(CCCC3)C2)c(O)c1 ZINC001231845579 1132377857 /nfs/dbraw/zinc/37/78/57/1132377857.db2.gz BJOAWEDFVNQHNX-UHFFFAOYSA-N 1 0 259.393 3.775 20 10 CHCDRO COc1cc(N(C)C)ccc1C[N@@H+]1CCCCC[C@H]1C ZINC001231853030 1132378816 /nfs/dbraw/zinc/37/88/16/1132378816.db2.gz RAUTVVJVLJONHD-CQSZACIVSA-N 1 0 276.424 3.526 20 10 CHCDRO COc1cc(N(C)C)ccc1C[NH+]1CC2(C1)CCCCC2 ZINC001231855456 1132379142 /nfs/dbraw/zinc/37/91/42/1132379142.db2.gz VJILSIQDUSDNRA-UHFFFAOYSA-N 1 0 288.435 3.527 20 10 CHCDRO Cc1cc(C)c(C[N@H+](C)CCc2cccc(F)c2)c(O)c1 ZINC001231850816 1132379852 /nfs/dbraw/zinc/37/98/52/1132379852.db2.gz UVMSZPFLDYGCHH-UHFFFAOYSA-N 1 0 287.378 3.823 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCC[C@@H]3CCC[C@H]32)c(O)c1 ZINC001231846960 1132380025 /nfs/dbraw/zinc/38/00/25/1132380025.db2.gz TYPFBKJYSMBKNF-GOEBONIOSA-N 1 0 259.393 3.774 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2CCC[C@@H](C)C2)cc1Cl ZINC001231866387 1132381163 /nfs/dbraw/zinc/38/11/63/1132381163.db2.gz GDYGHQJZCYHEMQ-SNVBAGLBSA-N 1 0 253.773 3.586 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2C[C@@H]3CCC[C@@H]3C2)cc1Cl ZINC001231867756 1132383443 /nfs/dbraw/zinc/38/34/43/1132383443.db2.gz NVEWQFIJRXTFTA-TXEJJXNPSA-N 1 0 265.784 3.586 20 10 CHCDRO Cc1cc(O)c(C[NH+]2C[C@@H]3CCC[C@H]3C2)cc1Cl ZINC001231869257 1132384172 /nfs/dbraw/zinc/38/41/72/1132384172.db2.gz NVEWQFIJRXTFTA-RYUDHWBXSA-N 1 0 265.784 3.586 20 10 CHCDRO Cc1nc(CC[NH2+][C@H](C)c2ccc(Cl)cc2O)cs1 ZINC000841745274 1132387178 /nfs/dbraw/zinc/38/71/78/1132387178.db2.gz PFWGFKGWHYSIDM-SECBINFHSA-N 1 0 296.823 3.704 20 10 CHCDRO Cc1csc(CC[NH2+][C@@H](C)c2ccc(Cl)cc2O)n1 ZINC000841744115 1132387286 /nfs/dbraw/zinc/38/72/86/1132387286.db2.gz FEGSIILCBUXREL-JTQLQIEISA-N 1 0 296.823 3.704 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)[C@@H]1C[C@H]1c1cccs1 ZINC000841747842 1132389077 /nfs/dbraw/zinc/38/90/77/1132389077.db2.gz UFNNOMLFKAZICU-VBNZEHGJSA-N 1 0 299.439 3.965 20 10 CHCDRO Oc1c(C[NH+]2C[C@@H]3CCC[C@H]3C2)ccc2ccccc21 ZINC001231877988 1132390529 /nfs/dbraw/zinc/39/05/29/1132390529.db2.gz CMYLTBQBYVAFLN-GJZGRUSLSA-N 1 0 267.372 3.777 20 10 CHCDRO CO[C@@H]1CC[N@H+](Cc2ccc3ccccc3c2O)[C@@H](C)C1 ZINC001231884013 1132391834 /nfs/dbraw/zinc/39/18/34/1132391834.db2.gz UGSCSKHXFNDNBV-XJKSGUPXSA-N 1 0 285.387 3.545 20 10 CHCDRO Oc1c(C[NH+]2CCC(CF)CC2)ccc2ccccc21 ZINC001231881917 1132391896 /nfs/dbraw/zinc/39/18/96/1132391896.db2.gz LEQQKLOOLJKZIO-UHFFFAOYSA-N 1 0 273.351 3.727 20 10 CHCDRO CO[C@H](C[NH2+][C@@H](C)c1ccc(C)c(C)c1O)CC(C)C ZINC000841754764 1132392929 /nfs/dbraw/zinc/39/29/29/1132392929.db2.gz DIUFOCPJQXXFLI-GJZGRUSLSA-N 1 0 279.424 3.721 20 10 CHCDRO Cc1ccoc1C[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841759040 1132393929 /nfs/dbraw/zinc/39/39/29/1132393929.db2.gz XCYHRYHOUUOEKF-JTQLQIEISA-N 1 0 265.740 3.798 20 10 CHCDRO CCc1noc(C)c1C[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841757151 1132394638 /nfs/dbraw/zinc/39/46/38/1132394638.db2.gz MNARASLPASCGBO-VIFPVBQESA-N 1 0 294.782 3.755 20 10 CHCDRO CC[C@H]([NH2+][C@H](CO)CC1CCCCC1)c1ccccc1O ZINC000841760453 1132394895 /nfs/dbraw/zinc/39/48/95/1132394895.db2.gz FLDUTHAHSPIJOB-RDJZCZTQSA-N 1 0 291.435 3.764 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2COCc3ccccc32)c(O)c1C ZINC000841761628 1132396765 /nfs/dbraw/zinc/39/67/65/1132396765.db2.gz QAFQHHWYRIUSIK-KBXCAEBGSA-N 1 0 297.398 3.931 20 10 CHCDRO CC[C@H](C[N@H+](Cc1ccccc1O)C1CCCC1)OC ZINC000842149095 1132410189 /nfs/dbraw/zinc/41/01/89/1132410189.db2.gz VZHOYHLROIYPME-MRXNPFEDSA-N 1 0 277.408 3.562 20 10 CHCDRO CCc1ccc(C[C@H](C)[NH2+]Cc2ccccc2O)cc1 ZINC001173236613 1132415412 /nfs/dbraw/zinc/41/54/12/1132415412.db2.gz BADXBPXSOIQQDP-AWEZNQCLSA-N 1 0 269.388 3.675 20 10 CHCDRO CCCC[C@@H](CC(C)C)[NH2+]Cc1cccc(O)c1O ZINC001173252523 1132422617 /nfs/dbraw/zinc/42/26/17/1132422617.db2.gz JGPSAPRWCZAQLD-AWEZNQCLSA-N 1 0 265.397 3.792 20 10 CHCDRO CC(C)O[C@@H]1CC[N@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000842613354 1132444135 /nfs/dbraw/zinc/44/41/35/1132444135.db2.gz ZMABJNIFUYMMLV-OAHLLOKOSA-N 1 0 285.387 3.545 20 10 CHCDRO CC[C@@H]1CCCC[N@@H+]1Cc1cc(Cl)c(OC)cc1O ZINC001232269870 1132446444 /nfs/dbraw/zinc/44/64/44/1132446444.db2.gz LNFGNGMVTAFWNY-GFCCVEGCSA-N 1 0 283.799 3.819 20 10 CHCDRO COc1cc(O)c(C[NH+]2C[C@@H](C)C[C@H](C)C2)cc1Cl ZINC001232269486 1132447773 /nfs/dbraw/zinc/44/77/73/1132447773.db2.gz BXPNENKLGCLAPQ-QWRGUYRKSA-N 1 0 283.799 3.532 20 10 CHCDRO COc1ccccc1C1([NH2+]Cc2cc(C)c(C)cc2O)CC1 ZINC000842738887 1132456239 /nfs/dbraw/zinc/45/62/39/1132456239.db2.gz ALEJQSOMEWWWSP-UHFFFAOYSA-N 1 0 297.398 3.797 20 10 CHCDRO Cc1ccc(C2([NH2+]Cc3ccccc3O)CCC2)cc1 ZINC000842774515 1132460605 /nfs/dbraw/zinc/46/06/05/1132460605.db2.gz QRMJKZQOECBUFG-UHFFFAOYSA-N 1 0 267.372 3.870 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](C)CC(F)F)c(O)c1C ZINC000842890874 1132474493 /nfs/dbraw/zinc/47/44/93/1132474493.db2.gz VDDCBNNPLSMLIO-BXKDBHETSA-N 1 0 271.351 3.951 20 10 CHCDRO C[C@@H](C[NH2+][C@@H](C)c1cc(Cl)ccc1O)CC(F)F ZINC000842889893 1132474508 /nfs/dbraw/zinc/47/45/08/1132474508.db2.gz IHQGFFBBGPGGLU-BDAKNGLRSA-N 1 0 277.742 3.988 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2C[C@@H](OC(C)(C)C)C2)c1 ZINC000842920176 1132476374 /nfs/dbraw/zinc/47/63/74/1132476374.db2.gz IAWKLTLBEOZVSI-MELADBBJSA-N 1 0 277.408 3.697 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCS[C@H]2C)c(O)c1C ZINC000842927928 1132477396 /nfs/dbraw/zinc/47/73/96/1132477396.db2.gz HNNQPQWPSFHBJX-OBJOEFQTSA-N 1 0 265.422 3.554 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CC2CCC(F)CC2)c1 ZINC000842929415 1132478094 /nfs/dbraw/zinc/47/80/94/1132478094.db2.gz PYDHQBUSUVVRJV-IYXRBSQSSA-N 1 0 265.372 3.880 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CO[C@H](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000842928978 1132478165 /nfs/dbraw/zinc/47/81/65/1132478165.db2.gz LGEAHASKXHXWNM-VYDXJSESSA-N 1 0 288.435 3.505 20 10 CHCDRO CC[C@@H]1CC[N@H+](Cc2cccc(C(C)(C)C)c2O)C1 ZINC001143116883 1132504057 /nfs/dbraw/zinc/50/40/57/1132504057.db2.gz NICYEXJNMSTKCJ-CYBMUJFWSA-N 1 0 261.409 3.922 20 10 CHCDRO CO[C@@H]1CCC[N@H+](Cc2cccc(C(C)(C)C)c2O)CC1 ZINC001143112621 1132504158 /nfs/dbraw/zinc/50/41/58/1132504158.db2.gz XQILYEQJZIETFN-OAHLLOKOSA-N 1 0 291.435 3.691 20 10 CHCDRO CC(C)O[C@@H]1CC[N@H+](Cc2cccc(C(C)(C)C)c2O)C1 ZINC001143111396 1132504258 /nfs/dbraw/zinc/50/42/58/1132504258.db2.gz BMEBYMIMDIGOEE-OAHLLOKOSA-N 1 0 291.435 3.689 20 10 CHCDRO [NH3+]Cc1ccc2c(c1)CCCN2CCCCC(F)(F)F ZINC000843350047 1132522239 /nfs/dbraw/zinc/52/22/39/1132522239.db2.gz IPOZKDMXJUTZNA-UHFFFAOYSA-N 1 0 286.341 3.631 20 10 CHCDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CC[C@](C)(F)[C@H](F)C2)c1 ZINC001233284358 1132594494 /nfs/dbraw/zinc/59/44/94/1132594494.db2.gz RGOGZTSGITZDOF-WBVHZDCISA-N 1 0 297.389 3.962 20 10 CHCDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CCCOC(C)(C)C2)c1 ZINC001233286192 1132595169 /nfs/dbraw/zinc/59/51/69/1132595169.db2.gz JIQFTSGKIPRQKV-UHFFFAOYSA-N 1 0 291.435 3.691 20 10 CHCDRO CCC[N@H+](CCOC)Cc1cc(C(C)(C)C)ccc1O ZINC001233283707 1132595382 /nfs/dbraw/zinc/59/53/82/1132595382.db2.gz SAJOHYDKCAAEAZ-UHFFFAOYSA-N 1 0 279.424 3.548 20 10 CHCDRO CC(C)(C)c1ccc(O)c(C[NH+]2C[C@@H]3CCC[C@H]3C2)c1 ZINC001233284410 1132595787 /nfs/dbraw/zinc/59/57/87/1132595787.db2.gz TYLMJGVJGSYEDO-KBPBESRZSA-N 1 0 273.420 3.922 20 10 CHCDRO Cc1cccc(C[N@@H+](C)Cc2c([O-])ccc(F)c2F)c1 ZINC001233331648 1132600767 /nfs/dbraw/zinc/60/07/67/1132600767.db2.gz FICLMWOFNNXOBE-UHFFFAOYSA-N 1 0 277.314 3.611 20 10 CHCDRO CCCC[N@H+](C)Cc1ccc(C(F)(F)F)cc1O ZINC001233451563 1132626342 /nfs/dbraw/zinc/62/63/42/1132626342.db2.gz PKXNCRYDKOCUMP-UHFFFAOYSA-N 1 0 261.287 3.643 20 10 CHCDRO O=C(c1ccccc1)c1ccccc1NC=C1CC[NH2+]CC1 ZINC001159477797 1132852744 /nfs/dbraw/zinc/85/27/44/1132852744.db2.gz RQWYJBMOSIKUEW-UHFFFAOYSA-N 1 0 292.382 3.597 20 10 CHCDRO Cc1c[nH+]ccc1Nc1cc(Cl)c(Cl)cc1O ZINC001174539037 1132899777 /nfs/dbraw/zinc/89/97/77/1132899777.db2.gz AYAKGGLXEKZNAO-UHFFFAOYSA-N 1 0 269.131 3.568 20 10 CHCDRO C[C@H]([N@H+](C)Cc1cc(F)c(N(C)C)cc1F)C1(C)CC1 ZINC001204389568 1132974511 /nfs/dbraw/zinc/97/45/11/1132974511.db2.gz NGPAEVLMQIQIGF-NSHDSACASA-N 1 0 282.378 3.651 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(N[C@@H]2CCC[C@@H]([NH3+])C2)cc1 ZINC001162397591 1133074044 /nfs/dbraw/zinc/07/40/44/1133074044.db2.gz WQLQFRUFKWBORA-NVXWUHKLSA-N 1 0 283.419 3.776 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(N[C@@]23CCC[C@@H]2[NH2+]CC3)cc1 ZINC001162984373 1133126018 /nfs/dbraw/zinc/12/60/18/1133126018.db2.gz JRDGTOZIOXSXNK-RBUKOAKNSA-N 1 0 295.430 3.791 20 10 CHCDRO Cc1cccc(C[C@H](C)[NH2+]Cc2cc(C)ccc2O)c1 ZINC001206714670 1133263769 /nfs/dbraw/zinc/26/37/69/1133263769.db2.gz JVOZOSXAWLQCAD-HNNXBMFYSA-N 1 0 269.388 3.730 20 10 CHCDRO COC(C)(C)[C@H](C)[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC000720244747 1133337934 /nfs/dbraw/zinc/33/79/34/1133337934.db2.gz ASVQSZPCYJDCIU-FRRDWIJNSA-N 1 0 277.408 3.652 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCC[C@@H](Cc2ccc(F)cc2)C1 ZINC001203558509 1133339762 /nfs/dbraw/zinc/33/97/62/1133339762.db2.gz LKJQNHOKGPLRLA-INIZCTEOSA-N 1 0 299.389 3.986 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CC[C@@H]2CCC[C@@H]2C1 ZINC001203650907 1133348276 /nfs/dbraw/zinc/34/82/76/1133348276.db2.gz GEFWCXJNLALZRC-NWDGAFQWSA-N 1 0 265.784 3.668 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2cc(Cl)ccc2O)cc1 ZINC001203657146 1133349574 /nfs/dbraw/zinc/34/95/74/1133349574.db2.gz GHKCPJJNPMNYKV-UHFFFAOYSA-N 1 0 275.779 3.986 20 10 CHCDRO CC[C@@H](c1ccccc1)[N@H+](C)Cc1ccc(O)c(O)c1 ZINC001203880581 1133377907 /nfs/dbraw/zinc/37/79/07/1133377907.db2.gz VRYXCPGDNWZTNC-HNNXBMFYSA-N 1 0 271.360 3.681 20 10 CHCDRO CC[C@H]1c2ccccc2CC[N@H+]1Cc1ccc(O)c(O)c1 ZINC001203880453 1133378614 /nfs/dbraw/zinc/37/86/14/1133378614.db2.gz SFDQIJLSKGNLPI-INIZCTEOSA-N 1 0 283.371 3.607 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCCc3ccccc3C2)cc1 ZINC001203933679 1133386371 /nfs/dbraw/zinc/38/63/71/1133386371.db2.gz DYJAFMAVCWMFLG-UHFFFAOYSA-N 1 0 280.415 3.701 20 10 CHCDRO Cc1ccc([C@H]2CCC[N@H+]2Cc2ccc(N(C)C)cc2)cn1 ZINC001203937873 1133386728 /nfs/dbraw/zinc/38/67/28/1133386728.db2.gz WRTMEIIUOIRNAO-LJQANCHMSA-N 1 0 295.430 3.793 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC3(C2)CCCCC3)cc1 ZINC001203936050 1133387193 /nfs/dbraw/zinc/38/71/93/1133387193.db2.gz HOVQTGODLDIVED-UHFFFAOYSA-N 1 0 272.436 3.909 20 10 CHCDRO C[C@@H]1CC[N@@H+]1Cc1ccc(N(C)C)c2ccccc12 ZINC001204233137 1133423200 /nfs/dbraw/zinc/42/32/00/1133423200.db2.gz ODUYHVPWNMDPMB-CYBMUJFWSA-N 1 0 254.377 3.500 20 10 CHCDRO CC[N@H+](Cc1cc(F)cc(F)c1)Cc1ccccc1O ZINC001204230760 1133423241 /nfs/dbraw/zinc/42/32/41/1133423241.db2.gz MWHRROUEVREFOW-UHFFFAOYSA-N 1 0 277.314 3.693 20 10 CHCDRO C[N@H+](Cc1ccc(O)cc1O)C(C)(C)Cc1ccccc1 ZINC001204279958 1133426850 /nfs/dbraw/zinc/42/68/50/1133426850.db2.gz GLGWPUXXWZUMMP-UHFFFAOYSA-N 1 0 285.387 3.551 20 10 CHCDRO CCSCC[C@H](C)[N@H+](C)Cc1ccc(C)cc1O ZINC001204348032 1133438182 /nfs/dbraw/zinc/43/81/82/1133438182.db2.gz NPRZNCRGFNSRKY-ZDUSSCGKSA-N 1 0 267.438 3.664 20 10 CHCDRO CCc1cccc(C[N@H+](C)Cc2ccc(F)c(F)c2)c1O ZINC001205070816 1133524133 /nfs/dbraw/zinc/52/41/33/1133524133.db2.gz ZJLLSOLSAMGCTJ-UHFFFAOYSA-N 1 0 291.341 3.865 20 10 CHCDRO CCOc1ccc(C[N@H+](C)Cc2ccc(C)cc2O)cc1 ZINC001205148278 1133537546 /nfs/dbraw/zinc/53/75/46/1133537546.db2.gz GGTRXWJLJADWOR-UHFFFAOYSA-N 1 0 285.387 3.731 20 10 CHCDRO CC[C@@H]1[C@@H](C)CC[N@@H+]1C/C=C/c1ccc(N(C)C)cc1 ZINC001205489425 1133582466 /nfs/dbraw/zinc/58/24/66/1133582466.db2.gz QGWQXIDOALEZCZ-XDWWLABZSA-N 1 0 272.436 3.886 20 10 CHCDRO C[C@@H]1CC[C@H]([NH2+]Cc2ccc(N(C)C)cc2)C[C@@H]1C ZINC000084982614 1133582620 /nfs/dbraw/zinc/58/26/20/1133582620.db2.gz CZWPGJGUZXFQSP-YCPHGPKFSA-N 1 0 260.425 3.667 20 10 CHCDRO CC(C)C[N@H+](Cc1ccccc1)Cc1ccc(N)cc1 ZINC001205925576 1133631517 /nfs/dbraw/zinc/63/15/17/1133631517.db2.gz WTLLEDLOQIOVQT-UHFFFAOYSA-N 1 0 268.404 3.927 20 10 CHCDRO CC[N@H+](C/C=C\c1ccc(N(C)C)cc1)C(C)(C)C ZINC001205998160 1133640155 /nfs/dbraw/zinc/64/01/55/1133640155.db2.gz JTTXSGLFDFIATK-HJWRWDBZSA-N 1 0 260.425 3.886 20 10 CHCDRO Oc1ccccc1Nc1cc[nH+]cc1Oc1ccccc1 ZINC001206188373 1133669240 /nfs/dbraw/zinc/66/92/40/1133669240.db2.gz NZSJPMHSWJSIGD-UHFFFAOYSA-N 1 0 278.311 3.745 20 10 CHCDRO CCC[C@H]([NH2+]Cc1cc(F)ccc1O)C1CCCC1 ZINC001206248531 1133676010 /nfs/dbraw/zinc/67/60/10/1133676010.db2.gz YNHYEDSIEGWXDS-HNNXBMFYSA-N 1 0 265.372 3.980 20 10 CHCDRO CC[C@@H](COCC1CC1)[NH2+]Cc1cc(C(C)C)ccc1O ZINC001206644167 1133730412 /nfs/dbraw/zinc/73/04/12/1133730412.db2.gz DSLUCNAHYXIPKJ-KRWDZBQOSA-N 1 0 291.435 3.810 20 10 CHCDRO CC1=C[C@@H](C)[C@H](C[N@@H+]2CCc3cccc(O)c3C2)CC1 ZINC001208184008 1133900886 /nfs/dbraw/zinc/90/08/86/1133900886.db2.gz ZMQNCEMLDDXNEK-ZBFHGGJFSA-N 1 0 271.404 3.743 20 10 CHCDRO C[N@H+](CCCCOCc1ccccc1)Cc1ccccc1O ZINC001209265460 1133997643 /nfs/dbraw/zinc/99/76/43/1133997643.db2.gz RJNUKQOZBQTATM-UHFFFAOYSA-N 1 0 299.414 3.821 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(C[N@@H+]2C[C@@H]3C[C@@H]3[C@@H](F)C2)cc1 ZINC001209516203 1134032306 /nfs/dbraw/zinc/03/23/06/1134032306.db2.gz CPJUGMZBYUBPQS-WDSOQIARSA-N 1 0 298.405 3.884 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(C[N@@H+](C)[C@H]2CCCOC2)cc1 ZINC001209520283 1134034121 /nfs/dbraw/zinc/03/41/21/1134034121.db2.gz UIVREQOCACGFHY-IBGZPJMESA-N 1 0 298.430 3.705 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CC[C@H]2C[C@H]2C1)c1ccc(N(C)C)cc1 ZINC000403375539 1134766448 /nfs/dbraw/zinc/76/64/48/1134766448.db2.gz NLSPAUHQUPRKTH-QCEMKRCNSA-N 1 0 258.409 3.592 20 10 CHCDRO C[NH2+][C@H]1C[C@@H](Oc2ccc(NN=C3C=CC(=O)C=C3)cc2)C1 ZINC001217957011 1135031483 /nfs/dbraw/zinc/03/14/83/1135031483.db2.gz NCDHNUMNMKFBIH-KDYLLFBJSA-N 1 0 297.358 3.937 20 10 CHCDRO O=C1C=CC(=NNc2ccc(OC3CC[NH2+]CC3)cc2)C=C1 ZINC001217964001 1135033090 /nfs/dbraw/zinc/03/30/90/1135033090.db2.gz XRBWGHOYAKVJPL-UHFFFAOYSA-N 1 0 297.358 3.938 20 10 CHCDRO C[C@@H]1[NH2+]C[C@@H]1Oc1ccccc1NN=C1C=CC=CC1=O ZINC001218388352 1135097215 /nfs/dbraw/zinc/09/72/15/1135097215.db2.gz SDAIORATIJLINL-LJWNEUSZSA-N 1 0 283.331 3.547 20 10 CHCDRO C[C@H]([NH2+]CCCc1ccccc1)c1ccccc1O ZINC000020122710 171003193 /nfs/dbraw/zinc/00/31/93/171003193.db2.gz HVPBWOHQOVKLLO-AWEZNQCLSA-N 1 0 255.361 3.676 20 10 CHCDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+][C@@H](C)c1cccnc1 ZINC000020127812 171014111 /nfs/dbraw/zinc/01/41/11/171014111.db2.gz CURACHQIEXDXDQ-YDHLFZDLSA-N 1 0 282.387 3.995 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCc2ccccc21)c1ccccc1O ZINC000020129742 171017977 /nfs/dbraw/zinc/01/79/77/171017977.db2.gz JAMZRKGHGBRESE-WBMJQRKESA-N 1 0 253.345 3.730 20 10 CHCDRO COc1cccc(C[NH2+][C@H](C)CCc2ccccc2)c1O ZINC000020138420 171025992 /nfs/dbraw/zinc/02/59/92/171025992.db2.gz FQZVUQXSEHCDGS-CQSZACIVSA-N 1 0 285.387 3.512 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(OC(F)F)cc1)c1ccccc1O ZINC000020145319 171030463 /nfs/dbraw/zinc/03/04/63/171030463.db2.gz DCZOBUGCHSDJGN-NSHDSACASA-N 1 0 293.313 3.844 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+][C@@H]1CCCc2occc21 ZINC000020204567 171069748 /nfs/dbraw/zinc/06/97/48/171069748.db2.gz ATCWGOAHKFPCCA-CYBMUJFWSA-N 1 0 277.751 3.806 20 10 CHCDRO C[C@@H](C[NH2+]Cc1ccc(N(C)C)cc1)c1ccccc1 ZINC000021805019 171327045 /nfs/dbraw/zinc/32/70/45/171327045.db2.gz ZCKMJEKIJZKRDA-HNNXBMFYSA-N 1 0 268.404 3.646 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H](C)c2cc(C)ccc2O)c1 ZINC000035628841 172308045 /nfs/dbraw/zinc/30/80/45/172308045.db2.gz RTJAFVQLWKWYKM-AWEZNQCLSA-N 1 0 255.361 3.860 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccc2ccccc2c1O)C1CC1 ZINC000035733328 172384508 /nfs/dbraw/zinc/38/45/08/172384508.db2.gz KISHOLLKQCIINH-NEPJUHHUSA-N 1 0 255.361 3.995 20 10 CHCDRO CC(C)C[C@@H](C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000037255555 173067010 /nfs/dbraw/zinc/06/70/10/173067010.db2.gz WADFDVSWVVIRJO-OAHLLOKOSA-N 1 0 260.425 3.811 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccccc2F)c1 ZINC000035628679 260030788 /nfs/dbraw/zinc/03/07/88/260030788.db2.gz PEXGKXWYYNVDCM-GFCCVEGCSA-N 1 0 259.324 3.691 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCO[C@H](C3CC3)C2)c(O)c1C ZINC000157885592 261155003 /nfs/dbraw/zinc/15/50/03/261155003.db2.gz IXMIHGNVQVAYBV-LXZKKBNFSA-N 1 0 289.419 3.617 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1cccnc1)c1ccc(N(C)C)cc1 ZINC000158521453 261166331 /nfs/dbraw/zinc/16/63/31/261166331.db2.gz MDNDANHTOKLQGS-KSSFIOAISA-N 1 0 283.419 3.950 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1ccncc1 ZINC000163666759 261324318 /nfs/dbraw/zinc/32/43/18/261324318.db2.gz WUKVVCXBRNNFMT-KSSFIOAISA-N 1 0 283.419 3.950 20 10 CHCDRO Cc1cccnc1C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000103712755 261332873 /nfs/dbraw/zinc/33/28/73/261332873.db2.gz HVRSZIOUEJVQLD-UHFFFAOYSA-N 1 0 295.430 3.670 20 10 CHCDRO CC(=O)Nc1ccc(C[NH2+][C@H](C)c2ccc(C)cc2O)cc1 ZINC000184916417 262033133 /nfs/dbraw/zinc/03/31/33/262033133.db2.gz SYRODAFNBVPLRY-CYBMUJFWSA-N 1 0 298.386 3.510 20 10 CHCDRO CCC(CC)(CCO)C[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000185621129 262063050 /nfs/dbraw/zinc/06/30/50/262063050.db2.gz TXNKJUQOGVEQND-AWEZNQCLSA-N 1 0 279.424 3.540 20 10 CHCDRO COC[C@H]([NH2+][C@@H](C)c1ccc(C)cc1O)c1ccccc1 ZINC000186034960 262076122 /nfs/dbraw/zinc/07/61/22/262076122.db2.gz WSCIRYJZTHGHLW-YOEHRIQHSA-N 1 0 285.387 3.739 20 10 CHCDRO CCOCCC1(C[NH2+][C@H](C)c2ccc(C)cc2O)CCC1 ZINC000186116067 262080295 /nfs/dbraw/zinc/08/02/95/262080295.db2.gz NQEGZWPVQFHXBM-OAHLLOKOSA-N 1 0 291.435 3.948 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCOC2(CCCC2)C1)c1cc(F)ccc1O ZINC000186130180 262081314 /nfs/dbraw/zinc/08/13/14/262081314.db2.gz ZGZKOAMUOBOERS-OCCSQVGLSA-N 1 0 293.382 3.674 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](CCO)c1ccccc1)c1ccccc1O ZINC000186207787 262084669 /nfs/dbraw/zinc/08/46/69/262084669.db2.gz HSXDEFPATSDSEA-AEFFLSMTSA-N 1 0 299.414 3.599 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCCOCC1)c1ccc2ccccc2c1O ZINC000186234522 262312368 /nfs/dbraw/zinc/31/23/68/262312368.db2.gz SZACOSGZDAOETR-ZFWWWQNUSA-N 1 0 285.387 3.765 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CCC[C@H]1c1ccncc1 ZINC000289890297 263112684 /nfs/dbraw/zinc/11/26/84/263112684.db2.gz SVKJOOKYTFWFMT-HNNXBMFYSA-N 1 0 288.778 3.778 20 10 CHCDRO COc1ccc(N2CCC([NH2+]CCC=C(C)C)CC2)cc1 ZINC000372774629 267600880 /nfs/dbraw/zinc/60/08/80/267600880.db2.gz DKZHTHFCBXCIPC-UHFFFAOYSA-N 1 0 288.435 3.610 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C(C)C)C(C)(C)O)c1ccc(C)cc1O ZINC000280161350 522683762 /nfs/dbraw/zinc/68/37/62/522683762.db2.gz QSJNJYGQZHNYGP-HOCLYGCPSA-N 1 0 279.424 3.537 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)Cc2ccc(O)cc2)c(O)c1 ZINC000185351798 327838263 /nfs/dbraw/zinc/83/82/63/327838263.db2.gz PHGRNITXQXJBFA-ZIAGYGMSSA-N 1 0 285.387 3.688 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1cc(F)ccc1O)c1ccncc1 ZINC000185541895 327840533 /nfs/dbraw/zinc/84/05/33/327840533.db2.gz SRAKESJUTGGJFD-ABAIWWIYSA-N 1 0 274.339 3.728 20 10 CHCDRO CC[C@@H](CCc1ccccc1)[NH2+]Cc1cccc(OC)c1O ZINC000527760701 326865566 /nfs/dbraw/zinc/86/55/66/326865566.db2.gz HTTKUHAUIDJFMM-KRWDZBQOSA-N 1 0 299.414 3.902 20 10 CHCDRO COc1ccccc1C(C)(C)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000103172073 327233652 /nfs/dbraw/zinc/23/36/52/327233652.db2.gz ZRGAPZNPTJEOQA-UHFFFAOYSA-N 1 0 298.430 3.786 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)c1O ZINC000403399838 327331183 /nfs/dbraw/zinc/33/11/83/327331183.db2.gz OMJAJUZTWRGQTM-UTUOFQBUSA-N 1 0 295.810 3.580 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+]CC[C@H]2CCCOC2)c1O ZINC000527925536 330296461 /nfs/dbraw/zinc/29/64/61/330296461.db2.gz MLGQMLYJFKPDKF-QWHCGFSZSA-N 1 0 297.826 3.821 20 10 CHCDRO CC[C@@H](c1ccccc1O)[NH+]1CCC(CCOC)CC1 ZINC000527936803 330298019 /nfs/dbraw/zinc/29/80/19/330298019.db2.gz RZQJKXBJAZDSLQ-INIZCTEOSA-N 1 0 277.408 3.592 20 10 CHCDRO Cc1ncccc1C[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000527989344 330299171 /nfs/dbraw/zinc/29/91/71/330299171.db2.gz YBBAQZIGQAGBHX-HZMBPMFUSA-N 1 0 286.350 3.573 20 10 CHCDRO COc1ccc([C@H]([NH2+][C@@H](C)c2ccccc2O)C2CC2)cn1 ZINC000528041625 330305788 /nfs/dbraw/zinc/30/57/88/330305788.db2.gz BTFQBOVMGILOFG-KPZWWZAWSA-N 1 0 298.386 3.598 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C)C1(C)CC1 ZINC000479446131 331730152 /nfs/dbraw/zinc/73/01/52/331730152.db2.gz ALDJVOUMHCEMGR-ZDUSSCGKSA-N 1 0 256.393 3.765 20 10 CHCDRO C[C@H]([NH2+]Cc1cc(Cl)ccc1O)[C@@H]1C[C@H]1C1CC1 ZINC000529617806 333501656 /nfs/dbraw/zinc/50/16/56/333501656.db2.gz PJZFFJPRYIASIS-HERUPUMHSA-N 1 0 265.784 3.570 20 10 CHCDRO C[C@@H]([NH2+]CCC(C)(C)CO)c1ccc2ccccc2c1O ZINC000296475675 334912314 /nfs/dbraw/zinc/91/23/14/334912314.db2.gz NZPCAEAEYQWUCR-CYBMUJFWSA-N 1 0 287.403 3.605 20 10 CHCDRO CCCC[C@H](C)[NH2+][C@H](C)c1cc(OC)ccc1O ZINC000050886956 521153246 /nfs/dbraw/zinc/15/32/46/521153246.db2.gz SXIOGTAZOKLCKU-NWDGAFQWSA-N 1 0 251.370 3.630 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]Cc1ccccc1Cl)CC2 ZINC000296036765 518203632 /nfs/dbraw/zinc/20/36/32/518203632.db2.gz QKACMYNNYUHZLU-CQSZACIVSA-N 1 0 273.763 3.823 20 10 CHCDRO CC(C)C[C@@H](CO)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000040773760 519224544 /nfs/dbraw/zinc/22/45/44/519224544.db2.gz XCUWEMABAVJCCA-ZFWWWQNUSA-N 1 0 287.403 3.603 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H]2CCOC(C)(C)C2)cc1 ZINC000119365928 520287850 /nfs/dbraw/zinc/28/78/50/520287850.db2.gz JAVZGDKXQGJMGP-GDBMZVCRSA-N 1 0 290.451 3.751 20 10 CHCDRO CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](C)c1ccc(F)cc1[O-] ZINC000062744833 520636544 /nfs/dbraw/zinc/63/65/44/520636544.db2.gz OWVWYCONVYSTEM-KBPBESRZSA-N 1 0 296.430 3.692 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2ccccn2)cc1 ZINC000020123842 520909227 /nfs/dbraw/zinc/90/92/27/520909227.db2.gz RACMQQBAJKQTTO-HNNXBMFYSA-N 1 0 283.419 3.779 20 10 CHCDRO CCC[N@H+](CCc1ccccn1)Cc1cc(C)ccc1O ZINC000289835385 521673142 /nfs/dbraw/zinc/67/31/42/521673142.db2.gz OZNSUDWINSMDJH-UHFFFAOYSA-N 1 0 284.403 3.550 20 10 CHCDRO CCSCC[C@H](C)[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000297909355 521716503 /nfs/dbraw/zinc/71/65/03/521716503.db2.gz WPELOYYUNPNNMW-WCQYABFASA-N 1 0 265.422 3.501 20 10 CHCDRO CCSc1cccc(C[NH2+]Cc2cc(F)ccc2O)c1 ZINC000292742240 521755864 /nfs/dbraw/zinc/75/58/64/521755864.db2.gz HMDWJURZVCDRNB-UHFFFAOYSA-N 1 0 291.391 3.933 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CC[C@@H](CC(F)(F)F)C2)cc1 ZINC000278392075 522180108 /nfs/dbraw/zinc/18/01/08/522180108.db2.gz MXLZRJLDPPCMEX-ZDUSSCGKSA-N 1 0 286.341 3.527 20 10 CHCDRO CCc1nc(C)c(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)o1 ZINC000291970940 522208959 /nfs/dbraw/zinc/20/89/59/522208959.db2.gz TZCQLCGFPXMCFT-GFCCVEGCSA-N 1 0 288.391 3.719 20 10 CHCDRO CC[C@H]([NH2+]C1CCN(C(C)C)CC1)c1ccc(C)cc1O ZINC000280296092 522560540 /nfs/dbraw/zinc/56/05/40/522560540.db2.gz ZPISAYRVNIESCR-KRWDZBQOSA-N 1 0 290.451 3.614 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCSC1)c1ccc(N(C)C)cc1 ZINC000280200915 522634970 /nfs/dbraw/zinc/63/49/70/522634970.db2.gz VNPGSGFTZGQUDC-CJNGLKHVSA-N 1 0 278.465 3.546 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1COc2ccccc21)c1ccccc1O ZINC000289846588 522636114 /nfs/dbraw/zinc/63/61/14/522636114.db2.gz BBSPWPUSPVSTJL-BBRMVZONSA-N 1 0 283.371 3.609 20 10 CHCDRO CC[C@H]([NH2+]Cc1nc(C2CC2)cs1)c1ccccc1O ZINC000130134160 522669342 /nfs/dbraw/zinc/66/93/42/522669342.db2.gz OSVNEBGBJTWXCM-ZDUSSCGKSA-N 1 0 288.416 3.967 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)[C@H](O)c1ccccc1)c1ccccc1O ZINC000290192287 522694514 /nfs/dbraw/zinc/69/45/14/522694514.db2.gz GADHXXDAFZINNR-OWQGQXMQSA-N 1 0 285.387 3.555 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCCc2c1cnn2C)c1ccc(C)cc1O ZINC000280272577 522717053 /nfs/dbraw/zinc/71/70/53/522717053.db2.gz YABYPQNEXFHBIX-JKSUJKDBSA-N 1 0 299.418 3.552 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1cccnc1)c1ccc(C)cc1O ZINC000280099205 522742094 /nfs/dbraw/zinc/74/20/94/522742094.db2.gz MYRYKLNYKRNJKF-CJNGLKHVSA-N 1 0 270.376 3.898 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)C1CCOCC1)c1ccc(C)cc1O ZINC000280282078 522907389 /nfs/dbraw/zinc/90/73/89/522907389.db2.gz YOJYHPGKPFGZJH-XJKSGUPXSA-N 1 0 277.408 3.556 20 10 CHCDRO CC[C@@H]([NH2+][C@H](CCO)c1ccccc1)c1ccc(C)cc1O ZINC000279988775 522943776 /nfs/dbraw/zinc/94/37/76/522943776.db2.gz FFAIWBFHSOSJFY-QZTJIDSGSA-N 1 0 299.414 3.865 20 10 CHCDRO CC[C@H](c1ccncc1)[N@H+](C)Cc1cc(C)c(C)cc1O ZINC000290488838 522968400 /nfs/dbraw/zinc/96/84/00/522968400.db2.gz OMTGQLULWYBLJN-QGZVFWFLSA-N 1 0 284.403 3.987 20 10 CHCDRO CC[C@@H](c1ccncc1)[N@H+](C)Cc1cccc(C)c1O ZINC000290478309 523119592 /nfs/dbraw/zinc/11/95/92/523119592.db2.gz NYDRXSFBMZJPEA-INIZCTEOSA-N 1 0 270.376 3.679 20 10 CHCDRO CO[C@@H](C)[C@H](C)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000191655563 523445768 /nfs/dbraw/zinc/44/57/68/523445768.db2.gz RZZCKOGAOBSDNJ-AVGNSLFASA-N 1 0 273.376 3.619 20 10 CHCDRO CCn1ccnc1[C@@H]1CCCC[N@@H+]1Cc1cccc(C)c1O ZINC000280888823 523553144 /nfs/dbraw/zinc/55/31/44/523553144.db2.gz DEBLYLWUXRSTEG-INIZCTEOSA-N 1 0 299.418 3.644 20 10 CHCDRO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1cccc(C)c1O ZINC000158081556 523852070 /nfs/dbraw/zinc/85/20/70/523852070.db2.gz WFFOBUCZOZIMRK-CQSZACIVSA-N 1 0 285.387 3.868 20 10 CHCDRO CO[C@](C)(C[NH2+][C@H](C)c1cc(Cl)ccc1O)C1CC1 ZINC000291207756 524027492 /nfs/dbraw/zinc/02/74/92/524027492.db2.gz MNQLGYFJAMPGGB-MEBBXXQBSA-N 1 0 283.799 3.511 20 10 CHCDRO COc1ccccc1[C@@H](C)[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000094616806 524725685 /nfs/dbraw/zinc/72/56/85/524725685.db2.gz HBECQTMPITVVQH-NEPJUHHUSA-N 1 0 289.350 3.952 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(F)c(F)c2)c1 ZINC000049577277 524764083 /nfs/dbraw/zinc/76/40/83/524764083.db2.gz ICFLZOGQQMILFY-SNVBAGLBSA-N 1 0 293.313 3.530 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2ccsc2)c1 ZINC000061360738 524766432 /nfs/dbraw/zinc/76/64/32/524766432.db2.gz IVIFEZNDICHTPX-GHMZBOCLSA-N 1 0 277.389 3.874 20 10 CHCDRO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2cc(F)ccc2O)cc1 ZINC000094618475 525157943 /nfs/dbraw/zinc/15/79/43/525157943.db2.gz ZGOJSUWESJRWPD-NEPJUHHUSA-N 1 0 289.350 3.952 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](C)[C@@H](C)c2ccco2)cc1C ZINC000131068806 525311982 /nfs/dbraw/zinc/31/19/82/525311982.db2.gz CPCZWYUFRLRKAW-ZDUSSCGKSA-N 1 0 259.349 3.795 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC(C)(C)[C@H]2c2cccnc2)c1 ZINC000366545599 525340716 /nfs/dbraw/zinc/34/07/16/525340716.db2.gz QQMLQBRAFCULIQ-QGZVFWFLSA-N 1 0 282.387 3.679 20 10 CHCDRO C[C@@H]([NH2+]C1CC(F)(F)C1)c1cc2c(cc1O)CCCC2 ZINC000277200037 525394690 /nfs/dbraw/zinc/39/46/90/525394690.db2.gz VQNCHDRTBMMTBY-SNVBAGLBSA-N 1 0 281.346 3.719 20 10 CHCDRO Cc1ccsc1C[NH2+][C@H](C)c1cc(C)ccc1O ZINC000094874870 525861510 /nfs/dbraw/zinc/86/15/10/525861510.db2.gz QRCHDDVMFDLFLF-GFCCVEGCSA-N 1 0 261.390 3.921 20 10 CHCDRO COc1cccc(C[NH2+][C@H](C)c2cccc(Cl)c2)c1O ZINC000020124239 526036238 /nfs/dbraw/zinc/03/62/38/526036238.db2.gz KGPUZTKGSIQRJA-LLVKDONJSA-N 1 0 291.778 3.905 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CC[C@@H](CC(F)(F)F)C1 ZINC000278366490 526362786 /nfs/dbraw/zinc/36/27/86/526362786.db2.gz KCTUURRCRVTJJJ-VIFPVBQESA-N 1 0 293.716 3.820 20 10 CHCDRO C[N@H+](Cc1ccsc1)Cc1cc(Cl)ccc1O ZINC000120469152 1117917579 /nfs/dbraw/zinc/91/75/79/1117917579.db2.gz QLCJEDWHNDKVLS-UHFFFAOYSA-N 1 0 267.781 3.739 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)o1 ZINC000113314200 1125493762 /nfs/dbraw/zinc/49/37/62/1125493762.db2.gz PYNNFTNXQWYWCS-LBPRGKRZSA-N 1 0 276.355 3.644 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)CC1CCC1 ZINC000766028275 1120669504 /nfs/dbraw/zinc/66/95/04/1120669504.db2.gz DKIFBDQIMNEKPF-AWEZNQCLSA-N 1 0 260.425 3.729 20 10 CHCDRO C[C@H]([NH2+]CC[C@@H]1CCSC1)c1ccc(N(C)C)cc1 ZINC000704775143 1121368239 /nfs/dbraw/zinc/36/82/39/1121368239.db2.gz KJOJWSSDGJHCCY-UONOGXRCSA-N 1 0 278.465 3.546 20 10 CHCDRO C[C@H]([NH2+]CCCc1nccs1)c1cc(Cl)ccc1O ZINC000273493081 1122236530 /nfs/dbraw/zinc/23/65/30/1122236530.db2.gz OQVRRKHJVKEBJB-JTQLQIEISA-N 1 0 296.823 3.786 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H](C)C2CCC(F)CC2)c1 ZINC000850396087 1123262743 /nfs/dbraw/zinc/26/27/43/1123262743.db2.gz PEXLBNHRLCLYNS-DNOWBOINSA-N 1 0 265.372 3.707 20 10 CHCDRO Cc1ncc([C@@H](C)[NH2+][C@H](C)c2ccccc2O)s1 ZINC000866455419 1124068242 /nfs/dbraw/zinc/06/82/42/1124068242.db2.gz LKTDKVKWHKGXKL-NXEZZACHSA-N 1 0 262.378 3.569 20 10 CHCDRO C[C@]1(CC[NH2+]Cc2cc(F)ccc2O)CC1(Cl)Cl ZINC000824969120 1131492084 /nfs/dbraw/zinc/49/20/84/1131492084.db2.gz FBYYWJPIFQRGRK-LBPRGKRZSA-N 1 0 292.181 3.595 20 10 CHCDRO CCCCC1CC[NH+](Cc2cc(F)ccc2O)CC1 ZINC001140062879 1131661905 /nfs/dbraw/zinc/66/19/05/1131661905.db2.gz HHNKOUFBOOHKHS-UHFFFAOYSA-N 1 0 265.372 3.934 20 10 CHCDRO CO[C@@H]([C@H](C)[NH2+][C@H](C)c1cc(Cl)ccc1O)C1CC1 ZINC000834905363 1131728259 /nfs/dbraw/zinc/72/82/59/1131728259.db2.gz UDZGSNVBTNRHEK-FTGAXOIBSA-N 1 0 283.799 3.510 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCC2CC(F)(F)C2)c(O)c1 ZINC000834910324 1131729673 /nfs/dbraw/zinc/72/96/73/1131729673.db2.gz WJSUWDHQGYSIBR-NSHDSACASA-N 1 0 269.335 3.787 20 10 CHCDRO CN(C)c1ccc(C[NH+]2CCC3(CC3)CC2)c(Cl)c1 ZINC001140922093 1131963882 /nfs/dbraw/zinc/96/38/82/1131963882.db2.gz HAYGJLMTZJOFMC-UHFFFAOYSA-N 1 0 278.827 3.782 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC3(CCC3)C2)cc1Cl ZINC001231870659 1132384668 /nfs/dbraw/zinc/38/46/68/1132384668.db2.gz MSBCUIWKICAMLZ-UHFFFAOYSA-N 1 0 265.784 3.730 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccco1)c1ccc(Cl)cc1O ZINC000841745173 1132388158 /nfs/dbraw/zinc/38/81/58/1132388158.db2.gz VQHYWLPQAZCQAE-SNVBAGLBSA-N 1 0 265.740 3.532 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CC[C@@H]([C@H]2CCCO2)C1 ZINC000884482664 1125568360 /nfs/dbraw/zinc/56/83/60/1125568360.db2.gz GEDKAKKDTFRYBR-DNVCBOLYSA-N 1 0 297.398 3.546 20 10 CHCDRO CCOc1ccccc1C[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC000215913093 1125581800 /nfs/dbraw/zinc/58/18/00/1125581800.db2.gz RTJSAYHLGJUQRV-UHFFFAOYSA-N 1 0 298.430 3.783 20 10 CHCDRO Oc1c(C[NH2+]C[C@@H]2CC[C@H](C3CC3)O2)ccc2ccccc21 ZINC000897506277 1125595233 /nfs/dbraw/zinc/59/52/33/1125595233.db2.gz XSZMREPTMKWGHU-FUHWJXTLSA-N 1 0 297.398 3.593 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+][C@H]2COCc3ccccc32)c(O)c1 ZINC000841759370 1125598982 /nfs/dbraw/zinc/59/89/82/1125598982.db2.gz FLMRVNFUHTZGRJ-PBHICJAKSA-N 1 0 297.398 3.931 20 10 CHCDRO Cc1ccncc1C[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841759373 1125599391 /nfs/dbraw/zinc/59/93/91/1125599391.db2.gz YYSXYALGDJURND-NSHDSACASA-N 1 0 276.767 3.600 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+][C@@H]2COCc3ccccc32)c(O)c1 ZINC000841759375 1125599401 /nfs/dbraw/zinc/59/94/01/1125599401.db2.gz FLMRVNFUHTZGRJ-RHSMWYFYSA-N 1 0 297.398 3.931 20 10 CHCDRO CCOc1ccc(C[NH2+]Cc2cscc2Cl)c(O)c1 ZINC000886199531 1125661026 /nfs/dbraw/zinc/66/10/26/1125661026.db2.gz ZUSLPGSAAQNCPK-UHFFFAOYSA-N 1 0 297.807 3.796 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2cc(C3CC3)no2)c(O)c1 ZINC000886684745 1125708503 /nfs/dbraw/zinc/70/85/03/1125708503.db2.gz RFATUKQPYIZTDV-LBPRGKRZSA-N 1 0 286.375 3.725 20 10 CHCDRO CCCC[C@@H](CCC)[NH2+]Cc1cc(OC)ccc1O ZINC000222073253 1125774187 /nfs/dbraw/zinc/77/41/87/1125774187.db2.gz XWCZHNJAOVNOIC-CQSZACIVSA-N 1 0 265.397 3.849 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H](C)CSC)cc1 ZINC000248147643 1129407123 /nfs/dbraw/zinc/40/71/23/1129407123.db2.gz QIVSUSRABDSWPB-OLZOCXBDSA-N 1 0 266.454 3.545 20 10 CHCDRO CC[C@H](C)[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000768338011 1129851705 /nfs/dbraw/zinc/85/17/05/1129851705.db2.gz KTTRGPBLWQSLLM-HNNXBMFYSA-N 1 0 260.425 3.907 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]Cc2cccc(C)c2O)c1 ZINC000158113484 1126746220 /nfs/dbraw/zinc/74/62/20/1126746220.db2.gz QBNIPIAXMNCHOE-ZDUSSCGKSA-N 1 0 271.360 3.560 20 10 CHCDRO Cc1oc2ccccc2c1C[NH2+]Cc1ccccc1O ZINC000160791473 1126772203 /nfs/dbraw/zinc/77/22/03/1126772203.db2.gz FWEGVGUSYIHPIS-UHFFFAOYSA-N 1 0 267.328 3.737 20 10 CHCDRO CC(C)([NH2+]Cc1ccccc1O)c1ccc(F)c(F)c1 ZINC000175987406 1126787987 /nfs/dbraw/zinc/78/79/87/1126787987.db2.gz YCRVQAYGUBEEEF-UHFFFAOYSA-N 1 0 277.314 3.695 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](c2ccccn2)C2CC2)c1 ZINC000903334463 1126801613 /nfs/dbraw/zinc/80/16/13/1126801613.db2.gz AEWHNEGFDZSWAR-KZULUSFZSA-N 1 0 298.386 3.598 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCCOC1)c1ccc(N2CCCCC2)cc1 ZINC000177926726 1126807284 /nfs/dbraw/zinc/80/72/84/1126807284.db2.gz VYOJKPXJZGDUNN-WBVHZDCISA-N 1 0 288.435 3.507 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CC2CC(F)(F)C2)cc1 ZINC000383081640 1130546102 /nfs/dbraw/zinc/54/61/02/1130546102.db2.gz AHDARAIRDIRIOS-UHFFFAOYSA-N 1 0 282.378 3.668 20 10 CHCDRO Cc1cc(C[NH2+]Cc2ccc3c(c2)CCO3)c(C)s1 ZINC001649005708 1126827599 /nfs/dbraw/zinc/82/75/99/1126827599.db2.gz QWZJRYJJLYWGPJ-UHFFFAOYSA-N 1 0 273.401 3.590 20 10 CHCDRO CC(C)([NH3+])c1ccc(NCc2c(O)cccc2Cl)cc1 ZINC000904470359 1126853514 /nfs/dbraw/zinc/85/35/14/1126853514.db2.gz IPXWBKBOIFYYPH-UHFFFAOYSA-N 1 0 290.794 3.852 20 10 CHCDRO Cc1ccc(O)c(CNc2ccc(C(C)(C)[NH3+])cc2)c1 ZINC000904470851 1126853778 /nfs/dbraw/zinc/85/37/78/1126853778.db2.gz RNXXUIPCCWBEOI-UHFFFAOYSA-N 1 0 270.376 3.507 20 10 CHCDRO CC[C@@H]([NH2+]CCCc1ccccn1)c1ccc(N(C)C)cc1 ZINC000181492044 1126856305 /nfs/dbraw/zinc/85/63/05/1126856305.db2.gz OJXPVCFHRLAURP-LJQANCHMSA-N 1 0 297.446 3.821 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCN(c2ccccc2)C1)c1ccccc1O ZINC000183412562 1126887126 /nfs/dbraw/zinc/88/71/26/1126887126.db2.gz ICCBWRFPHKBHIB-HOTGVXAUSA-N 1 0 296.414 3.569 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCCOc2ccccc21)c1ccccc1O ZINC000183475618 1126887953 /nfs/dbraw/zinc/88/79/53/1126887953.db2.gz FVTLYRJLIXAYPS-CJNGLKHVSA-N 1 0 283.371 3.957 20 10 CHCDRO C[C@H](O)C[C@@H](C[NH2+][C@@H](C)c1ccccc1O)c1ccccc1 ZINC000183559112 1126888922 /nfs/dbraw/zinc/88/89/22/1126888922.db2.gz PSNBDUGICUUBDD-ZOBUZTSGSA-N 1 0 299.414 3.598 20 10 CHCDRO COCCC1(C[NH2+][C@@H](C)c2ccc(C)cc2O)CCCC1 ZINC000185748016 1126902367 /nfs/dbraw/zinc/90/23/67/1126902367.db2.gz MMTSHVHZEWBART-HNNXBMFYSA-N 1 0 291.435 3.948 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)C[C@H](O)c2ccccc2)c1 ZINC000185833464 1126903966 /nfs/dbraw/zinc/90/39/66/1126903966.db2.gz BDCDYPLDPWECJA-KHYOSLBOSA-N 1 0 299.414 3.863 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H](CC(F)(F)F)C(C)C)c1 ZINC000782543071 1130783062 /nfs/dbraw/zinc/78/30/62/1130783062.db2.gz ABZKASMAHJVJLY-LBPRGKRZSA-N 1 0 275.314 3.767 20 10 CHCDRO Cc1cc(O)c(C[NH+]2CCC(c3ccncc3)CC2)cc1C ZINC000191296751 1126950407 /nfs/dbraw/zinc/95/04/07/1126950407.db2.gz LGKUJJOBXUKYON-UHFFFAOYSA-N 1 0 296.414 3.784 20 10 CHCDRO CO[C@@H](C)[C@H](C)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000191655591 1126953722 /nfs/dbraw/zinc/95/37/22/1126953722.db2.gz RZZCKOGAOBSDNJ-XQQFMLRXSA-N 1 0 273.376 3.619 20 10 CHCDRO C[C@H]([NH2+][C@@H]1C[C@H]1c1cccc(F)c1)c1ccccc1O ZINC000906594269 1126960833 /nfs/dbraw/zinc/96/08/33/1126960833.db2.gz CTSXMOLYWGBIOE-KNXALSJPSA-N 1 0 271.335 3.738 20 10 CHCDRO CCc1cnc(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)s1 ZINC000284307306 1126982492 /nfs/dbraw/zinc/98/24/92/1126982492.db2.gz ZALNLEMWUZARDR-GFCCVEGCSA-N 1 0 290.432 3.879 20 10 CHCDRO CCSCC[C@@H](C)[NH2+][C@H](C)c1cc(F)ccc1O ZINC000168809751 1130917293 /nfs/dbraw/zinc/91/72/93/1130917293.db2.gz VEDCKHUTZBMTSN-GHMZBOCLSA-N 1 0 271.401 3.714 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H]2CCO[C@@H](C(C)(C)C)C2)cc1C ZINC000270602177 1127059054 /nfs/dbraw/zinc/05/90/54/1127059054.db2.gz AUPSMNQUICPJDV-NVXWUHKLSA-N 1 0 291.435 3.692 20 10 CHCDRO CC[C@@H]1CCCC[N@@H+]1Cc1c(O)cc(OC)cc1Cl ZINC001236804788 1131011666 /nfs/dbraw/zinc/01/16/66/1131011666.db2.gz ZOEMREZFGWCKAV-LLVKDONJSA-N 1 0 283.799 3.819 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CCC[C@@H](C)[C@H]2C)c(Cl)c1 ZINC001236798218 1131008098 /nfs/dbraw/zinc/00/80/98/1131008098.db2.gz DFJRQULRTXIYCS-GHMZBOCLSA-N 1 0 283.799 3.675 20 10 CHCDRO CC[C@H]([NH2+][C@H](CCO)c1ccccc1)c1ccccc1O ZINC000155986001 1127091260 /nfs/dbraw/zinc/09/12/60/1127091260.db2.gz BEYULNZSYXFMIK-DLBZAZTESA-N 1 0 285.387 3.557 20 10 CHCDRO Cc1cc(Br)cc(C[N@H+]2CCC=C(C)C2)c1O ZINC000798090576 1131024586 /nfs/dbraw/zinc/02/45/86/1131024586.db2.gz QPUVUZUIVTYQDI-UHFFFAOYSA-N 1 0 296.208 3.615 20 10 CHCDRO Cc1noc(C)c1CC[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000284311417 1127179822 /nfs/dbraw/zinc/17/98/22/1127179822.db2.gz ZHAYZXYPDMJHRJ-ZDUSSCGKSA-N 1 0 288.391 3.507 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCCSC2)c(O)c1C ZINC000286999284 1127280859 /nfs/dbraw/zinc/28/08/59/1127280859.db2.gz KAAXZPRIPOGDMW-KBPBESRZSA-N 1 0 279.449 3.803 20 10 CHCDRO CC[C@H]([NH2+]CCCC(C)(C)COC)c1ccccc1O ZINC000287043152 1127283918 /nfs/dbraw/zinc/28/39/18/1127283918.db2.gz MJXBOFRPECBLIA-HNNXBMFYSA-N 1 0 279.424 3.886 20 10 CHCDRO CC[C@H](CC(F)(F)F)[NH2+][C@H](C)c1cc(F)ccc1O ZINC000760902645 1127324693 /nfs/dbraw/zinc/32/46/93/1127324693.db2.gz HHFAZAHARVFUJG-PSASIEDQSA-N 1 0 279.277 3.913 20 10 CHCDRO CC[C@H](CC(F)(F)F)[NH2+][C@H](C)c1cc(OC)ccc1O ZINC000760905143 1127325284 /nfs/dbraw/zinc/32/52/84/1127325284.db2.gz JEVZFUVSZXSWMK-NXEZZACHSA-N 1 0 291.313 3.782 20 10 CHCDRO C[C@@H]([NH2+]CCC[C@@H]1CCCCO1)c1cc(F)cc(F)c1[O-] ZINC000760904263 1127325296 /nfs/dbraw/zinc/32/52/96/1127325296.db2.gz BOTOEXUDUSJQNG-YPMHNXCESA-N 1 0 299.361 3.670 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H]2c3ccccc3O[C@@H]2C)cc1C ZINC000288544452 1127345929 /nfs/dbraw/zinc/34/59/29/1127345929.db2.gz LBBSCHLLNYNZHH-FZKQIMNGSA-N 1 0 283.371 3.621 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CC(C)(C)OC1(C)C)c1ccccc1O ZINC000157881711 1127400986 /nfs/dbraw/zinc/40/09/86/1127400986.db2.gz OATQJUNYPQJBKZ-HIFRSBDPSA-N 1 0 277.408 3.779 20 10 CHCDRO Cc1cc(N2CC=C(c3c[nH]c4ncccc34)CC2)cc[nH+]1 ZINC000358148085 1127404450 /nfs/dbraw/zinc/40/44/50/1127404450.db2.gz LCAXIBGVLWRXNY-UHFFFAOYSA-N 1 0 290.370 3.560 20 10 CHCDRO CC[C@@H]1CCCCC[N@@H+]1Cc1cc(F)ccc1O ZINC000226565435 1127411415 /nfs/dbraw/zinc/41/14/15/1127411415.db2.gz JHVBRHNUDHHQGY-CQSZACIVSA-N 1 0 251.345 3.686 20 10 CHCDRO COc1ccc([C@@H](C)[NH2+]Cc2cccc(C)c2O)cc1F ZINC000158081121 1127437029 /nfs/dbraw/zinc/43/70/29/1127437029.db2.gz CNVPUJVSNASXRT-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H]2CCCS2)cc1 ZINC000168669956 1127458963 /nfs/dbraw/zinc/45/89/63/1127458963.db2.gz IRFMGMFNYWWBBU-BBRMVZONSA-N 1 0 278.465 3.689 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1CCCS1)c1ccc(N(C)C)cc1 ZINC000168688019 1127461672 /nfs/dbraw/zinc/46/16/72/1127461672.db2.gz OYYFVNJUCJNOAX-JKSUJKDBSA-N 1 0 278.465 3.689 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H]2CCC[C@H](C)CC2)c1O ZINC000227309967 1127469720 /nfs/dbraw/zinc/46/97/20/1127469720.db2.gz ACIXCEVGTAHKCH-DZGCQCFKSA-N 1 0 277.408 3.849 20 10 CHCDRO C[C@H]([NH2+][C@@H](c1ccccc1)[C@H]1CCOC1)c1ccccc1O ZINC000360697803 1127507198 /nfs/dbraw/zinc/50/71/98/1127507198.db2.gz IYZLLBXHXMBBEW-QOKNQOGYSA-N 1 0 297.398 3.821 20 10 CHCDRO CC[C@@H]([NH2+]CCCCC[NH+]1CCCC1)c1ccccc1O ZINC000293676921 1127512083 /nfs/dbraw/zinc/51/20/83/1127512083.db2.gz KAWATXPCOJWNRZ-QGZVFWFLSA-N 1 0 290.451 3.699 20 10 CHCDRO CC[C@H]([NH2+]CCCCC[NH+]1CCCC1)c1ccccc1O ZINC000293676918 1127512159 /nfs/dbraw/zinc/51/21/59/1127512159.db2.gz KAWATXPCOJWNRZ-KRWDZBQOSA-N 1 0 290.451 3.699 20 10 CHCDRO Cc1cc(C[N@@H+]2CC[C@@]3(C)[C@@H](C2)C3(F)F)ccc1N(C)C ZINC000293700782 1127513518 /nfs/dbraw/zinc/51/35/18/1127513518.db2.gz XDISFGPGSDMVPG-CVEARBPZSA-N 1 0 294.389 3.538 20 10 CHCDRO COc1cc(Cl)cc(C[N@H+](CC(C)C)C2CC2)c1O ZINC000761191853 1127517191 /nfs/dbraw/zinc/51/71/91/1127517191.db2.gz CZMQVKVSEBVJFL-UHFFFAOYSA-N 1 0 283.799 3.675 20 10 CHCDRO CCc1noc(C)c1C[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000293819803 1127523077 /nfs/dbraw/zinc/52/30/77/1127523077.db2.gz WHYGVEQRCNUKMP-SECBINFHSA-N 1 0 294.782 3.755 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CC2CC(F)(F)C2)c(O)c1 ZINC000294447153 1127575690 /nfs/dbraw/zinc/57/56/90/1127575690.db2.gz VKDJBNZGSBMFAE-NSHDSACASA-N 1 0 269.335 3.705 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CCCc2nccs2)c(O)c1 ZINC000294650277 1127589274 /nfs/dbraw/zinc/58/92/74/1127589274.db2.gz GRTSVGFWLQANFO-CYBMUJFWSA-N 1 0 290.432 3.749 20 10 CHCDRO Fc1cccc2c1CC[C@@H]2[NH2+]Cc1ccc2c(c1)CCO2 ZINC000126927015 1127598718 /nfs/dbraw/zinc/59/87/18/1127598718.db2.gz DNAIQPAAGZXSTI-KRWDZBQOSA-N 1 0 283.346 3.538 20 10 CHCDRO C[C@@H](Cc1ccc(F)cc1)[NH2+]Cc1cc(Cl)ccc1O ZINC000060942095 1127625033 /nfs/dbraw/zinc/62/50/33/1127625033.db2.gz VPHYVIWVEKOODO-NSHDSACASA-N 1 0 293.769 3.906 20 10 CHCDRO Cc1csc([C@H](C)C[NH2+][C@@H]2CCc3cccc(O)c32)n1 ZINC000295783847 1127652966 /nfs/dbraw/zinc/65/29/66/1127652966.db2.gz ADELAVWGYDJSFU-ZWNOBZJWSA-N 1 0 288.416 3.538 20 10 CHCDRO CC[C@@H]1CC[C@H](C)[N@@H+]1Cc1cc(Cl)cc(OC)c1O ZINC000229121206 1127650518 /nfs/dbraw/zinc/65/05/18/1127650518.db2.gz WEZAQJGVAMVYNT-GXFFZTMASA-N 1 0 283.799 3.817 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1cnn(CC)c1)c1ccc(C)cc1O ZINC000296118406 1127662869 /nfs/dbraw/zinc/66/28/69/1127662869.db2.gz ZWUGFMTUZQZIAV-XJKSGUPXSA-N 1 0 287.407 3.719 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]C[C@@H]1CCCC(F)(F)C1)CC2 ZINC000296423011 1127671839 /nfs/dbraw/zinc/67/18/39/1127671839.db2.gz LNVKOIUQONEBCY-YPMHNXCESA-N 1 0 281.346 3.795 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]C[C@H]1[C@@H]3c4ccccc4C[C@H]13)CC2 ZINC000297115480 1127688713 /nfs/dbraw/zinc/68/87/13/1127688713.db2.gz YHDNPPKCEXWFHU-WOCWXWTJSA-N 1 0 291.394 3.555 20 10 CHCDRO C[C@H]([NH2+]CCC(C)(F)F)c1cc2c(cc1O)CCCC2 ZINC000297192107 1127690845 /nfs/dbraw/zinc/69/08/45/1127690845.db2.gz FLZCHPXYFAMQAR-NSHDSACASA-N 1 0 283.362 3.967 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC(C)(C)c2ccccn2)c(O)c1 ZINC000297477656 1127698002 /nfs/dbraw/zinc/69/80/02/1127698002.db2.gz ZAFOUKOVRMLPFH-CQSZACIVSA-N 1 0 284.403 3.724 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H]2COc3c2cccc3Cl)c1 ZINC000365943909 1127741929 /nfs/dbraw/zinc/74/19/29/1127741929.db2.gz AVBCPBJBACDLEG-CQSZACIVSA-N 1 0 289.762 3.577 20 10 CHCDRO C[C@H]([NH2+]CC[C@@H]1CCOC1)c1ccc2ccccc2c1O ZINC000230672525 1127770897 /nfs/dbraw/zinc/77/08/97/1127770897.db2.gz PXXDEJIQSDOXCA-UONOGXRCSA-N 1 0 285.387 3.623 20 10 CHCDRO CS[C@@H]1CC[C@@H]([NH2+][C@@H](C)c2cc(C)ccc2O)C1 ZINC000230664422 1127771538 /nfs/dbraw/zinc/77/15/38/1127771538.db2.gz JYNMNKKZWDELET-YNEHKIRRSA-N 1 0 265.422 3.635 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CC[C@H](SC)C2)cc1 ZINC000230697900 1127772514 /nfs/dbraw/zinc/77/25/14/1127772514.db2.gz ZCTPGVYSOIKTQC-WBVHZDCISA-N 1 0 292.492 3.907 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CCC[C@@H]3CCC[C@@H]32)c1O ZINC000230929805 1127784480 /nfs/dbraw/zinc/78/44/80/1127784480.db2.gz SKMCTMWNNIIWDB-FZMZJTMJSA-N 1 0 295.810 3.819 20 10 CHCDRO CC[C@@H]([NH2+]CCC1CC1)c1cc(Br)ccc1O ZINC000088454373 1127937281 /nfs/dbraw/zinc/93/72/81/1127937281.db2.gz SUDGEWHFQXGHNY-CYBMUJFWSA-N 1 0 298.224 3.996 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCSCC(F)(F)F)c1 ZINC000698952878 1128069129 /nfs/dbraw/zinc/06/91/29/1128069129.db2.gz MLIBQPNRDPIMCL-SNVBAGLBSA-N 1 0 293.354 3.647 20 10 CHCDRO CC(C)[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)C1CC1 ZINC000324091961 1128075434 /nfs/dbraw/zinc/07/54/34/1128075434.db2.gz HITRGPQCOZBISL-SFHVURJKSA-N 1 0 272.436 3.811 20 10 CHCDRO CCCCCC[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1 ZINC000151867317 1128080142 /nfs/dbraw/zinc/08/01/42/1128080142.db2.gz WMUGKUZPYRIVGR-INIZCTEOSA-N 1 0 290.451 3.754 20 10 CHCDRO Cc1noc(C)c1[C@H](C)[NH2+]CCCSc1nccs1 ZINC000925092306 1128121689 /nfs/dbraw/zinc/12/16/89/1128121689.db2.gz BGHGQDJCSVZIJA-VIFPVBQESA-N 1 0 297.449 3.581 20 10 CHCDRO CCC[N@H+](CC[C@H]1CCCCO1)Cc1ccccc1O ZINC000754051451 1128179518 /nfs/dbraw/zinc/17/95/18/1128179518.db2.gz ULNHFTJGCKLLDG-MRXNPFEDSA-N 1 0 277.408 3.563 20 10 CHCDRO CC(C)CC[N@H+](Cc1cc2c(cc1O)CCC2)C1CC1 ZINC000914566594 1128210988 /nfs/dbraw/zinc/21/09/88/1128210988.db2.gz CKDWLLPJWDLSFX-UHFFFAOYSA-N 1 0 273.420 3.891 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2cccc3c2OCC3)c(O)c1 ZINC000927090586 1128216658 /nfs/dbraw/zinc/21/66/58/1128216658.db2.gz NPJSQNBGZAYOAD-CQSZACIVSA-N 1 0 297.398 3.795 20 10 CHCDRO CC1(C)C[C@H](C[NH2+][C@H]2CCc3cccc(O)c32)C(C)(C)O1 ZINC000927099378 1128217513 /nfs/dbraw/zinc/21/75/13/1128217513.db2.gz NDIIRQDXZMNLKY-KGLIPLIRSA-N 1 0 289.419 3.563 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CC[C@H]2CCC3(CCC3)O2)c1 ZINC000927127198 1128220574 /nfs/dbraw/zinc/22/05/74/1128220574.db2.gz GKIJNRFDEBXIGL-HUUCEWRRSA-N 1 0 289.419 3.843 20 10 CHCDRO C[C@@H]([NH2+]C1([C@H]2CCCCO2)CC1)c1ccc(Cl)cc1O ZINC000927156690 1128223386 /nfs/dbraw/zinc/22/33/86/1128223386.db2.gz BETMHRSQWZUDCM-IAQYHMDHSA-N 1 0 295.810 3.798 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@H+]2CC3(CCC3)C[C@@H]2C)c1 ZINC000762140244 1128273331 /nfs/dbraw/zinc/27/33/31/1128273331.db2.gz TZBPPGAWULOVNV-AWEZNQCLSA-N 1 0 259.393 3.774 20 10 CHCDRO COc1cc(C[N@@H+]2CC[C@@H](C)C2)c(O)c(C(C)(C)C)c1 ZINC000754730506 1128299954 /nfs/dbraw/zinc/29/99/54/1128299954.db2.gz QUMXWCJUWLGSNU-GFCCVEGCSA-N 1 0 277.408 3.540 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCO[C@H](C(C)C)C2)cc1C(C)C ZINC000777969209 1128352125 /nfs/dbraw/zinc/35/21/25/1128352125.db2.gz OREVNBALUSUXHE-SFHVURJKSA-N 1 0 291.435 3.681 20 10 CHCDRO C[C@H]1CC[N@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C[C@H]1F ZINC000777967751 1128352162 /nfs/dbraw/zinc/35/21/62/1128352162.db2.gz ZAMAMLSNMCDXTO-SMDDNHRTSA-N 1 0 295.398 3.575 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@H](C1CC1)C1CCC1)CC2 ZINC000324631657 1128389044 /nfs/dbraw/zinc/38/90/44/1128389044.db2.gz AOCOURXRMKSWAW-PBHICJAKSA-N 1 0 257.377 3.548 20 10 CHCDRO C[C@H]([NH2+][C@H](C1CC1)C1CCC1)c1cc(F)ccc1O ZINC000324606572 1128389550 /nfs/dbraw/zinc/38/95/50/1128389550.db2.gz BJRZXUUFPGHJAE-QFYYESIMSA-N 1 0 263.356 3.761 20 10 CHCDRO COc1ccc2ccc(O)c(C[N@@H+]3CC[C@H](C4CC4)C3)c2c1 ZINC000763330281 1128392497 /nfs/dbraw/zinc/39/24/97/1128392497.db2.gz CGFXEVZJZVTYEO-HNNXBMFYSA-N 1 0 297.398 3.786 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+](C)Cc2cc(C)ccc2O)c1 ZINC000763382580 1128429849 /nfs/dbraw/zinc/42/98/49/1128429849.db2.gz XVSXZFZCUSSXGH-UHFFFAOYSA-N 1 0 269.388 3.949 20 10 CHCDRO CCC[C@@H](C)CC[C@H](C)[NH2+]Cc1ccc(O)c(O)c1 ZINC001257472345 1128473002 /nfs/dbraw/zinc/47/30/02/1128473002.db2.gz SJCDMSAIWRXJLD-OLZOCXBDSA-N 1 0 265.397 3.792 20 10 CHCDRO CC(C)[N@H+](C/C=C/Cl)Cc1ccc(N(C)C)cc1 ZINC000917075032 1128474632 /nfs/dbraw/zinc/47/46/32/1128474632.db2.gz OWUKENIXAKNXNJ-BJMVGYQFSA-N 1 0 266.816 3.716 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CCc2ccsc2)cc1 ZINC000042374034 1128575196 /nfs/dbraw/zinc/57/51/96/1128575196.db2.gz SSVKLOMNUHXEHB-UHFFFAOYSA-N 1 0 288.460 3.927 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)Cc1ccc(O)cc1)c1ccccc1O ZINC000155668713 1128610858 /nfs/dbraw/zinc/61/08/58/1128610858.db2.gz GVXNRXFZMBCYGZ-DYVFJYSZSA-N 1 0 285.387 3.770 20 10 CHCDRO CC[N@@H+](Cc1cc(C(C)C)c(C)cc1O)C[C@H]1CCCO1 ZINC000919945651 1128652536 /nfs/dbraw/zinc/65/25/36/1128652536.db2.gz OMHKYUQEUMVQNH-MRXNPFEDSA-N 1 0 291.435 3.825 20 10 CHCDRO C[C@H]1CCC[C@H](C)[N@H+](Cc2cc(F)ccc2O)C1 ZINC000779019099 1128683189 /nfs/dbraw/zinc/68/31/89/1128683189.db2.gz DSLXUECPAYBSNP-RYUDHWBXSA-N 1 0 251.345 3.542 20 10 CHCDRO CC[C@@]1(C)CCC[N@H+](Cc2cc(F)ccc2O)C1 ZINC000779019863 1128683291 /nfs/dbraw/zinc/68/32/91/1128683291.db2.gz IYQUAMUGJPOUQG-HNNXBMFYSA-N 1 0 251.345 3.543 20 10 CHCDRO COc1ccc(C[NH2+]C2[C@H](C)CCC[C@H]2C)cc1C ZINC000921067173 1128699741 /nfs/dbraw/zinc/69/97/41/1128699741.db2.gz NPSONTRMSNYGEC-CHWSQXEVSA-N 1 0 261.409 3.918 20 10 CHCDRO CCc1cccc(C[NH+]2CCC(C(F)(F)F)CC2)c1O ZINC000692093496 1128708093 /nfs/dbraw/zinc/70/80/93/1128708093.db2.gz PIWQGTGRLDIXDA-UHFFFAOYSA-N 1 0 287.325 3.729 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCCO2)c1ccccc1 ZINC000921477062 1128710375 /nfs/dbraw/zinc/71/03/75/1128710375.db2.gz WNKGWZBFQCWYSD-CQSZACIVSA-N 1 0 267.372 3.862 20 10 CHCDRO CC(C)C[C@@H](C)C[C@H](C)[NH2+]CCc1ccc(O)c(O)c1 ZINC001258056544 1128714707 /nfs/dbraw/zinc/71/47/07/1128714707.db2.gz QBDFUECEUALOFH-KGLIPLIRSA-N 1 0 279.424 3.691 20 10 CHCDRO CCC1CC[NH+](Cc2c(O)ccc3ccncc32)CC1 ZINC000048621940 1128720050 /nfs/dbraw/zinc/72/00/50/1128720050.db2.gz OTQJJTVCERCFJO-UHFFFAOYSA-N 1 0 270.376 3.562 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCc2c(F)cccc2F)c(O)c1 ZINC000185067769 1117759275 /nfs/dbraw/zinc/75/92/75/1117759275.db2.gz CXKNWFMRNHNVFZ-GFCCVEGCSA-N 1 0 291.341 3.872 20 10 CHCDRO COc1cc(C[NH2+][C@@H](C)c2cc(F)ccc2O)ccc1C ZINC000185193663 1117781009 /nfs/dbraw/zinc/78/10/09/1117781009.db2.gz LOIJEHZSHQRQAP-LBPRGKRZSA-N 1 0 289.350 3.699 20 10 CHCDRO C[C@@H](C[NH2+][C@@H](C)c1ccc2ccccc2c1O)N(C)C1CC1 ZINC000185368853 1117814438 /nfs/dbraw/zinc/81/44/38/1117814438.db2.gz BVLZCAOZTDLOGE-KBPBESRZSA-N 1 0 298.430 3.679 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CC2CC(F)(F)C2)c(O)c1 ZINC000294447139 1117843542 /nfs/dbraw/zinc/84/35/42/1117843542.db2.gz VKDJBNZGSBMFAE-LLVKDONJSA-N 1 0 269.335 3.705 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H](C)[C@@H](C)c2ccccc2)c1 ZINC000237566645 1128743376 /nfs/dbraw/zinc/74/33/76/1128743376.db2.gz KKLSEZLUNWZYJD-CABCVRRESA-N 1 0 269.388 3.982 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](CCO)C2CCCCC2)c1 ZINC000185828750 1117914267 /nfs/dbraw/zinc/91/42/67/1117914267.db2.gz WIVUMVGZKUPAQN-WMLDXEAASA-N 1 0 291.435 3.683 20 10 CHCDRO CCC1([NH2+]Cc2cc(Br)ccc2O)CCCC1 ZINC000382583776 1118055773 /nfs/dbraw/zinc/05/57/73/1118055773.db2.gz WSCMAPSROIAENH-UHFFFAOYSA-N 1 0 298.224 3.967 20 10 CHCDRO COc1ccc(O)c(C[N@H+](C)[C@@H](C)c2ccc(C)cc2)c1 ZINC000179682274 1128753913 /nfs/dbraw/zinc/75/39/13/1128753913.db2.gz OOUFZBOSMGUTBW-AWEZNQCLSA-N 1 0 285.387 3.902 20 10 CHCDRO Cc1cccc(C[N@@H+](Cc2ccc(C#N)cc2)C(C)C)c1O ZINC000179696053 1128754262 /nfs/dbraw/zinc/75/42/62/1128754262.db2.gz DNWHWBMGKLSRQO-UHFFFAOYSA-N 1 0 294.398 3.983 20 10 CHCDRO Oc1ccc2ccncc2c1C[NH+]1C[C@@H]2CCCC[C@H]2C1 ZINC000749976358 1118087158 /nfs/dbraw/zinc/08/71/58/1118087158.db2.gz LHCVHXPHDNPJKH-GJZGRUSLSA-N 1 0 282.387 3.562 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]C(C)(C)c2cccs2)c1 ZINC000735086025 1118123942 /nfs/dbraw/zinc/12/39/42/1118123942.db2.gz NGPVITZRZXUEPE-UHFFFAOYSA-N 1 0 291.416 3.877 20 10 CHCDRO Cc1cc(C[N@H+]2CCO[C@@H](C)[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC000765098294 1118135021 /nfs/dbraw/zinc/13/50/21/1118135021.db2.gz GITHWOWKYGYYHN-KGLIPLIRSA-N 1 0 291.435 3.607 20 10 CHCDRO C[C@H](CSC(C)(C)C)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000765474026 1118154938 /nfs/dbraw/zinc/15/49/38/1118154938.db2.gz KWKPZOYLNXXDSY-GFCCVEGCSA-N 1 0 298.471 3.902 20 10 CHCDRO C[C@@H]1CCCC[C@H]1C[NH2+]Cc1c(O)cccc1Cl ZINC000083552198 1118168663 /nfs/dbraw/zinc/16/86/63/1118168663.db2.gz XDXZQYVVDZSAKX-NEPJUHHUSA-N 1 0 267.800 3.962 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCS[C@H]1C)c1cc2c(cc1O)CCCC2 ZINC000842927861 1118171455 /nfs/dbraw/zinc/17/14/55/1118171455.db2.gz GEXHKSIDGOQYSA-MKBNYLNASA-N 1 0 291.460 3.816 20 10 CHCDRO CCc1ccc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCO3)o1 ZINC000765610639 1118182485 /nfs/dbraw/zinc/18/24/85/1118182485.db2.gz WNGJWKQAXQTXSA-GFCCVEGCSA-N 1 0 271.360 3.628 20 10 CHCDRO C[C@@H]([NH2+]CCCOc1ccc(F)cc1)c1ccccc1O ZINC000179890307 1128764339 /nfs/dbraw/zinc/76/43/39/1128764339.db2.gz MMAFNWDIMPNALM-CYBMUJFWSA-N 1 0 289.350 3.651 20 10 CHCDRO C[C@H]([NH2+]CCc1ccc(F)c(F)c1)c1ccccc1O ZINC000179900507 1128764878 /nfs/dbraw/zinc/76/48/78/1128764878.db2.gz BKYPHZFACGNKFI-NSHDSACASA-N 1 0 277.314 3.564 20 10 CHCDRO COc1cccc(C[N@H+](C)Cc2c(C)ccc(C)c2O)c1 ZINC001140178852 1118245445 /nfs/dbraw/zinc/24/54/45/1118245445.db2.gz AARWSWUCWFACPV-UHFFFAOYSA-N 1 0 285.387 3.650 20 10 CHCDRO Clc1cccc(CC[NH2+]Cc2ccc3c(c2)CCO3)c1 ZINC000237848723 1128765289 /nfs/dbraw/zinc/76/52/89/1128765289.db2.gz XACDYKIJAYGYFJ-UHFFFAOYSA-N 1 0 287.790 3.607 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H](C)CN(CC)CC)cc1 ZINC000765765572 1118267986 /nfs/dbraw/zinc/26/79/86/1118267986.db2.gz GWVDUNGJCPIVRN-HZPDHXFCSA-N 1 0 291.483 3.524 20 10 CHCDRO CN(C)c1ccc(C[NH2+]Cc2coc3ccccc23)cc1 ZINC000083601952 1118357160 /nfs/dbraw/zinc/35/71/60/1118357160.db2.gz BVOXDBKYYOCPQK-UHFFFAOYSA-N 1 0 280.371 3.789 20 10 CHCDRO Cc1ccc(C[NH2+][C@H]2CCc3cccc(O)c32)cc1F ZINC000834496375 1118399583 /nfs/dbraw/zinc/39/95/83/1118399583.db2.gz FUJUIDGZYMWFHL-HNNXBMFYSA-N 1 0 271.335 3.617 20 10 CHCDRO Cc1cccc(C[NH2+]Cc2ccc3c(c2)CCCN3C)c1 ZINC000050266807 1118470356 /nfs/dbraw/zinc/47/03/56/1118470356.db2.gz LFZHNXUEPTYBAO-UHFFFAOYSA-N 1 0 280.415 3.667 20 10 CHCDRO C[C@@H]1CCC[C@H]([NH2+]Cc2ccc3c(c2)CCCN3C)C1 ZINC000050286455 1118475047 /nfs/dbraw/zinc/47/50/47/1118475047.db2.gz VSUHCZQKMWKSTN-PBHICJAKSA-N 1 0 272.436 3.737 20 10 CHCDRO CCc1cccc(C[NH2+]Cc2cc(C)cc(C)c2)c1O ZINC000693292711 1118515693 /nfs/dbraw/zinc/51/56/93/1118515693.db2.gz ZRDONPWWGQKXCG-UHFFFAOYSA-N 1 0 269.388 3.861 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CC(C2CC2)C2CC2)c1 ZINC000088455405 1118521493 /nfs/dbraw/zinc/52/14/93/1118521493.db2.gz XQQYKTNAPKXXMI-GFCCVEGCSA-N 1 0 259.393 3.787 20 10 CHCDRO CCOc1cccc(C[N@H+](C)Cc2ccccc2F)c1O ZINC000160728014 1118533581 /nfs/dbraw/zinc/53/35/81/1118533581.db2.gz GGDYBVUKVZDOIV-UHFFFAOYSA-N 1 0 289.350 3.562 20 10 CHCDRO C[C@H]1C[C@@H]([NH2+]CCC(C)(F)F)c2c1c(F)ccc2O ZINC000834819165 1118572921 /nfs/dbraw/zinc/57/29/21/1118572921.db2.gz SZLJZAOYLOTSIG-WCBMZHEXSA-N 1 0 273.298 3.715 20 10 CHCDRO COc1ccc(C[NH2+]C[C@H]2CCCC[C@@H]2C)cc1C ZINC000109935542 1118590280 /nfs/dbraw/zinc/59/02/80/1118590280.db2.gz OELUBJZLZVIXLZ-XJKSGUPXSA-N 1 0 261.409 3.920 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCOC1(C)C)c1cc(Cl)ccc1O ZINC000834875796 1118601599 /nfs/dbraw/zinc/60/15/99/1118601599.db2.gz UMCLNSXXVCXAQJ-JSGCOSHPSA-N 1 0 283.799 3.654 20 10 CHCDRO CCn1ccnc1[C@@H](C)[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000834893291 1118613595 /nfs/dbraw/zinc/61/35/95/1118613595.db2.gz FHOBCAYPTALJMO-GHMZBOCLSA-N 1 0 293.798 3.674 20 10 CHCDRO Cc1cccc(C[N@H+](C[C@H]2CCCO2)C2CCCC2)c1O ZINC000180456004 1128792282 /nfs/dbraw/zinc/79/22/82/1128792282.db2.gz XKCNQXUDHWUOIO-QGZVFWFLSA-N 1 0 289.419 3.624 20 10 CHCDRO COc1cc(C)cc(C[N@@H+]2C[C@H](C)[C@H]3CCCC[C@@H]32)c1O ZINC000782275829 1118735790 /nfs/dbraw/zinc/73/57/90/1118735790.db2.gz IUEHUMKOSNNATG-IMJJTQAJSA-N 1 0 289.419 3.720 20 10 CHCDRO Cc1cc(C[N@@H+]2CCS[C@H](C(C)C)C2)ccc1N(C)C ZINC001167495437 1118853492 /nfs/dbraw/zinc/85/34/92/1118853492.db2.gz FHFAFEPJOZKRES-KRWDZBQOSA-N 1 0 292.492 3.634 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H]2CCc3cc(F)ccc32)cc1 ZINC000133385788 1118863328 /nfs/dbraw/zinc/86/33/28/1118863328.db2.gz VNGREMLWTFNFIK-SFHVURJKSA-N 1 0 284.378 3.669 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2CCc3cc(F)ccc32)cc1 ZINC000133385578 1118864396 /nfs/dbraw/zinc/86/43/96/1118864396.db2.gz VNGREMLWTFNFIK-GOSISDBHSA-N 1 0 284.378 3.669 20 10 CHCDRO CCCN(Cc1ccccc1OC)c1ccc(C[NH3+])cc1 ZINC000043457229 1119032696 /nfs/dbraw/zinc/03/26/96/1119032696.db2.gz UDNYBVVQTOMQLE-UHFFFAOYSA-N 1 0 284.403 3.571 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+][C@@H]1CCc2ccccc2C1 ZINC000051630680 1119059486 /nfs/dbraw/zinc/05/94/86/1119059486.db2.gz ZHKOWDWZKJTYIZ-MRXNPFEDSA-N 1 0 287.790 3.693 20 10 CHCDRO CCOc1cccc(C[NH2+]C2(C)CCCCC2)c1O ZINC000045042441 1119064892 /nfs/dbraw/zinc/06/48/92/1119064892.db2.gz JSSAYALDLLDIMV-UHFFFAOYSA-N 1 0 263.381 3.603 20 10 CHCDRO CC[C@@H](C)[C@H](C)[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC000152833202 1119128679 /nfs/dbraw/zinc/12/86/79/1119128679.db2.gz PTEWYPZWJWXFSY-CABCVRRESA-N 1 0 290.451 3.688 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]C1CCCCCCC1 ZINC000226582146 1119208155 /nfs/dbraw/zinc/20/81/55/1119208155.db2.gz YLHVSWVVFSHPAX-UHFFFAOYSA-N 1 0 251.345 3.734 20 10 CHCDRO C[C@@H]([NH2+]CC(C)(C)C(C)(F)F)c1ccccc1O ZINC000829237330 1119323118 /nfs/dbraw/zinc/32/31/18/1119323118.db2.gz UKAAWKBQMHDYCC-SNVBAGLBSA-N 1 0 257.324 3.724 20 10 CHCDRO C[C@H]([NH2+]CC1(C)CC1)c1ccc(Br)cc1O ZINC000309502781 1119387710 /nfs/dbraw/zinc/38/77/10/1119387710.db2.gz BGVMINVTHNCTEE-VIFPVBQESA-N 1 0 284.197 3.605 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCC[C@@H]1c1cccc(F)c1 ZINC000179557359 1119751884 /nfs/dbraw/zinc/75/18/84/1119751884.db2.gz CQJYBRKSIAWKCI-MRXNPFEDSA-N 1 0 271.335 3.868 20 10 CHCDRO COc1cc(C[N@H+]2CC=C(C)CC2)c(O)c(C(C)(C)C)c1 ZINC000755769332 1119765093 /nfs/dbraw/zinc/76/50/93/1119765093.db2.gz CQRSOOBGLKINJQ-UHFFFAOYSA-N 1 0 289.419 3.850 20 10 CHCDRO Cc1[nH]c2ccccc2c1CC[NH2+]Cc1cccc(C)c1O ZINC000181384303 1128877249 /nfs/dbraw/zinc/87/72/49/1128877249.db2.gz JMDKCFNZSPKDCW-UHFFFAOYSA-N 1 0 294.398 3.823 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccnn1C1CCC1 ZINC000924573921 1119909010 /nfs/dbraw/zinc/90/90/10/1119909010.db2.gz LHGDDTOYWBRXDV-CQSZACIVSA-N 1 0 298.434 3.525 20 10 CHCDRO COc1ccc(C[NH2+]CCCOc2ccc(C)cc2)cc1C ZINC000725850872 1119927197 /nfs/dbraw/zinc/92/71/97/1119927197.db2.gz GIJPLFOKLHKNLE-UHFFFAOYSA-N 1 0 299.414 3.871 20 10 CHCDRO Cc1cc(Br)cc([C@@H](C)[NH2+]C2CCC2)c1O ZINC000309466038 1120062888 /nfs/dbraw/zinc/06/28/88/1120062888.db2.gz PXDFRMIZDGLEKO-SECBINFHSA-N 1 0 284.197 3.666 20 10 CHCDRO COc1ccccc1[C@@H](C)[N@H+](C)Cc1ccc(C)cc1O ZINC001140950765 1120136148 /nfs/dbraw/zinc/13/61/48/1120136148.db2.gz HEDSEPRASBPAFY-CQSZACIVSA-N 1 0 285.387 3.902 20 10 CHCDRO CS[C@H]1CCC[C@H]([NH2+][C@@H](C)c2ccccc2O)C1 ZINC000183518668 1120136627 /nfs/dbraw/zinc/13/66/27/1120136627.db2.gz QKKXJWCLJCVODL-AVGNSLFASA-N 1 0 265.422 3.717 20 10 CHCDRO CCC(CC)[C@H](O)C[NH2+][C@@H](C)c1ccc(N(C)CC)cc1 ZINC000765921779 1120209879 /nfs/dbraw/zinc/20/98/79/1120209879.db2.gz LTMFHHFBPYMVLD-KBXCAEBGSA-N 1 0 292.467 3.590 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CC(C)(C)OC2(C)C)c(O)c1 ZINC000186499919 1120241472 /nfs/dbraw/zinc/24/14/72/1120241472.db2.gz VRFHLJFEDKDPGI-IUODEOHRSA-N 1 0 277.408 3.697 20 10 CHCDRO C[C@H]([NH2+][C@H]1CC(C)(C)OC1(C)C)c1cc(F)ccc1O ZINC000186500127 1120241496 /nfs/dbraw/zinc/24/14/96/1120241496.db2.gz OSBFLTMPTTVRQG-HZMBPMFUSA-N 1 0 281.371 3.528 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CC(C)(C)OC1(C)C)c1cc(F)ccc1O ZINC000186500099 1120241850 /nfs/dbraw/zinc/24/18/50/1120241850.db2.gz OSBFLTMPTTVRQG-IINYFYTJSA-N 1 0 281.371 3.528 20 10 CHCDRO C[C@@H]1C[C@@H]([NH2+]CCc2cccs2)c2c1c(F)ccc2O ZINC000756373133 1120276306 /nfs/dbraw/zinc/27/63/06/1120276306.db2.gz SZTRYKSZAYZRDK-ZWNOBZJWSA-N 1 0 291.391 3.973 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCN(C)c2ccccc2)c(O)c1C ZINC000756380255 1120283384 /nfs/dbraw/zinc/28/33/84/1120283384.db2.gz FTIUTVYYQPHGDP-MRXNPFEDSA-N 1 0 298.430 3.796 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCN(C)c2ccccc2)c(O)c1C ZINC000756380254 1120283819 /nfs/dbraw/zinc/28/38/19/1120283819.db2.gz FTIUTVYYQPHGDP-INIZCTEOSA-N 1 0 298.430 3.796 20 10 CHCDRO C[C@@H]([NH2+]Cc1cccc2c1OCC2)c1ccc(N(C)C)cc1 ZINC000922015852 1120336377 /nfs/dbraw/zinc/33/63/77/1120336377.db2.gz USSQSMNCVIRLQN-CQSZACIVSA-N 1 0 296.414 3.538 20 10 CHCDRO C[C@@H]([NH2+]CCN1CCCC[C@@H]1C)c1cc(Cl)ccc1O ZINC000756421475 1120336826 /nfs/dbraw/zinc/33/68/26/1120336826.db2.gz ZVXNUSXGWWQSNX-QWHCGFSZSA-N 1 0 296.842 3.571 20 10 CHCDRO Oc1ccccc1C[NH2+]Cc1cccc(C2CC2)c1 ZINC000228406671 1120341500 /nfs/dbraw/zinc/34/15/00/1120341500.db2.gz BNPCNGDUDSYWKB-UHFFFAOYSA-N 1 0 253.345 3.559 20 10 CHCDRO Cc1cc(Nc2cc(F)cc(F)c2O)c2ccccc2[nH+]1 ZINC001212477577 1120353764 /nfs/dbraw/zinc/35/37/64/1120353764.db2.gz INVZTNIEIXUNGZ-UHFFFAOYSA-N 1 0 286.281 3.693 20 10 CHCDRO C[C@@H](C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F)C1CC1 ZINC000756483699 1120372989 /nfs/dbraw/zinc/37/29/89/1120372989.db2.gz VJVUJXODGHUSDO-GBIKHYSHSA-N 1 0 263.356 3.715 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCOc3ccccc32)c1 ZINC000185404948 1120376629 /nfs/dbraw/zinc/37/66/29/1120376629.db2.gz ZJYSJKKJZUCFDN-LSDHHAIUSA-N 1 0 297.398 3.918 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+][C@@H](C)c2cncc(F)c2)c1O ZINC000781926377 1120566386 /nfs/dbraw/zinc/56/63/86/1120566386.db2.gz GNRBPYDWRVQFRS-JTQLQIEISA-N 1 0 294.757 3.739 20 10 CHCDRO CSC1(C[NH2+][C@H](C)c2cc(Cl)ccc2O)CCC1 ZINC000193805651 1120582307 /nfs/dbraw/zinc/58/23/07/1120582307.db2.gz KPGRHGMLGSQNIN-SNVBAGLBSA-N 1 0 285.840 3.982 20 10 CHCDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]C1CC=CC1 ZINC000759848700 1120584420 /nfs/dbraw/zinc/58/44/20/1120584420.db2.gz GBUVKFRTAIJJFU-UHFFFAOYSA-N 1 0 265.356 3.867 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CC2(SC)CC2)cc1 ZINC000193825999 1120584472 /nfs/dbraw/zinc/58/44/72/1120584472.db2.gz HIDBXBTVWXUTPY-ZDUSSCGKSA-N 1 0 278.465 3.689 20 10 CHCDRO Cc1cc(O)c(C[NH2+]Cc2ccc3c(c2)C[C@H](C)O3)cc1C ZINC000922702693 1120584734 /nfs/dbraw/zinc/58/47/34/1120584734.db2.gz OPQAMLBIVGEPCY-AWEZNQCLSA-N 1 0 297.398 3.622 20 10 CHCDRO C[C@@H]([NH2+]C1(Cc2ccccc2)CC1)c1ccccc1O ZINC000186578946 1120597734 /nfs/dbraw/zinc/59/77/34/1120597734.db2.gz FUKXONQOWUNXQM-CQSZACIVSA-N 1 0 267.372 3.818 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+][C@@H]1CCSC2(CCC2)C1 ZINC000922844994 1120612644 /nfs/dbraw/zinc/61/26/44/1120612644.db2.gz JJGNTBWNJGMJGM-LLVKDONJSA-N 1 0 297.851 3.954 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)c1ccsc1 ZINC000766030571 1120674115 /nfs/dbraw/zinc/67/41/15/1120674115.db2.gz UHFPCKVYQOHWRG-CYBMUJFWSA-N 1 0 274.433 3.973 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)CCc1ccco1 ZINC000766030030 1120674609 /nfs/dbraw/zinc/67/46/09/1120674609.db2.gz SRZKOUNOHVBZDZ-HNNXBMFYSA-N 1 0 286.419 3.765 20 10 CHCDRO CS[C@@H]1CC[C@H]([N@H+](C)Cc2ccc(N(C)C)c(C)c2)C1 ZINC001117704620 1120677089 /nfs/dbraw/zinc/67/70/89/1120677089.db2.gz ICNAVIMRTDDWOK-JKSUJKDBSA-N 1 0 292.492 3.777 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H]2CC[C@@H](C)C[C@@H]2C)c1O ZINC000070112023 1128941505 /nfs/dbraw/zinc/94/15/05/1128941505.db2.gz RTBMEUHKRNULLY-VNHYZAJKSA-N 1 0 277.408 3.705 20 10 CHCDRO C[C@@H](C[NH2+][C@@H](C)c1ccc2ccccc2c1O)C[C@H](C)O ZINC000185521492 1120911565 /nfs/dbraw/zinc/91/15/65/1120911565.db2.gz JRLBCKCZCXNKHY-RDBSUJKOSA-N 1 0 287.403 3.603 20 10 CHCDRO c1cc(C[NH2+]Cc2ccc(C3CC3)cc2)cc2c1OCC2 ZINC000191683891 1128951241 /nfs/dbraw/zinc/95/12/41/1128951241.db2.gz UVTBDNHHPDQDJO-UHFFFAOYSA-N 1 0 279.383 3.789 20 10 CHCDRO CCOC1CC[NH+](Cc2ccc(C(C)C)cc2O)CC1 ZINC001237052498 1128952199 /nfs/dbraw/zinc/95/21/99/1128952199.db2.gz BABSGWUUBUJDHI-UHFFFAOYSA-N 1 0 277.408 3.517 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCCC2(C)C)c1 ZINC000094321598 1121000011 /nfs/dbraw/zinc/00/00/11/1121000011.db2.gz BBHUUZUMGPHOJU-ABAIWWIYSA-N 1 0 263.381 3.630 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccsc1 ZINC000178188144 1121006863 /nfs/dbraw/zinc/00/68/63/1121006863.db2.gz GRAJQDNTKZTBMP-LLVKDONJSA-N 1 0 278.396 3.804 20 10 CHCDRO Clc1ccc(C[NH2+]Cc2ccc3c(c2)CCO3)s1 ZINC000070213192 1128957564 /nfs/dbraw/zinc/95/75/64/1128957564.db2.gz JMRLJEQPEPHQPY-UHFFFAOYSA-N 1 0 279.792 3.626 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H](O)CC(C)(C)C)cc1 ZINC000766060541 1121069134 /nfs/dbraw/zinc/06/91/34/1121069134.db2.gz LZNQLYKKQCUCST-YOEHRIQHSA-N 1 0 292.467 3.590 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H]2C[C@@H](c3ccccc3)[C@@H]2C)c1 ZINC000763518639 1128960755 /nfs/dbraw/zinc/96/07/55/1128960755.db2.gz NJDLVYMZRLOXCN-BMGDILEWSA-N 1 0 281.399 3.982 20 10 CHCDRO CCOCc1cc(C[NH2+][C@H]2CCC(F)(F)C2)ccc1OC ZINC000763520790 1128961048 /nfs/dbraw/zinc/96/10/48/1128961048.db2.gz IQLWOQRFAWRXBD-AWEZNQCLSA-N 1 0 299.361 3.509 20 10 CHCDRO C[C@@H]([NH2+]CCCOc1ccccc1)c1cc(F)ccc1O ZINC000094618084 1121086187 /nfs/dbraw/zinc/08/61/87/1121086187.db2.gz KDYLNKHXFYLXKK-CYBMUJFWSA-N 1 0 289.350 3.651 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H](C)CC(F)F)c1 ZINC000700156044 1121086646 /nfs/dbraw/zinc/08/66/46/1121086646.db2.gz QJLZGPAMKTWBCL-GHMZBOCLSA-N 1 0 257.324 3.643 20 10 CHCDRO COCc1cccc(C[NH2+][C@@H](C)c2cc(C)ccc2O)c1 ZINC000038010680 1121093976 /nfs/dbraw/zinc/09/39/76/1121093976.db2.gz DBFAQZPJKYMMHJ-AWEZNQCLSA-N 1 0 285.387 3.698 20 10 CHCDRO CCc1cnccc1[C@@H](C)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000773427289 1121099715 /nfs/dbraw/zinc/09/97/15/1121099715.db2.gz JSEQGDBVGPXDJD-CQSZACIVSA-N 1 0 283.419 3.561 20 10 CHCDRO CC1(CC[NH2+]Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000700506623 1121102348 /nfs/dbraw/zinc/10/23/48/1121102348.db2.gz AHIHRFAYDRFMKA-UHFFFAOYSA-N 1 0 272.436 3.957 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1C=CCC1)c1cc(Br)ccc1O ZINC000700586054 1121107522 /nfs/dbraw/zinc/10/75/22/1121107522.db2.gz GJOPMPBYFYVUBR-YPMHNXCESA-N 1 0 296.208 3.914 20 10 CHCDRO CCC[N@H+](Cc1c(O)ccc2ccc(OC)cc21)C1CC1 ZINC000728903986 1121182224 /nfs/dbraw/zinc/18/22/24/1121182224.db2.gz DTTBJWGQXMUTCM-UHFFFAOYSA-N 1 0 285.387 3.928 20 10 CHCDRO CCC[N@H+](Cc1ccc(C#N)c(F)c1)Cc1ccccc1O ZINC000192049455 1128968148 /nfs/dbraw/zinc/96/81/48/1128968148.db2.gz PPBBCHUHZXTUBX-UHFFFAOYSA-N 1 0 298.361 3.815 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCC2(F)CCC2)c1 ZINC000702431226 1121199411 /nfs/dbraw/zinc/19/94/11/1121199411.db2.gz DWTWUTMDQDCUEH-LBPRGKRZSA-N 1 0 251.345 3.634 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc3c(c2)CCC3)c1 ZINC000182448550 1128970161 /nfs/dbraw/zinc/97/01/61/1128970161.db2.gz CAYHOBGGNZBQCF-CYBMUJFWSA-N 1 0 297.398 3.740 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(N(C)C)cc1 ZINC000124045263 1121284469 /nfs/dbraw/zinc/28/44/69/1121284469.db2.gz GKGHBGXAXSAGTA-OAHLLOKOSA-N 1 0 297.446 3.669 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]C[C@@H]2CCCC23CC3)c1O ZINC000706271202 1121424440 /nfs/dbraw/zinc/42/44/40/1121424440.db2.gz PRIQOVBUOXFCJD-LBPRGKRZSA-N 1 0 295.810 3.724 20 10 CHCDRO CC(=O)c1cc(Cl)cc(C[NH+]2[C@@H](C)CC[C@@H]2C)c1O ZINC000706475361 1121430242 /nfs/dbraw/zinc/43/02/42/1121430242.db2.gz HHDJBBQZQLSHFI-UWVGGRQHSA-N 1 0 281.783 3.621 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H]2CC[C@H]2SC)cc1 ZINC000706504239 1121431811 /nfs/dbraw/zinc/43/18/11/1121431811.db2.gz GSXUUHAABIQGKK-JKSUJKDBSA-N 1 0 278.465 3.516 20 10 CHCDRO C[C@@H]1CC[C@H](C)[N@H+]1Cc1cc(Br)ccc1O ZINC000706497663 1121431983 /nfs/dbraw/zinc/43/19/83/1121431983.db2.gz DPZQPZLIWWJVKR-AOOOYVTPSA-N 1 0 284.197 3.528 20 10 CHCDRO COc1cccc(C[NH2+][C@@H]2C[C@@H](C)CC(C)(C)C2)c1O ZINC000708233274 1121464506 /nfs/dbraw/zinc/46/45/06/1121464506.db2.gz KNFSFYIUZZQPST-TZMCWYRMSA-N 1 0 277.408 3.705 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCC2(CCCC2)O1)c1ccccc1O ZINC000709496883 1121470451 /nfs/dbraw/zinc/47/04/51/1121470451.db2.gz BOWIYYZXVZHCMW-ZIAGYGMSSA-N 1 0 275.392 3.535 20 10 CHCDRO CCc1cccc(C[NH2+][C@H](C)Cc2cccs2)c1O ZINC000709444812 1121471082 /nfs/dbraw/zinc/47/10/82/1121471082.db2.gz KAONWPCBYZFOPF-GFCCVEGCSA-N 1 0 275.417 3.737 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)CC2CCC2)c1 ZINC000710247505 1121474586 /nfs/dbraw/zinc/47/45/86/1121474586.db2.gz WBVXKIQNRDZUNF-NWDGAFQWSA-N 1 0 263.381 3.630 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCCSC2)cc1F ZINC000236933153 1121490182 /nfs/dbraw/zinc/49/01/82/1121490182.db2.gz IQRNJIKQKLPXTK-CQSZACIVSA-N 1 0 296.455 3.657 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCC2(CCC2)O1)c1ccccc1O ZINC000711458533 1121537022 /nfs/dbraw/zinc/53/70/22/1121537022.db2.gz XNCNFHDMQAIDLC-HIFRSBDPSA-N 1 0 275.392 3.535 20 10 CHCDRO Cc1cc(Nc2ccc(Cl)c(Cl)c2O)cc(C)[nH+]1 ZINC001176056894 1121543645 /nfs/dbraw/zinc/54/36/45/1121543645.db2.gz HDYYQPIVYSWSTA-UHFFFAOYSA-N 1 0 283.158 3.876 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)C[C@@H](O)c1ccco1)c1ccccc1O ZINC000248546100 1121573161 /nfs/dbraw/zinc/57/31/61/1121573161.db2.gz FNIPOUOUUCNGSN-DUVNUKRYSA-N 1 0 289.375 3.538 20 10 CHCDRO COc1ccc(C[NH2+]Cc2cccc(C)c2)cc1C ZINC000035230280 1121579929 /nfs/dbraw/zinc/57/99/29/1121579929.db2.gz LHQQLJYJPCQOEP-UHFFFAOYSA-N 1 0 255.361 3.602 20 10 CHCDRO C[C@H]1C[C@H]([NH2+]Cc2cc(Cl)ccc2O)C[C@@H](C)C1 ZINC000252139175 1121648444 /nfs/dbraw/zinc/64/84/44/1121648444.db2.gz MXSNKLTUFNPRAN-YABSGUDNSA-N 1 0 267.800 3.960 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](C)CSC)cc1 ZINC000150985139 1121666997 /nfs/dbraw/zinc/66/69/97/1121666997.db2.gz QIVSUSRABDSWPB-QWHCGFSZSA-N 1 0 266.454 3.545 20 10 CHCDRO Cc1cc(O)c(CNCC[NH+](C(C)C)C(C)C)c(Cl)c1 ZINC001177060728 1121709633 /nfs/dbraw/zinc/70/96/33/1121709633.db2.gz ARVQMBIVWQFGOF-UHFFFAOYSA-N 1 0 298.858 3.562 20 10 CHCDRO COc1cc(C)cc(C[NH2+][C@H](C)c2ccc(C)cc2)c1O ZINC000894192402 1121729074 /nfs/dbraw/zinc/72/90/74/1121729074.db2.gz BVYLUYIHIMVJNN-CQSZACIVSA-N 1 0 285.387 3.868 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCC2SCCS2)c(O)c1 ZINC000693775495 1121737730 /nfs/dbraw/zinc/73/77/30/1121737730.db2.gz DYTRISRYOLNZJQ-NSHDSACASA-N 1 0 283.462 3.547 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CC[C@@H](c3ccco3)C2)cc1 ZINC000773757264 1121799700 /nfs/dbraw/zinc/79/97/00/1121799700.db2.gz NVTMZDUTBSWYFA-MRXNPFEDSA-N 1 0 284.403 3.725 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C2CC(c3ccc(F)cc3)C2)cc1 ZINC000237122277 1121815804 /nfs/dbraw/zinc/81/58/04/1121815804.db2.gz YLNYHHYLHAHXFO-UHFFFAOYSA-N 1 0 298.405 3.928 20 10 CHCDRO CC/C=C\C[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC001178800441 1121816954 /nfs/dbraw/zinc/81/69/54/1121816954.db2.gz BYFPLVPFYOFTEN-WAYWQWQTSA-N 1 0 286.341 3.827 20 10 CHCDRO CCN(C)c1ccc(C[N@H+](CC)CCc2ccccn2)cc1 ZINC000773775321 1121819997 /nfs/dbraw/zinc/81/99/97/1121819997.db2.gz HERLWPYTOHYFKY-UHFFFAOYSA-N 1 0 297.446 3.602 20 10 CHCDRO CCN(C)c1ccc(C[N@H+](C)[C@H](C)CCSC)cc1 ZINC000773772911 1121823097 /nfs/dbraw/zinc/82/30/97/1121823097.db2.gz MCCFPWGVTQZWNJ-CQSZACIVSA-N 1 0 280.481 3.716 20 10 CHCDRO C[C@H]1CCCC[C@@]1(C)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC001178868739 1121825644 /nfs/dbraw/zinc/82/56/44/1121825644.db2.gz UZPDSNZBLPFBFV-SUMWQHHRSA-N 1 0 278.415 3.950 20 10 CHCDRO C[C@H]1CCCC[C@]1(C)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC001178868738 1121825789 /nfs/dbraw/zinc/82/57/89/1121825789.db2.gz UZPDSNZBLPFBFV-GUYCJALGSA-N 1 0 278.415 3.950 20 10 CHCDRO C[C@@H]1CCCC[C@]1(C)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC001178868736 1121825919 /nfs/dbraw/zinc/82/59/19/1121825919.db2.gz UZPDSNZBLPFBFV-DYVFJYSZSA-N 1 0 278.415 3.950 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C[C@@H]2C[C@@H]2c2ccccc2)cc1 ZINC000237125004 1121828188 /nfs/dbraw/zinc/82/81/88/1121828188.db2.gz JBQYKFMSQGDDFA-PKOBYXMFSA-N 1 0 280.415 3.646 20 10 CHCDRO C[C@H]1C[N@H+](Cc2ccc(N(C)C)c3ccccc23)CCCO1 ZINC001204232645 1121828988 /nfs/dbraw/zinc/82/89/88/1121828988.db2.gz HKCFTSQUYGPYHZ-HNNXBMFYSA-N 1 0 298.430 3.517 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C(C)(C2CC2)C2CC2)cc1F ZINC001179204728 1121858564 /nfs/dbraw/zinc/85/85/64/1121858564.db2.gz DWPYSSYWTJWCCR-UHFFFAOYSA-N 1 0 276.399 3.560 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2ccc(N(C)C)c3ccccc23)[C@H](C)CO1 ZINC001204240068 1121861109 /nfs/dbraw/zinc/86/11/09/1121861109.db2.gz HEPXDGXAIDIVHG-HUUCEWRRSA-N 1 0 298.430 3.515 20 10 CHCDRO CCC[C@@H](C)CC[NH2+]Cc1c(O)cccc1Cl ZINC001179468949 1121880859 /nfs/dbraw/zinc/88/08/59/1121880859.db2.gz VCPBBFHLMRNJLX-LLVKDONJSA-N 1 0 255.789 3.962 20 10 CHCDRO C[C@@H]1C[C@@H]1[C@@H]1C[C@@H]1C[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001179592861 1121892655 /nfs/dbraw/zinc/89/26/55/1121892655.db2.gz JIJWHYPOCZDEFH-SKWUIDRYSA-N 1 0 284.447 3.669 20 10 CHCDRO CC(C)[N@H+](Cc1cc(F)c(N(C)C)cc1F)C1CCC1 ZINC001179898624 1121919231 /nfs/dbraw/zinc/91/92/31/1121919231.db2.gz QSBZOMPFQPKVBM-UHFFFAOYSA-N 1 0 282.378 3.794 20 10 CHCDRO C[C@H]1CCC[N@H+](C/C=C\c2ccc(N(C)C)cc2)CC1 ZINC001180030807 1121938774 /nfs/dbraw/zinc/93/87/74/1121938774.db2.gz PXPDJNDDNWTKFV-WRLNGNIRSA-N 1 0 272.436 3.888 20 10 CHCDRO CC(C)CC[C@@H]1CCC[N@@H+]1Cc1cc(F)ccc1O ZINC001180136553 1121950680 /nfs/dbraw/zinc/95/06/80/1121950680.db2.gz GHUAVVXZXPFPBK-HNNXBMFYSA-N 1 0 265.372 3.932 20 10 CHCDRO COc1cc(C)c(C[N@H+](C)Cc2ccc(C)s2)c(O)c1 ZINC001180212511 1121961712 /nfs/dbraw/zinc/96/17/12/1121961712.db2.gz BXAPAMPXNJBVMW-UHFFFAOYSA-N 1 0 291.416 3.711 20 10 CHCDRO CCN(C)c1ccc(C[NH2+][C@@H](C)c2cncc(F)c2)cc1 ZINC000773843071 1121965057 /nfs/dbraw/zinc/96/50/57/1121965057.db2.gz ZJVYLZDNCDZQPS-ZDUSSCGKSA-N 1 0 287.382 3.528 20 10 CHCDRO C[C@@H](CC1CCC1)[NH2+]Cc1ccc(Br)cc1O ZINC000710274616 1121969134 /nfs/dbraw/zinc/96/91/34/1121969134.db2.gz DPZDDFWHLRCVDK-JTQLQIEISA-N 1 0 298.224 3.823 20 10 CHCDRO CN(C)c1ccc(C[NH2+]CC2(c3ccccc3)CC2)cc1F ZINC000733323978 1121975715 /nfs/dbraw/zinc/97/57/15/1121975715.db2.gz BMVKQLBHLTWJEG-UHFFFAOYSA-N 1 0 298.405 3.713 20 10 CHCDRO CC(C)CC[C@H](C)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000733323407 1121975839 /nfs/dbraw/zinc/97/58/39/1121975839.db2.gz ZHONHRIYPGIRCB-ZDUSSCGKSA-N 1 0 266.404 3.806 20 10 CHCDRO C[C@@H]1CCCC[C@H]1OCC[NH2+]Cc1c(O)cccc1Cl ZINC000733324784 1121976319 /nfs/dbraw/zinc/97/63/19/1121976319.db2.gz CGHKRUMFHXLDFJ-MLGOLLRUSA-N 1 0 297.826 3.731 20 10 CHCDRO C[C@@H]1CCCC[C@@H]1OCC[NH2+]Cc1c(O)cccc1Cl ZINC000733324785 1121976422 /nfs/dbraw/zinc/97/64/22/1121976422.db2.gz CGHKRUMFHXLDFJ-WBMJQRKESA-N 1 0 297.826 3.731 20 10 CHCDRO CSc1ccc(C[NH2+]Cc2cc(C)ccc2O)cc1 ZINC000733325449 1121976714 /nfs/dbraw/zinc/97/67/14/1121976714.db2.gz MTECAFYVDDTYFM-UHFFFAOYSA-N 1 0 273.401 3.712 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2CC[C@H]2C(C)C)cc1Cl ZINC001180326202 1121981629 /nfs/dbraw/zinc/98/16/29/1121981629.db2.gz ITISWLKGNZYMGV-ZDUSSCGKSA-N 1 0 253.773 3.584 20 10 CHCDRO CCC[NH+](CCC)Cc1cc(F)c(N(C)C)cc1F ZINC001180375477 1121983373 /nfs/dbraw/zinc/98/33/73/1121983373.db2.gz RGFQBXRVCWHPDK-UHFFFAOYSA-N 1 0 270.367 3.653 20 10 CHCDRO Cc1cccc(C[NH2+]C(C2CCC2)C2CCC2)c1O ZINC000324929657 1129024890 /nfs/dbraw/zinc/02/48/90/1129024890.db2.gz NGIHXWSWRDGMMP-UHFFFAOYSA-N 1 0 259.393 3.759 20 10 CHCDRO COc1cc(O)c(C[NH2+]CC(C)(C)C(C)(C)C)cc1OC ZINC000816618672 1122033334 /nfs/dbraw/zinc/03/33/34/1122033334.db2.gz DVEUYKAPYGTMKR-UHFFFAOYSA-N 1 0 295.423 3.571 20 10 CHCDRO CC[C@H]1[C@H](C)CC[N@@H+]1Cc1ccc(Cl)cc1O ZINC001181102184 1122033568 /nfs/dbraw/zinc/03/35/68/1122033568.db2.gz JNAVLPFLUDFZJQ-MFKMUULPSA-N 1 0 253.773 3.666 20 10 CHCDRO COc1ccc(O)c(C[NH+]2CCC(C)(C(C)C)CC2)c1 ZINC001181084197 1122035518 /nfs/dbraw/zinc/03/55/18/1122035518.db2.gz AERXZXFTFSYNQV-UHFFFAOYSA-N 1 0 277.408 3.659 20 10 CHCDRO CC[C@@H]1CC[C@H](C)[N@@H+]1Cc1ccc(Cl)cc1O ZINC001181543951 1122061550 /nfs/dbraw/zinc/06/15/50/1122061550.db2.gz IYRNOBWGQURMGT-GXFFZTMASA-N 1 0 253.773 3.809 20 10 CHCDRO CCc1cccnc1[C@@H](C)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000780706011 1122144466 /nfs/dbraw/zinc/14/44/66/1122144466.db2.gz JYQBBLAUBCMACY-CQSZACIVSA-N 1 0 283.419 3.561 20 10 CHCDRO CC(C)C[C@H]1C[C@@H]([NH2+]Cc2c(O)cccc2Cl)CCO1 ZINC000272034714 1122188408 /nfs/dbraw/zinc/18/84/08/1122188408.db2.gz UYMQQNSWSKWSCK-STQMWFEESA-N 1 0 297.826 3.729 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCOC2(CCCCC2)C1)c1ccccc1O ZINC000272815051 1122213737 /nfs/dbraw/zinc/21/37/37/1122213737.db2.gz DWQNSLDNMFTGDS-GJZGRUSLSA-N 1 0 289.419 3.925 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCOC2(CCCCC2)C1)c1ccccc1O ZINC000272815046 1122214327 /nfs/dbraw/zinc/21/43/27/1122214327.db2.gz DWQNSLDNMFTGDS-CABCVRRESA-N 1 0 289.419 3.925 20 10 CHCDRO COc1ccc(O)c(C[NH2+]CCCc2ccc(C)cc2C)c1 ZINC001183312319 1122217154 /nfs/dbraw/zinc/21/71/54/1122217154.db2.gz HYGGCEHEJHDKKF-UHFFFAOYSA-N 1 0 299.414 3.740 20 10 CHCDRO Oc1cccc2c1C[N@H+](CCCc1ccc(F)c(F)c1)C2 ZINC001183454960 1122223508 /nfs/dbraw/zinc/22/35/08/1122223508.db2.gz PTYSHUHXNIHINZ-UHFFFAOYSA-N 1 0 289.325 3.619 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCc2ccccc2O)c(O)c1C ZINC000273361090 1122229860 /nfs/dbraw/zinc/22/98/60/1122229860.db2.gz AKUBIIUIMCBRHS-AWEZNQCLSA-N 1 0 285.387 3.608 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CC[C@@H]2CCO[C@@H](C)C2)c1 ZINC000273410693 1122231542 /nfs/dbraw/zinc/23/15/42/1122231542.db2.gz HRYBFYOSQJAXSE-SOUVJXGZSA-N 1 0 277.408 3.556 20 10 CHCDRO Cc1nc(CC[NH2+][C@@H](C)c2cc(Cl)ccc2O)cs1 ZINC000273427483 1122232409 /nfs/dbraw/zinc/23/24/09/1122232409.db2.gz UPIJIFBKJUGLAI-VIFPVBQESA-N 1 0 296.823 3.704 20 10 CHCDRO COc1cc(C)c(C[N@H+]2Cc3ccccc3[C@H](C)C2)c(O)c1 ZINC001183673124 1122233847 /nfs/dbraw/zinc/23/38/47/1122233847.db2.gz PCFCUARBBAASPJ-CQSZACIVSA-N 1 0 297.398 3.829 20 10 CHCDRO Cc1cccc([C@@H](O)C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)c1 ZINC000273455199 1122234141 /nfs/dbraw/zinc/23/41/41/1122234141.db2.gz GXCKKTZAUJJIIO-YJBOKZPZSA-N 1 0 299.414 3.702 20 10 CHCDRO Cc1cccc([C@@H](O)C[NH2+][C@H](C)c2ccc(C)c(C)c2O)c1 ZINC000273455198 1122234334 /nfs/dbraw/zinc/23/43/34/1122234334.db2.gz GXCKKTZAUJJIIO-QAPCUYQASA-N 1 0 299.414 3.702 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCO[C@H](C(C)(C)C)C2)c(O)c1 ZINC000273503399 1122236892 /nfs/dbraw/zinc/23/68/92/1122236892.db2.gz QMXILWBGWYPVMH-ZQIUZPCESA-N 1 0 291.435 3.945 20 10 CHCDRO [O-]c1cccc(F)c1C[NH2+]Cc1ccc2ccccc2c1O ZINC001183918933 1122248638 /nfs/dbraw/zinc/24/86/38/1122248638.db2.gz CXPPQYAJMTWDRM-UHFFFAOYSA-N 1 0 297.329 3.680 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccc2c(c1)CCO2)c1ccccc1O ZINC000183331917 1129046039 /nfs/dbraw/zinc/04/60/39/1129046039.db2.gz YDCKJZTXYYOSCJ-QGZVFWFLSA-N 1 0 297.398 3.611 20 10 CHCDRO Cc1cc(O)c(C[NH2+]Cc2ccc3ncccc3c2)cc1C ZINC000192982090 1129048980 /nfs/dbraw/zinc/04/89/80/1129048980.db2.gz QHUIHDNQASHAEC-UHFFFAOYSA-N 1 0 292.382 3.847 20 10 CHCDRO C[C@@H]([NH2+]CCc1cccc(Cl)c1)c1ccccc1O ZINC000183383229 1129049520 /nfs/dbraw/zinc/04/95/20/1129049520.db2.gz XJEYXFVJASFHLL-GFCCVEGCSA-N 1 0 275.779 3.939 20 10 CHCDRO CC(C)(C)[C@@H](CO)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000775059909 1122414266 /nfs/dbraw/zinc/41/42/66/1122414266.db2.gz YZPHNCHDLGFMDU-GOSISDBHSA-N 1 0 299.414 3.556 20 10 CHCDRO Cc1cc(C[NH2+][C@@H](C)c2cccc(O)c2)ccc1N(C)C ZINC000282325379 1122425595 /nfs/dbraw/zinc/42/55/95/1122425595.db2.gz NUCMZPKTGIXDAV-AWEZNQCLSA-N 1 0 284.403 3.617 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2ccccc2n1)c1ccccc1O ZINC000775137694 1122437112 /nfs/dbraw/zinc/43/71/12/1122437112.db2.gz XLLCDDMCLQOKDX-CYBMUJFWSA-N 1 0 278.355 3.791 20 10 CHCDRO COc1ccc(C[NH2+][C@H]2CCCO[C@H]2CC(C)C)cc1C ZINC000775367614 1122530090 /nfs/dbraw/zinc/53/00/90/1122530090.db2.gz ALYMGDVCLPANHC-WMZOPIPTSA-N 1 0 291.435 3.687 20 10 CHCDRO C[C@H](C[NH2+][C@H](C)c1ccccc1O)Oc1cccc(F)c1 ZINC000183534265 1129060974 /nfs/dbraw/zinc/06/09/74/1129060974.db2.gz LWTQICHZPWXJGK-CHWSQXEVSA-N 1 0 289.350 3.649 20 10 CHCDRO CN(C)c1ccc(C[N@H+](CCC2CCC2)C2CC2)cc1 ZINC001190445370 1122535923 /nfs/dbraw/zinc/53/59/23/1122535923.db2.gz GTFVEDINJMRUGA-UHFFFAOYSA-N 1 0 272.436 3.907 20 10 CHCDRO CCOc1ccc([C@H](C)[NH2+]Cc2cc(C)ccc2O)cc1 ZINC000071407767 1129062291 /nfs/dbraw/zinc/06/22/91/1129062291.db2.gz OMWVJKZIHWEACJ-AWEZNQCLSA-N 1 0 285.387 3.950 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H](C)Cc2ccc(F)cc2)c1 ZINC000071409355 1129063278 /nfs/dbraw/zinc/06/32/78/1129063278.db2.gz MFGBVQXBTLGRDX-ZDUSSCGKSA-N 1 0 273.351 3.561 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](C)N1CCC[C@H](C)C1)c1ccccc1O ZINC000775486519 1122616218 /nfs/dbraw/zinc/61/62/18/1122616218.db2.gz COAMLESNKKFORQ-ZOBUZTSGSA-N 1 0 290.451 3.553 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccoc1)c1cc(Cl)ccc1O ZINC000775490234 1122619659 /nfs/dbraw/zinc/61/96/59/1122619659.db2.gz ALVNLJYJRUGJQF-CYBMUJFWSA-N 1 0 265.740 3.880 20 10 CHCDRO CC[C@@H](C)N(C)CC[NH2+][C@H](CC)c1cc(Cl)ccc1O ZINC000775501929 1122628578 /nfs/dbraw/zinc/62/85/78/1122628578.db2.gz URDPIWVHSUYVPP-IUODEOHRSA-N 1 0 298.858 3.817 20 10 CHCDRO CC[C@H]([NH2+]CCN1[C@H](C)CCC[C@H]1C)c1ccccc1O ZINC000775502970 1122631646 /nfs/dbraw/zinc/63/16/46/1122631646.db2.gz ZHCZGPFXDOFQKM-INMHGKMJSA-N 1 0 290.451 3.696 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccc(C)c(OC)c1)c1ccccc1O ZINC000775509209 1122632033 /nfs/dbraw/zinc/63/20/33/1122632033.db2.gz JDBCUARVYQZOFW-KRWDZBQOSA-N 1 0 299.414 3.993 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCCSC1)c1cc(Cl)ccc1O ZINC000775510939 1122633786 /nfs/dbraw/zinc/63/37/86/1122633786.db2.gz BGPYOPZJOOKZIB-AAEUAGOBSA-N 1 0 285.840 3.982 20 10 CHCDRO CC[C@@H]([NH2+]C1CC=CC1)c1cc(Cl)ccc1O ZINC000775513762 1122634949 /nfs/dbraw/zinc/63/49/49/1122634949.db2.gz MAQQUUOHIJEEGK-CYBMUJFWSA-N 1 0 251.757 3.805 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1cnccc1C)c1ccccc1O ZINC000775519607 1122638577 /nfs/dbraw/zinc/63/85/77/1122638577.db2.gz MSLSCFBDWBCPQP-CJNGLKHVSA-N 1 0 270.376 3.898 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCO[C@@H](C)C1)c1cc(Cl)ccc1O ZINC000775520203 1122638943 /nfs/dbraw/zinc/63/89/43/1122638943.db2.gz QPTMGIICLCGWGA-ZOWXZIJZSA-N 1 0 297.826 3.901 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@H](C)CCCC(F)(F)F)c1 ZINC000775523302 1122639668 /nfs/dbraw/zinc/63/96/68/1122639668.db2.gz HYRJAZJSYAIMAM-SNVBAGLBSA-N 1 0 291.313 3.612 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1cn[nH]c1)c1cc(Cl)ccc1O ZINC000775522931 1122639755 /nfs/dbraw/zinc/63/97/55/1122639755.db2.gz BYHGELQOQKIYFD-NOZJJQNGSA-N 1 0 279.771 3.571 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCC[C@H]1OC)c1cc(Cl)ccc1O ZINC000775532433 1122649643 /nfs/dbraw/zinc/64/96/43/1122649643.db2.gz UNORKLWZGXVEEG-DIOULYMOSA-N 1 0 297.826 3.901 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCC[C@@H]1OC)c1cc(Cl)ccc1O ZINC000775532435 1122650183 /nfs/dbraw/zinc/65/01/83/1122650183.db2.gz UNORKLWZGXVEEG-PJODQICGSA-N 1 0 297.826 3.901 20 10 CHCDRO CC(C)OCCCC[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000228563805 1122654830 /nfs/dbraw/zinc/65/48/30/1122654830.db2.gz PSZPNBBFPVXXMO-UHFFFAOYSA-N 1 0 290.451 3.582 20 10 CHCDRO Cc1cc(C[NH2+][C@@H]2CCC[C@@H](C)[C@@H]2C)ccc1N(C)C ZINC001193593152 1122699348 /nfs/dbraw/zinc/69/93/48/1122699348.db2.gz JGXREJXDLAEKFC-UKPHBRMFSA-N 1 0 274.452 3.975 20 10 CHCDRO COCC1(CC[NH2+][C@@H](C)c2cc(C)ccc2O)CCC1 ZINC000293773855 1122717929 /nfs/dbraw/zinc/71/79/29/1122717929.db2.gz SJLXDJGEARBEQU-AWEZNQCLSA-N 1 0 277.408 3.558 20 10 CHCDRO COCC1(CC[NH2+][C@@H](C)c2ccc(N(C)C)cc2)CCC1 ZINC000293778921 1122718494 /nfs/dbraw/zinc/71/84/94/1122718494.db2.gz STEKDXOSPBCFCC-HNNXBMFYSA-N 1 0 290.451 3.610 20 10 CHCDRO Cc1cc(C[NH2+]C[C@H]2C[C@H]2C)c(C)n1-c1ccccc1 ZINC000159037817 1122769608 /nfs/dbraw/zinc/76/96/08/1122769608.db2.gz FXBRBULNQFAPKB-CZUORRHYSA-N 1 0 268.404 3.840 20 10 CHCDRO C[C@H](Nc1ccc(N2CCCCC2)cn1)c1ccccc1O ZINC000183650893 1129076736 /nfs/dbraw/zinc/07/67/36/1129076736.db2.gz APCKVPXFEZVTMK-AWEZNQCLSA-N 1 0 297.402 3.951 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CCCC[C@H](SC)C2)c1 ZINC000092064249 1122839369 /nfs/dbraw/zinc/83/93/69/1122839369.db2.gz XZPMMFMWNAFUPM-HNNXBMFYSA-N 1 0 295.448 3.508 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+]2CCCC[C@H]2C)c1O ZINC000775639254 1122844072 /nfs/dbraw/zinc/84/40/72/1122844072.db2.gz RIQKRZJLUZXCID-LLVKDONJSA-N 1 0 253.773 3.728 20 10 CHCDRO Cc1cccc(C[N@H+](C)Cc2ccccc2C)c1O ZINC000775641521 1122851248 /nfs/dbraw/zinc/85/12/48/1122851248.db2.gz BYFIJVZAKAAZOW-UHFFFAOYSA-N 1 0 255.361 3.641 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCc3sccc3[C@@H]2C)c1O ZINC000775646015 1122856744 /nfs/dbraw/zinc/85/67/44/1122856744.db2.gz FEAHBRNYLAOVHG-LBPRGKRZSA-N 1 0 273.401 3.881 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCC2CC(F)(F)C2)c1 ZINC000834907868 1122857915 /nfs/dbraw/zinc/85/79/15/1122857915.db2.gz DZKXEKNVUQATRY-LLVKDONJSA-N 1 0 269.335 3.787 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCC[C@@H]2c2ccc(O)cc2)c1O ZINC000775661064 1122876170 /nfs/dbraw/zinc/87/61/70/1122876170.db2.gz ICPOPECHKCBYEK-QGZVFWFLSA-N 1 0 283.371 3.743 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+](CCCO)CC(C)(C)C)c1O ZINC000775681786 1122902045 /nfs/dbraw/zinc/90/20/45/1122902045.db2.gz SPKZOUBQONMAAI-UHFFFAOYSA-N 1 0 299.842 3.585 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H](C3CC3)C2)c1O ZINC000775726351 1122926675 /nfs/dbraw/zinc/92/66/75/1122926675.db2.gz QVXBVPBCXDHBJT-GFCCVEGCSA-N 1 0 265.784 3.586 20 10 CHCDRO Cc1cc(Cl)cc(C[NH+]2[C@@H](C)CC[C@@H]2C)c1O ZINC000775737470 1122928988 /nfs/dbraw/zinc/92/89/88/1122928988.db2.gz HVRAGKHXKSBLLE-QWRGUYRKSA-N 1 0 253.773 3.727 20 10 CHCDRO Oc1ccc(C[N@@H+]2CCC[C@@H]2C2CCCCC2)cc1O ZINC001203880460 1122959986 /nfs/dbraw/zinc/95/99/86/1122959986.db2.gz SKTBQIZBGDXMPE-OAHLLOKOSA-N 1 0 275.392 3.643 20 10 CHCDRO COc1cc(C)cc(C[NH+](C2CCC2)C2CCC2)c1O ZINC000894850977 1122967983 /nfs/dbraw/zinc/96/79/83/1122967983.db2.gz KVTJOFMMQZCQJZ-UHFFFAOYSA-N 1 0 275.392 3.616 20 10 CHCDRO CCOCc1cc(C[NH2+][C@@H]2CCCC[C@@H]2C)ccc1OC ZINC001198959169 1123017890 /nfs/dbraw/zinc/01/78/90/1123017890.db2.gz JJUWPDSQQXSVFW-WMLDXEAASA-N 1 0 291.435 3.900 20 10 CHCDRO Cc1cc(Br)cc(C[N@@H+]2CCCC2(C)C)c1O ZINC000160966368 1123018451 /nfs/dbraw/zinc/01/84/51/1123018451.db2.gz FYIPZMOYCAWREC-UHFFFAOYSA-N 1 0 298.224 3.838 20 10 CHCDRO Cc1cccc(C[N@@H+]2Cc3ccccc3C3(CC3)C2)c1O ZINC000776013975 1123035135 /nfs/dbraw/zinc/03/51/35/1123035135.db2.gz POYOGSSUFISPKC-UHFFFAOYSA-N 1 0 279.383 3.748 20 10 CHCDRO C[C@H]([NH2+]CCCC1CCOCC1)c1ccc(N(C)C)cc1 ZINC000776008656 1123036462 /nfs/dbraw/zinc/03/64/62/1123036462.db2.gz ULFPPCGEQOBBBN-HNNXBMFYSA-N 1 0 290.451 3.610 20 10 CHCDRO C[C@@H]1CCC[C@@H](C[NH2+]Cc2cc(F)c(N(C)C)cc2F)C1 ZINC001199759386 1123038961 /nfs/dbraw/zinc/03/89/61/1123038961.db2.gz JIGQJWLDJPERJS-CHWSQXEVSA-N 1 0 296.405 3.947 20 10 CHCDRO Cc1ccsc1C[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC001199842247 1123042374 /nfs/dbraw/zinc/04/23/74/1123042374.db2.gz HGHSIZRSZCENEN-PLNGDYQASA-N 1 0 286.444 3.926 20 10 CHCDRO CCC1CCC([NH2+]Cc2ccc(N(C)C)c(F)c2)CC1 ZINC001199864316 1123043258 /nfs/dbraw/zinc/04/32/58/1123043258.db2.gz IFWCMMRTYDAHIV-UHFFFAOYSA-N 1 0 278.415 3.950 20 10 CHCDRO CCOc1ccc(C[NH2+]C2CC(c3ccccc3)C2)c(O)c1 ZINC000776173705 1123101608 /nfs/dbraw/zinc/10/16/08/1123101608.db2.gz GQPATRJQAYUYSA-UHFFFAOYSA-N 1 0 297.398 3.827 20 10 CHCDRO COc1cccc(C[NH2+][C@@H](C)CCC2CCCC2)c1O ZINC000776213327 1123150117 /nfs/dbraw/zinc/15/01/17/1123150117.db2.gz ASGNNRVZSWAHBK-ZDUSSCGKSA-N 1 0 277.408 3.849 20 10 CHCDRO [O-]c1ccc(Cl)c(F)c1C[NH2+]CC12CCC(CC1)C2 ZINC001201787651 1123152227 /nfs/dbraw/zinc/15/22/27/1123152227.db2.gz SEWLAFFCAJZVAW-UHFFFAOYSA-N 1 0 283.774 3.855 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]C[C@H]1[C@@H]2c3ccccc3C[C@H]12 ZINC000776248271 1123182475 /nfs/dbraw/zinc/18/24/75/1123182475.db2.gz LLZHBZZPIANBRJ-HBUWYVDXSA-N 1 0 299.801 3.721 20 10 CHCDRO CC(F)(F)C(C)(C)C[NH2+]Cc1c(O)cccc1Cl ZINC000696587891 1123216009 /nfs/dbraw/zinc/21/60/09/1123216009.db2.gz WHMCSIDURVFWOO-UHFFFAOYSA-N 1 0 277.742 3.817 20 10 CHCDRO CC[C@](C)([NH2+]Cc1ccccc1O)c1ccccc1 ZINC000107717660 1123227105 /nfs/dbraw/zinc/22/71/05/1123227105.db2.gz SWILGYAQKJJWRK-KRWDZBQOSA-N 1 0 255.361 3.807 20 10 CHCDRO CC[C@H](Cc1ccc(F)cc1)[NH2+]Cc1ccccc1O ZINC000850342525 1123254949 /nfs/dbraw/zinc/25/49/49/1123254949.db2.gz MJBVZDDCWKPDEA-MRXNPFEDSA-N 1 0 273.351 3.642 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]CC[C@@]2(C)CC2(F)F)cc1 ZINC000850380528 1123260423 /nfs/dbraw/zinc/26/04/23/1123260423.db2.gz IGRBPJHTVNKFLP-AWFCHZOYSA-N 1 0 294.389 3.791 20 10 CHCDRO COc1cccc(C[NH2+]Cc2cc(C)c(C)cc2O)c1C ZINC000850416507 1123264265 /nfs/dbraw/zinc/26/42/65/1123264265.db2.gz KPJYTAZGIMAKNF-UHFFFAOYSA-N 1 0 285.387 3.616 20 10 CHCDRO COc1cccc(C[NH2+][C@@H]2CCCc3c(C)cccc32)c1O ZINC000850411818 1123264267 /nfs/dbraw/zinc/26/42/67/1123264267.db2.gz LMNISYFCOZDSBT-QGZVFWFLSA-N 1 0 297.398 3.876 20 10 CHCDRO CC[C@@H]([NH2+]CCC1CC(OC)C1)c1ccc(N(C)C)cc1 ZINC000850481278 1123273342 /nfs/dbraw/zinc/27/33/42/1123273342.db2.gz IQTHATCXGYHDQM-IUPXNIOVSA-N 1 0 290.451 3.608 20 10 CHCDRO CCC(O)(CC)C(C)(C)C[NH2+][C@H](C)c1ccccc1O ZINC000850500811 1123274850 /nfs/dbraw/zinc/27/48/50/1123274850.db2.gz GMEPVXMCGDKDRY-CYBMUJFWSA-N 1 0 279.424 3.620 20 10 CHCDRO CC[C@H](COCC1CC1)[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000850493135 1123274883 /nfs/dbraw/zinc/27/48/83/1123274883.db2.gz HKMUSJDGMZWZOX-WBVHZDCISA-N 1 0 291.435 3.947 20 10 CHCDRO CC[C@H](COCC1CC1)[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000850495267 1123275270 /nfs/dbraw/zinc/27/52/70/1123275270.db2.gz ZFHCHTHGKRBXLY-SMDDNHRTSA-N 1 0 297.826 3.901 20 10 CHCDRO CC[C@H]([NH2+]CCc1cnccc1C)c1ccc(C)cc1O ZINC000850505836 1123276060 /nfs/dbraw/zinc/27/60/60/1123276060.db2.gz ZIGRAWJXSFZWHJ-KRWDZBQOSA-N 1 0 284.403 3.687 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@H]2C=CCC2)c1O ZINC000850506969 1123276807 /nfs/dbraw/zinc/27/68/07/1123276807.db2.gz HCBSXVSUEPAWLJ-PWSUYJOCSA-N 1 0 251.757 3.723 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H]2C=CCC2)c1O ZINC000850506972 1123277033 /nfs/dbraw/zinc/27/70/33/1123277033.db2.gz HCBSXVSUEPAWLJ-ZYHUDNBSSA-N 1 0 251.757 3.723 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H]2COC3(CCC3)C2)cc1 ZINC000850524512 1123280961 /nfs/dbraw/zinc/28/09/61/1123280961.db2.gz GTJOVUUGBHNJPK-GDBMZVCRSA-N 1 0 288.435 3.505 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2C[C@H](O)c3ccccc32)c(O)c1 ZINC000850526970 1123282238 /nfs/dbraw/zinc/28/22/38/1123282238.db2.gz DHKSXDYRNMWKJG-XZOAIXRZSA-N 1 0 283.371 3.530 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1C[C@@H](O)c2ccccc21)c1ccc(C)cc1O ZINC000850530587 1123284889 /nfs/dbraw/zinc/28/48/89/1123284889.db2.gz ZZQQAKACHAVTQC-YQVWRLOYSA-N 1 0 297.398 3.920 20 10 CHCDRO C[C@H]([NH2+]CCc1ccoc1)c1cc2c(cc1O)CCCC2 ZINC000850532415 1123285968 /nfs/dbraw/zinc/28/59/68/1123285968.db2.gz UPTSDZPHOWVSEV-ZDUSSCGKSA-N 1 0 285.387 3.757 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CCC(C)(C)F)cc1 ZINC000850532255 1123286308 /nfs/dbraw/zinc/28/63/08/1123286308.db2.gz RKXJWBSJGGUNKU-ZDUSSCGKSA-N 1 0 266.404 3.932 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2c(C3CCC3)cnn2C)c1 ZINC000850549342 1123289169 /nfs/dbraw/zinc/28/91/69/1123289169.db2.gz GVAFCVSELGGPRW-CYBMUJFWSA-N 1 0 299.418 3.552 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCc2ccc(O)cc21)c1ccc(N(C)C)cc1 ZINC000850543399 1123289198 /nfs/dbraw/zinc/28/91/98/1123289198.db2.gz IXIMFLDBEWRTPX-ORAYPTAESA-N 1 0 296.414 3.796 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2C(C)(C)C2(F)F)c(O)c1 ZINC000850553586 1123289876 /nfs/dbraw/zinc/28/98/76/1123289876.db2.gz ZEXGILRLJMNFKZ-GXFFZTMASA-N 1 0 269.335 3.643 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CCC2SCCS2)c(O)c1 ZINC000850569276 1123293407 /nfs/dbraw/zinc/29/34/07/1123293407.db2.gz YZRNIFSFFLXITF-LBPRGKRZSA-N 1 0 297.489 3.856 20 10 CHCDRO C[C@H]1C[C@@H]([NH2+]CCCc2ccco2)c2c1c(F)ccc2O ZINC000850570554 1123294246 /nfs/dbraw/zinc/29/42/46/1123294246.db2.gz WDXUNHXUMDJPEC-SMDDNHRTSA-N 1 0 289.350 3.895 20 10 CHCDRO C=C/C=C/CC[NH2+]Cc1ccc(N(CC)CC)cc1 ZINC000713456043 1123294934 /nfs/dbraw/zinc/29/49/34/1123294934.db2.gz LBHVNOFMJAUDQD-BQYQJAHWSA-N 1 0 258.409 3.755 20 10 CHCDRO Cc1ccc(C)c(C[N@H+](C)Cc2ccccc2O)c1 ZINC000109772566 1123326565 /nfs/dbraw/zinc/32/65/65/1123326565.db2.gz OTGWQWZVMDZWOR-UHFFFAOYSA-N 1 0 255.361 3.641 20 10 CHCDRO C[N@H+](Cc1ccc(Cl)cc1)Cc1ccccc1O ZINC000109773258 1123326783 /nfs/dbraw/zinc/32/67/83/1123326783.db2.gz JTVMGFRFKUMQRI-UHFFFAOYSA-N 1 0 261.752 3.678 20 10 CHCDRO CCCC[N@H+](Cc1ccccc1O)[C@@H]1CC[C@@H](OC)C1 ZINC000852019038 1123392786 /nfs/dbraw/zinc/39/27/86/1123392786.db2.gz TUFNGHSRZSHVSR-HZPDHXFCSA-N 1 0 277.408 3.562 20 10 CHCDRO CCCC[N@H+](Cc1ccccc1O)[C@H]1CC[C@@H](OC)C1 ZINC000852019039 1123393366 /nfs/dbraw/zinc/39/33/66/1123393366.db2.gz TUFNGHSRZSHVSR-JKSUJKDBSA-N 1 0 277.408 3.562 20 10 CHCDRO CCCCN1CCCC[C@@H]1C[NH2+][C@H](C)c1ccccc1O ZINC000783509874 1123400981 /nfs/dbraw/zinc/40/09/81/1123400981.db2.gz VHMLXFCEYFXTER-HZPDHXFCSA-N 1 0 290.451 3.697 20 10 CHCDRO C[C@H]([NH2+]CCc1ccc(F)cc1F)c1ccccc1O ZINC000783511022 1123403665 /nfs/dbraw/zinc/40/36/65/1123403665.db2.gz WCZTVCLTQMXIPQ-NSHDSACASA-N 1 0 277.314 3.564 20 10 CHCDRO CCN(C(=O)C=C1CC[NH2+]CC1)c1ccc2ccccc2c1 ZINC000852824132 1123415733 /nfs/dbraw/zinc/41/57/33/1123415733.db2.gz XYDQYKLOQSFUNY-UHFFFAOYSA-N 1 0 294.398 3.503 20 10 CHCDRO c1ccc([C@H]2C[C@@H]2C[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC000111398675 1123443199 /nfs/dbraw/zinc/44/31/99/1123443199.db2.gz KIMHWAMCOSFRCN-QZTJIDSGSA-N 1 0 279.383 3.515 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC[C@H](CCF)C2)cc1C ZINC000853564654 1123444108 /nfs/dbraw/zinc/44/41/08/1123444108.db2.gz RJHNEKKNZSULDG-CQSZACIVSA-N 1 0 265.372 3.581 20 10 CHCDRO C[C@H]([NH2+]CCOC1CCCCC1)c1ccc(N(C)C)cc1 ZINC000111636122 1123457387 /nfs/dbraw/zinc/45/73/87/1123457387.db2.gz NUNWCQBMSXMBCR-HNNXBMFYSA-N 1 0 290.451 3.753 20 10 CHCDRO C[C@@H]([NH2+]CCOC1CCCCC1)c1ccc(N(C)C)cc1 ZINC000111636124 1123457746 /nfs/dbraw/zinc/45/77/46/1123457746.db2.gz NUNWCQBMSXMBCR-OAHLLOKOSA-N 1 0 290.451 3.753 20 10 CHCDRO Cc1cc(Cl)cc(C[NH+]2C[C@H]3CCCC[C@@H]3C2)c1O ZINC001237681087 1129123908 /nfs/dbraw/zinc/12/39/08/1129123908.db2.gz KYLCTESTTFMLEQ-CHWSQXEVSA-N 1 0 279.811 3.976 20 10 CHCDRO Cc1cc(O)c(C[NH2+]Cc2cc(C3CC3)no2)cc1Cl ZINC000895763917 1123511276 /nfs/dbraw/zinc/51/12/76/1123511276.db2.gz CWNWADVCTPWYIM-UHFFFAOYSA-N 1 0 292.766 3.509 20 10 CHCDRO CC(C)Cc1ccc(C[NH2+][C@H](C)c2ccccc2O)cn1 ZINC000895850992 1123521485 /nfs/dbraw/zinc/52/14/85/1123521485.db2.gz HVNCWPDMDQCNDC-CQSZACIVSA-N 1 0 284.403 3.837 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCOC(C)(C)C)cc1 ZINC000776890697 1123563653 /nfs/dbraw/zinc/56/36/53/1123563653.db2.gz TUJGHQCFNADFOF-CQSZACIVSA-N 1 0 278.440 3.608 20 10 CHCDRO COc1ccc(O)c(C[NH2+]C/C(C)=C/c2ccccc2)c1 ZINC000114506224 1123564438 /nfs/dbraw/zinc/56/44/38/1123564438.db2.gz PUDMTTDVHFIVIQ-GXDHUFHOSA-N 1 0 283.371 3.594 20 10 CHCDRO COc1ccc(F)c(C[NH2+][C@H](C)c2cc(C)ccc2O)c1 ZINC000857080569 1123584711 /nfs/dbraw/zinc/58/47/11/1123584711.db2.gz IEYMRLNZFBMOGT-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO C[C@H]([NH2+]CC[C@H]1CC1(F)F)c1cc(Cl)ccc1O ZINC000857081692 1123585939 /nfs/dbraw/zinc/58/59/39/1123585939.db2.gz QDOWEUBOKXSDPA-IUCAKERBSA-N 1 0 275.726 3.742 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CCO[C@H](CC(C)C)C2)cc1C ZINC000776949108 1123608852 /nfs/dbraw/zinc/60/88/52/1123608852.db2.gz JYPGFKAZWSTAHR-IAGOWNOFSA-N 1 0 291.435 3.687 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2ncc(C(C)C)s2)c1 ZINC000858239883 1123639067 /nfs/dbraw/zinc/63/90/67/1123639067.db2.gz VSGYEWSXDIJYDW-UHFFFAOYSA-N 1 0 276.405 3.570 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H]2CCC[C@H](c3cccnc3)C2)c1 ZINC000858238525 1123639439 /nfs/dbraw/zinc/63/94/39/1123639439.db2.gz AFADRUKCRSNHRV-YJBOKZPZSA-N 1 0 296.414 3.912 20 10 CHCDRO Oc1ccccc1C[NH2+]C1(c2c(F)cccc2F)CCC1 ZINC000858341316 1123646146 /nfs/dbraw/zinc/64/61/46/1123646146.db2.gz BJKMQKUPCDFZHL-UHFFFAOYSA-N 1 0 289.325 3.839 20 10 CHCDRO CO[C@H]1C[C@@H](C[NH2+][C@@H](C)c2ccc3ccccc3c2O)C1 ZINC000858592545 1123665852 /nfs/dbraw/zinc/66/58/52/1123665852.db2.gz FSIFLZODDJTPGK-KCQAQPDRSA-N 1 0 285.387 3.621 20 10 CHCDRO Cc1cccnc1[C@H]1CCC[C@@H]([NH2+]Cc2ccccc2O)C1 ZINC000281126578 1123683499 /nfs/dbraw/zinc/68/34/99/1123683499.db2.gz DPNDKZATHHMAKY-DOTOQJQBSA-N 1 0 296.414 3.912 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCC(F)(F)C1)c1cc(F)ccc1O ZINC000281273120 1123692520 /nfs/dbraw/zinc/69/25/20/1123692520.db2.gz YRHQLFBFJBIFOS-VHSXEESVSA-N 1 0 273.298 3.617 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCC(F)(F)C1)c1cc(F)ccc1O ZINC000281273108 1123692694 /nfs/dbraw/zinc/69/26/94/1123692694.db2.gz YRHQLFBFJBIFOS-NXEZZACHSA-N 1 0 273.298 3.617 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]C[C@@H]1CCC2(CCCC2)O1 ZINC000691832349 1123741881 /nfs/dbraw/zinc/74/18/81/1123741881.db2.gz WVEWAWRIYMPMPY-LBPRGKRZSA-N 1 0 295.810 3.627 20 10 CHCDRO CC[C@@H]([NH2+]C1(C2CC2)CC1)c1ccc(N(C)C)cc1 ZINC000777149248 1123747747 /nfs/dbraw/zinc/74/77/47/1123747747.db2.gz LROMADZDULHSPZ-MRXNPFEDSA-N 1 0 258.409 3.736 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+]2C[C@@H](C)C(F)(F)[C@@H](C)C2)c1 ZINC000862444033 1123810654 /nfs/dbraw/zinc/81/06/54/1123810654.db2.gz SLSZHPNOLXRHOO-TXEJJXNPSA-N 1 0 299.361 3.514 20 10 CHCDRO CCOc1ccc(C[N@H+]2C[C@@H](C)C(F)(F)[C@@H](C)C2)c(O)c1 ZINC000862444677 1123811716 /nfs/dbraw/zinc/81/17/16/1123811716.db2.gz XPSBAEBLKKFOCV-TXEJJXNPSA-N 1 0 299.361 3.514 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H](C)CCC(F)(F)F)c1 ZINC000862475988 1123813077 /nfs/dbraw/zinc/81/30/77/1123813077.db2.gz DPDQXEOSFCMUPG-JTQLQIEISA-N 1 0 261.287 3.521 20 10 CHCDRO CCOc1cccc(C[N@H+](C)[C@H](C)c2ccccc2)c1O ZINC000119376225 1123857560 /nfs/dbraw/zinc/85/75/60/1123857560.db2.gz GRXBMXHLNWVJHJ-CQSZACIVSA-N 1 0 285.387 3.984 20 10 CHCDRO CO[C@@](C)([C@@H](C)[NH2+][C@H](C)c1cc(C)ccc1O)C1CC1 ZINC000840859984 1123862294 /nfs/dbraw/zinc/86/22/94/1123862294.db2.gz RAKRLUGBLSIOSL-XNJGSVPQSA-N 1 0 277.408 3.555 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@H]2C[C@@H](C)O[C@H]2C)c1O ZINC000840872997 1123872015 /nfs/dbraw/zinc/87/20/15/1123872015.db2.gz OTNKXXFAVLSNPF-VOAKCMCISA-N 1 0 297.826 3.818 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CCCC[C@H]1F)c1ccccc1O ZINC000840875503 1123882201 /nfs/dbraw/zinc/88/22/01/1123882201.db2.gz HPIAIGLVLVUVKO-MGPQQGTHSA-N 1 0 251.345 3.714 20 10 CHCDRO C[C@H]1CC2(CCC2)C[N@@H+]1Cc1cc(Cl)ccc1O ZINC000763646198 1129151579 /nfs/dbraw/zinc/15/15/79/1129151579.db2.gz KGHOYXFVFZLVQI-NSHDSACASA-N 1 0 265.784 3.810 20 10 CHCDRO CC[C@@H]([NH2+]CCSC(F)(F)F)c1ccc(C)cc1O ZINC000794796377 1123949693 /nfs/dbraw/zinc/94/96/93/1123949693.db2.gz KALTUVALLYXJBG-LLVKDONJSA-N 1 0 293.354 3.994 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cccc(C)n1)c1ccc(C)cc1O ZINC000794795820 1123949959 /nfs/dbraw/zinc/94/99/59/1123949959.db2.gz JEBLKTLXNHEYNU-MRXNPFEDSA-N 1 0 270.376 3.645 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)CN1CCCCC1)c1ccc(C)cc1O ZINC000794799142 1123950455 /nfs/dbraw/zinc/95/04/55/1123950455.db2.gz ZAWOPKRJJPIWLC-NVXWUHKLSA-N 1 0 290.451 3.616 20 10 CHCDRO CC[C@H]([NH2+]C[C@@](C)(O)CCC(C)C)c1ccc(C)cc1O ZINC000794799989 1123950604 /nfs/dbraw/zinc/95/06/04/1123950604.db2.gz AYIWFJKMWRQMAH-WMZOPIPTSA-N 1 0 293.451 3.929 20 10 CHCDRO CC[C@@H]([NH2+]CCN1CCCC[C@H]1C)c1ccc(C)cc1O ZINC000794794550 1123951581 /nfs/dbraw/zinc/95/15/81/1123951581.db2.gz FCBMHVSCCRMIHL-NVXWUHKLSA-N 1 0 290.451 3.616 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)Cc1ccco1)c1ccc(C)cc1O ZINC000794794005 1123951681 /nfs/dbraw/zinc/95/16/81/1123951681.db2.gz PBGKSXXZNDQTMW-BBRMVZONSA-N 1 0 273.376 3.966 20 10 CHCDRO CC[C@@H]([NH2+]CCOCCC(C)C)c1ccc(C)cc1O ZINC000794805288 1123954291 /nfs/dbraw/zinc/95/42/91/1123954291.db2.gz PVTDUPZRSWELEA-MRXNPFEDSA-N 1 0 279.424 3.804 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccoc1C)c1ccc(C)cc1O ZINC000794805732 1123955255 /nfs/dbraw/zinc/95/52/55/1123955255.db2.gz QLUASZODFUZSEB-OAHLLOKOSA-N 1 0 259.349 3.843 20 10 CHCDRO CC[C@H]([NH2+]C1C[C@H](C)O[C@@H](C)C1)c1ccc(C)cc1O ZINC000794814335 1123957026 /nfs/dbraw/zinc/95/70/26/1123957026.db2.gz CYMNHXYNXDRQSJ-XEZPLFJOSA-N 1 0 277.408 3.697 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CO)c1ccsc1)c1ccc(C)cc1O ZINC000794812447 1123958995 /nfs/dbraw/zinc/95/89/95/1123958995.db2.gz CZEGYROTTSVKRH-CABCVRRESA-N 1 0 291.416 3.536 20 10 CHCDRO CCOC[C@H]([NH2+][C@H](CC)c1ccc(C)cc1O)C(C)C ZINC000794812479 1123959182 /nfs/dbraw/zinc/95/91/82/1123959182.db2.gz DQKSPTYWGONIBA-CVEARBPZSA-N 1 0 279.424 3.802 20 10 CHCDRO CC[C@H]([NH2+]CC1([C@H](O)C(C)C)CC1)c1ccc(C)cc1O ZINC000794817105 1123960138 /nfs/dbraw/zinc/96/01/38/1123960138.db2.gz MYHXOYXZTZMCPZ-DOTOQJQBSA-N 1 0 291.435 3.538 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+]CCC2(C)CC2)c2c1c(F)ccc2O ZINC000794828435 1123961981 /nfs/dbraw/zinc/96/19/81/1123961981.db2.gz OVYWKURKSBESLO-PWSUYJOCSA-N 1 0 263.356 3.859 20 10 CHCDRO C[C@H]([NH2+]CCC1(C)CC1)c1cc(Br)ccc1O ZINC000794826692 1123962255 /nfs/dbraw/zinc/96/22/55/1123962255.db2.gz CSNMAJVIJZDOFA-JTQLQIEISA-N 1 0 298.224 3.996 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CO)CC1CCC1)c1cc(Cl)ccc1O ZINC000794836582 1123971583 /nfs/dbraw/zinc/97/15/83/1123971583.db2.gz UIOBUFADZFQZSH-UKRRQHHQSA-N 1 0 297.826 3.637 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CCO[C@H]2c2ccccc2)cc1C ZINC000865651397 1124002539 /nfs/dbraw/zinc/00/25/39/1124002539.db2.gz ZVYNMYCWZRWRMQ-MJGOQNOKSA-N 1 0 297.398 3.623 20 10 CHCDRO CCOCc1cc(C[NH2+][C@]23C[C@H]2CCCC3)ccc1OC ZINC000865704171 1124006944 /nfs/dbraw/zinc/00/69/44/1124006944.db2.gz RWASVRVGWCZHOM-SJLPKXTDSA-N 1 0 289.419 3.654 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CC(C)(C)C(C)(F)F)cc1C ZINC000865789656 1124015775 /nfs/dbraw/zinc/01/57/75/1124015775.db2.gz LRCLWYCYAFDQDV-UHFFFAOYSA-N 1 0 271.351 3.780 20 10 CHCDRO Cc1ccc(O)c(C[N@H+](C)Cc2nc3ccccc3s2)c1 ZINC000120800551 1124024816 /nfs/dbraw/zinc/02/48/16/1124024816.db2.gz YTYYHYPJKWLPNP-UHFFFAOYSA-N 1 0 298.411 3.942 20 10 CHCDRO Cc1cc(Cl)nc(C[NH2+]Cc2cc(C)c(C)cc2O)c1 ZINC000282011872 1124026390 /nfs/dbraw/zinc/02/63/90/1124026390.db2.gz MUGVJQOTNIVZDI-UHFFFAOYSA-N 1 0 290.794 3.656 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC[C@@H]2CCSC2)c(O)c1C ZINC000866401883 1124062684 /nfs/dbraw/zinc/06/26/84/1124062684.db2.gz GAWKUNVFXSLLQD-ZIAGYGMSSA-N 1 0 279.449 3.803 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CC[C@@H]2CCSC2)c(O)c1 ZINC000866404901 1124063913 /nfs/dbraw/zinc/06/39/13/1124063913.db2.gz XHAFYJREEBLEAF-UONOGXRCSA-N 1 0 279.449 3.803 20 10 CHCDRO C[C@H]([NH2+][C@@H]1C[C@H]1C(F)(F)F)c1cc(Cl)ccc1O ZINC000866498877 1124073804 /nfs/dbraw/zinc/07/38/04/1124073804.db2.gz BXQFZEIBLLRVJQ-WQGWLQIFSA-N 1 0 279.689 3.647 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C2([C@@H]3CCCCO3)CCC2)c(O)c1 ZINC000866622964 1124090913 /nfs/dbraw/zinc/09/09/13/1124090913.db2.gz KTNYAKULLASEAQ-YOEHRIQHSA-N 1 0 289.419 3.843 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C2([C@@H]3CCCCO3)CCC2)c1 ZINC000866623399 1124091188 /nfs/dbraw/zinc/09/11/88/1124091188.db2.gz QLZPFCWRCXSVPA-PBHICJAKSA-N 1 0 289.419 3.843 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2ccc(N(C)C)cc2)cc1C ZINC000035012545 1124134735 /nfs/dbraw/zinc/13/47/35/1124134735.db2.gz HXWFMRLQCHGPMR-UHFFFAOYSA-N 1 0 268.404 3.659 20 10 CHCDRO C[C@H]1C[C@@H]([NH2+]CCCC(F)F)c2c1c(F)ccc2O ZINC001119607227 1131260006 /nfs/dbraw/zinc/26/00/06/1131260006.db2.gz ZDOJKWLARDQFGJ-WCBMZHEXSA-N 1 0 273.298 3.715 20 10 CHCDRO CCc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)o1 ZINC000122486239 1124503659 /nfs/dbraw/zinc/50/36/59/1124503659.db2.gz XXXCHXHDBNAUSN-LBPRGKRZSA-N 1 0 290.382 3.898 20 10 CHCDRO C[C@@H](Cc1ccc(O)cc1)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000122899721 1124544277 /nfs/dbraw/zinc/54/42/77/1124544277.db2.gz YFIBHIFDDLRGKY-GJZGRUSLSA-N 1 0 298.430 3.740 20 10 CHCDRO Cc1cc(-c2[nH+]ccc3c2ccn3C)cnc1OCC(C)C ZINC001238921125 1131270617 /nfs/dbraw/zinc/27/06/17/1131270617.db2.gz DAERQKLXADGYNV-UHFFFAOYSA-N 1 0 295.386 3.979 20 10 CHCDRO c1cc(N2CCCCC2)ccc1C[NH2+]C[C@@H]1CCCS1 ZINC000123949091 1124680872 /nfs/dbraw/zinc/68/08/72/1124680872.db2.gz UKXKEMRDTRMTCM-KRWDZBQOSA-N 1 0 290.476 3.662 20 10 CHCDRO COCC(C)(C)CC[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000872104720 1124683040 /nfs/dbraw/zinc/68/30/40/1124683040.db2.gz NWSRJQYSERHVQO-CQSZACIVSA-N 1 0 279.424 3.722 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1C[C@H]2CCC[C@H]2O1)c1cc(Cl)ccc1O ZINC000872110041 1124686553 /nfs/dbraw/zinc/68/65/53/1124686553.db2.gz VJWXYKSLFAAPAA-NGOBNIPXSA-N 1 0 295.810 3.654 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC2(OC(C)C)CCC2)c(O)c1 ZINC000872116623 1124687624 /nfs/dbraw/zinc/68/76/24/1124687624.db2.gz UBEALHDJPBKQDD-AWEZNQCLSA-N 1 0 277.408 3.699 20 10 CHCDRO Cc1nccnc1[C@@H](C)[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000872129720 1124690616 /nfs/dbraw/zinc/69/06/16/1124690616.db2.gz ATZPFKDZPBOQQJ-MWLCHTKSSA-N 1 0 291.782 3.556 20 10 CHCDRO C[N@H+](Cc1c[nH]c2c1cccc2F)Cc1ccccc1O ZINC001137059368 1124711256 /nfs/dbraw/zinc/71/12/56/1124711256.db2.gz YJQQXOOMTIPXID-UHFFFAOYSA-N 1 0 284.334 3.645 20 10 CHCDRO COCC(C)(C)CC[NH2+]Cc1c(O)cc(C)cc1Cl ZINC000873152655 1124742707 /nfs/dbraw/zinc/74/27/07/1124742707.db2.gz BFEXSGYXBCTQIK-UHFFFAOYSA-N 1 0 285.815 3.506 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]C2CCC(C)CC2)c1 ZINC000019917947 1124770370 /nfs/dbraw/zinc/77/03/70/1124770370.db2.gz XJJCAWAQCAYHIZ-OTTFEQOBSA-N 1 0 263.381 3.630 20 10 CHCDRO CN(C)c1ccc(C[NH2+]Cc2cc3ccccc3o2)cc1 ZINC000020146132 1124808617 /nfs/dbraw/zinc/80/86/17/1124808617.db2.gz DZUDUOXTZQPNKB-UHFFFAOYSA-N 1 0 280.371 3.789 20 10 CHCDRO COc1ccccc1[C@H]1CC[N@H+](Cc2c(C)cccc2O)C1 ZINC000876758215 1124974904 /nfs/dbraw/zinc/97/49/04/1124974904.db2.gz JWAUWHSYTCMKIO-HNNXBMFYSA-N 1 0 297.398 3.699 20 10 CHCDRO Cc1cccc(O)c1CNc1ccc(C[NH+](C)C)c(F)c1 ZINC000876869661 1124987107 /nfs/dbraw/zinc/98/71/07/1124987107.db2.gz VYTIATAMKVHYAL-UHFFFAOYSA-N 1 0 288.366 3.513 20 10 CHCDRO CCCOCc1ccccc1C[NH2+]Cc1ccc(C)cc1O ZINC000876943261 1124991592 /nfs/dbraw/zinc/99/15/92/1124991592.db2.gz NTNPBAUFXXOYQY-UHFFFAOYSA-N 1 0 299.414 3.917 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(C)cc2O)s1 ZINC000876964797 1124992704 /nfs/dbraw/zinc/99/27/04/1124992704.db2.gz QKJCAGQEHONVTJ-GFCCVEGCSA-N 1 0 261.390 3.921 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](c2ccccc2)[C@H]2CCCO2)c(O)c1 ZINC000876976499 1124995021 /nfs/dbraw/zinc/99/50/21/1124995021.db2.gz QLXHYCMXEIMKHP-RTBURBONSA-N 1 0 297.398 3.711 20 10 CHCDRO CCOc1ccc(C[NH2+]Cc2c(C)cccc2O)cc1F ZINC000877008282 1124996834 /nfs/dbraw/zinc/99/68/34/1124996834.db2.gz IPLCXDKKWBVQSJ-UHFFFAOYSA-N 1 0 289.350 3.528 20 10 CHCDRO CCC[C@@H]([NH2+]Cc1ccc(C)cc1O)c1ccccn1 ZINC000877013638 1124997983 /nfs/dbraw/zinc/99/79/83/1124997983.db2.gz UPBAYSJOCCNGIW-OAHLLOKOSA-N 1 0 270.376 3.727 20 10 CHCDRO Cc1ccc(C[NH2+]C2(c3cccc(F)c3)CC2)c(O)c1 ZINC000877050097 1125004304 /nfs/dbraw/zinc/00/43/04/1125004304.db2.gz XYJXLXHLFKYFBZ-UHFFFAOYSA-N 1 0 271.335 3.619 20 10 CHCDRO CSc1ccc(F)cc1C[NH2+]Cc1ccc(C)cc1O ZINC000877067891 1125005203 /nfs/dbraw/zinc/00/52/03/1125005203.db2.gz NTJUKNDYSIKLEB-UHFFFAOYSA-N 1 0 291.391 3.851 20 10 CHCDRO Cc1ccc(C[NH2+]C[C@H]2CC[C@@H](c3ccccc3)O2)c(O)c1 ZINC000877539237 1125040879 /nfs/dbraw/zinc/04/08/79/1125040879.db2.gz LDLSKZQEVDIJIP-MJGOQNOKSA-N 1 0 297.398 3.711 20 10 CHCDRO Cc1ccc(C[NH2+]C[C@H]2CC[C@H](c3ccccc3)O2)c(O)c1 ZINC000877537430 1125041384 /nfs/dbraw/zinc/04/13/84/1125041384.db2.gz LDLSKZQEVDIJIP-IEBWSBKVSA-N 1 0 297.398 3.711 20 10 CHCDRO CCc1cccc(C[NH2+][C@H](C)c2cnc(C)s2)c1O ZINC000877685268 1125062452 /nfs/dbraw/zinc/06/24/52/1125062452.db2.gz SENPZNYFNHATHX-SNVBAGLBSA-N 1 0 276.405 3.570 20 10 CHCDRO Cc1scc(C[NH2+]Cc2ccc(C)cc2O)c1C ZINC000877673981 1125063454 /nfs/dbraw/zinc/06/34/54/1125063454.db2.gz KRQCRHZORRSPGL-UHFFFAOYSA-N 1 0 261.390 3.669 20 10 CHCDRO Cc1cccc(C[NH2+][C@H](CF)c2ccc(F)cc2)c1O ZINC000877758977 1125074689 /nfs/dbraw/zinc/07/46/89/1125074689.db2.gz PEXCNGIKWGFVGZ-OAHLLOKOSA-N 1 0 277.314 3.640 20 10 CHCDRO C[C@H](CSC(C)(C)C)[NH2+][C@H](C)c1ccccc1O ZINC000877756629 1125075371 /nfs/dbraw/zinc/07/53/71/1125075371.db2.gz ZWHUSXBOVCQUOV-VXGBXAGGSA-N 1 0 267.438 3.963 20 10 CHCDRO C[C@H]([NH2+]CCCF)c1ccc(N2CCCCC2)cc1 ZINC000126834794 1125108757 /nfs/dbraw/zinc/10/87/57/1125108757.db2.gz IUGFVXMTPYDCLM-AWEZNQCLSA-N 1 0 264.388 3.687 20 10 CHCDRO C[C@@H]([NH2+]CC[C@H]1CCC2(CCC2)O1)c1ccccc1O ZINC000717108815 1125152088 /nfs/dbraw/zinc/15/20/88/1125152088.db2.gz GJLHTJGZGWOIKF-ZIAGYGMSSA-N 1 0 275.392 3.535 20 10 CHCDRO COc1cccc(C[N@@H+]2C[C@H](c3ccccc3)C[C@@H]2C)c1O ZINC000127579761 1125202752 /nfs/dbraw/zinc/20/27/52/1125202752.db2.gz LVSXDCKMRQSJHT-WMLDXEAASA-N 1 0 297.398 3.779 20 10 CHCDRO C[C@@H]([NH2+]CCCCC1CCOCC1)c1ccccc1O ZINC000879649005 1125222518 /nfs/dbraw/zinc/22/25/18/1125222518.db2.gz GYNSEDKNSUSIRU-CQSZACIVSA-N 1 0 277.408 3.640 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]Cc2ccc(C)s2)c1O ZINC000228671358 1125251024 /nfs/dbraw/zinc/25/10/24/1125251024.db2.gz QRKSWXJRWVABSF-UHFFFAOYSA-N 1 0 297.807 3.714 20 10 CHCDRO CC[C@H](C)C[C@@H](C)[NH2+]Cc1cc(Cl)cc(OC)c1O ZINC000228675618 1125251048 /nfs/dbraw/zinc/25/10/48/1125251048.db2.gz NWHNUNQXKPACRS-WDEREUQCSA-N 1 0 285.815 3.969 20 10 CHCDRO CSCCCCCC[NH2+][C@H](C)c1ccccc1O ZINC000184104232 1125291997 /nfs/dbraw/zinc/29/19/97/1125291997.db2.gz WQVHSSCIYMNNSN-CYBMUJFWSA-N 1 0 267.438 3.966 20 10 CHCDRO COc1ccc([C@@H](C)[NH2+]Cc2cc(F)ccc2O)cc1C ZINC000897417437 1125321116 /nfs/dbraw/zinc/32/11/16/1125321116.db2.gz PLYAWAMIUHQXCL-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO CC[N@H+](Cc1ccoc1)Cc1ccc(N(C)C)c(F)c1 ZINC000129909867 1125353448 /nfs/dbraw/zinc/35/34/48/1125353448.db2.gz BBFPSQXVKRPSPN-UHFFFAOYSA-N 1 0 276.355 3.507 20 10 CHCDRO Cc1ccc(O)c(C[N@H+](Cc2cccs2)C2CC2)c1 ZINC000130257608 1125358636 /nfs/dbraw/zinc/35/86/36/1125358636.db2.gz BEJJPCJDLPWKTG-UHFFFAOYSA-N 1 0 273.401 3.927 20 10 CHCDRO Cc1ccc([C@H](C)[N@H+](C)Cc2cc3c(cc2O)OCO3)cc1 ZINC000130814644 1125369155 /nfs/dbraw/zinc/36/91/55/1125369155.db2.gz KPJXYGCSZZYZQX-ZDUSSCGKSA-N 1 0 299.370 3.622 20 10 CHCDRO CC(=O)c1cc(F)cc(C[N@@H+]2CC[C@@H](C(C)(C)C)C2)c1O ZINC000131355801 1125388125 /nfs/dbraw/zinc/38/81/25/1125388125.db2.gz CHADITSYWFMZRV-CYBMUJFWSA-N 1 0 293.382 3.602 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1ccc(C)c(C)c1O)[C@@H]1CCCOC1 ZINC000883351890 1125399681 /nfs/dbraw/zinc/39/96/81/1125399681.db2.gz NYPAGTPCSQMZEL-INMHGKMJSA-N 1 0 291.435 3.865 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H]2CCC3(CCC3)O2)c(O)c1 ZINC000883357846 1125401248 /nfs/dbraw/zinc/40/12/48/1125401248.db2.gz WFKWOSWZGJCJEN-CABCVRRESA-N 1 0 289.419 3.761 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCC[C@]12CCCO2)c1ccc(N(C)C)cc1 ZINC000883367062 1125402102 /nfs/dbraw/zinc/40/21/02/1125402102.db2.gz GZXZDVWPRCWMBB-OLMNPRSZSA-N 1 0 288.435 3.505 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]C2(c3ccccc3)CCC2)c1 ZINC000171129234 1125403777 /nfs/dbraw/zinc/40/37/77/1125403777.db2.gz XWSFQJVAIYDEII-UHFFFAOYSA-N 1 0 297.398 3.960 20 10 CHCDRO C[C@@H](N[C@H](C)C(F)F)c1cccc(C(F)(F)F)c1O ZINC000883400747 1125408773 /nfs/dbraw/zinc/40/87/73/1125408773.db2.gz UHXKZBKBBAFBFU-RNFRBKRXSA-N 1 0 283.240 3.715 20 10 CHCDRO CCSCC[C@@H](C)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000132241494 1125416005 /nfs/dbraw/zinc/41/60/05/1125416005.db2.gz SPYVYFGMLXAJML-KGLIPLIRSA-N 1 0 280.481 3.935 20 10 CHCDRO C[C@@H]([NH2+]CCCSc1nccs1)C1CCCC1 ZINC000132296462 1125416760 /nfs/dbraw/zinc/41/67/60/1125416760.db2.gz IFQUCKQKXXFXMP-LLVKDONJSA-N 1 0 270.467 3.794 20 10 CHCDRO CC(C)(C[NH2+]Cc1cc(Cl)ccc1O)C1CCOCC1 ZINC000897452641 1125418134 /nfs/dbraw/zinc/41/81/34/1125418134.db2.gz XUNFCNMUXJQCFD-UHFFFAOYSA-N 1 0 297.826 3.588 20 10 CHCDRO Cc1cccc([C@@H]2CCC[N@@H+]2Cc2ccc(N)cc2)c1 ZINC001204849099 1125428993 /nfs/dbraw/zinc/42/89/93/1125428993.db2.gz XVBHUSWSXDHJBZ-SFHVURJKSA-N 1 0 266.388 3.914 20 10 CHCDRO CC[N@H+](Cc1ccc(N2CCCCC2)cc1)C1CC1 ZINC000133294647 1125444655 /nfs/dbraw/zinc/44/46/55/1125444655.db2.gz RPFAZORCRSJISB-UHFFFAOYSA-N 1 0 258.409 3.661 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H](C)C[C@H](C)CC)c1O ZINC000088293755 1129202294 /nfs/dbraw/zinc/20/22/94/1129202294.db2.gz KSWVVJXKNGNPHJ-OLZOCXBDSA-N 1 0 265.397 3.705 20 10 CHCDRO C[C@@H]([NH2+]CC(C1CC1)C1CC1)c1ccc(N(C)C)cc1 ZINC000088455419 1129205896 /nfs/dbraw/zinc/20/58/96/1129205896.db2.gz KTGZDEOSWCHGPM-CYBMUJFWSA-N 1 0 272.436 3.839 20 10 CHCDRO Cc1ccccc1C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000037719049 1129210094 /nfs/dbraw/zinc/21/00/94/1129210094.db2.gz SBOJCIVBZBKGBZ-OAHLLOKOSA-N 1 0 268.404 3.912 20 10 CHCDRO Cc1ccsc1C[NH2+][C@H]1CCc2cccc(O)c21 ZINC000295954955 1129220592 /nfs/dbraw/zinc/22/05/92/1129220592.db2.gz LTMYWYPVJUXYHH-LBPRGKRZSA-N 1 0 259.374 3.539 20 10 CHCDRO Cc1ccc(O)c(C[N@H+]2C[C@H](C)OC[C@H]2c2ccccc2)c1 ZINC000245773341 1129224709 /nfs/dbraw/zinc/22/47/09/1129224709.db2.gz SFCNRSSYPWFHJT-YJBOKZPZSA-N 1 0 297.398 3.663 20 10 CHCDRO Cc1cc(C[N@H+](C)CCc2ccccc2)ccc1N(C)C ZINC001139670198 1131359741 /nfs/dbraw/zinc/35/97/41/1131359741.db2.gz ZMDKZSQZLFHLJR-UHFFFAOYSA-N 1 0 282.431 3.736 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]CC(C)(C)Oc2ccccc2)c1 ZINC000734160992 1129296740 /nfs/dbraw/zinc/29/67/40/1129296740.db2.gz JQQUJMGPSLFQBK-UHFFFAOYSA-N 1 0 285.387 3.648 20 10 CHCDRO CCCN(CCC)c1ccc(C[NH2+][C@@H](C)C(C)(C)O)cc1 ZINC000734841479 1129324647 /nfs/dbraw/zinc/32/46/47/1129324647.db2.gz PTIAUQANYRUUKR-HNNXBMFYSA-N 1 0 292.467 3.562 20 10 CHCDRO c1ccc2c(c1)CC[C@@H](C[NH2+]Cc1ccc3c(c1)CCO3)C2 ZINC000735324670 1129338929 /nfs/dbraw/zinc/33/89/29/1129338929.db2.gz ZXUREISPAOVZLM-OAHLLOKOSA-N 1 0 293.410 3.516 20 10 CHCDRO CCOC1CC[NH+](Cc2ccc(N(CC)CC)cc2)CC1 ZINC000091679472 1129368591 /nfs/dbraw/zinc/36/85/91/1129368591.db2.gz BGOIRWKZEYJXON-UHFFFAOYSA-N 1 0 290.451 3.534 20 10 CHCDRO CN(C)c1ccc(C[NH2+]CCCC(C)(C)C)cc1F ZINC000740013283 1129410609 /nfs/dbraw/zinc/41/06/09/1129410609.db2.gz CCYBHBDISRFSAG-UHFFFAOYSA-N 1 0 266.404 3.808 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCCO[C@H]1C(C)(C)C)c1ccccc1O ZINC000248384709 1129416085 /nfs/dbraw/zinc/41/60/85/1129416085.db2.gz FUYHNKXYKIWXAJ-GRDNDAEWSA-N 1 0 291.435 3.884 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCO[C@H]2c2ccccc2)c(O)c1 ZINC000248481606 1129419546 /nfs/dbraw/zinc/41/95/46/1129419546.db2.gz BHUVLOJXLZIGLF-YJLNNSPDSA-N 1 0 297.398 3.881 20 10 CHCDRO CCO[C@@H]1C[C@H]([NH2+][C@H](C)c2ccc(C)cc2O)C12CCC2 ZINC000248484964 1129419825 /nfs/dbraw/zinc/41/98/25/1129419825.db2.gz DQXOMZZTRKUNTH-XOKHGSTOSA-N 1 0 289.419 3.699 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]C[C@H]2C[C@H]2c2ccccc2)c1 ZINC000248525346 1129420268 /nfs/dbraw/zinc/42/02/68/1129420268.db2.gz ULOXNRDAIYBAJR-JOQOYGCGSA-N 1 0 297.398 3.855 20 10 CHCDRO CCCO[C@H]1CCC[N@H+](Cc2cc(C)c(C)cc2O)CC1 ZINC000093317056 1129421309 /nfs/dbraw/zinc/42/13/09/1129421309.db2.gz NYMKFXDBXHUROR-KRWDZBQOSA-N 1 0 291.435 3.790 20 10 CHCDRO CO[C@H]1C[C@@H]([N@H+](C)Cc2cc(C)cc(C(C)(C)C)c2O)C1 ZINC000795672831 1129423995 /nfs/dbraw/zinc/42/39/95/1129423995.db2.gz AWTYKFPVSPGPFE-GASCZTMLSA-N 1 0 291.435 3.607 20 10 CHCDRO Cc1cc(C)cc(CC[NH2+]Cc2ccc3c(c2)CCO3)c1 ZINC000740899839 1129424105 /nfs/dbraw/zinc/42/41/05/1129424105.db2.gz FNKFEWAPYCSGHZ-UHFFFAOYSA-N 1 0 281.399 3.571 20 10 CHCDRO C[C@H](CCc1ccco1)[NH2+][C@H](C)c1cc(F)ccc1O ZINC000094616936 1129448283 /nfs/dbraw/zinc/44/82/83/1129448283.db2.gz LAPWQKLJMSSDPI-VXGBXAGGSA-N 1 0 277.339 3.796 20 10 CHCDRO COc1ccc(C[NH2+]Cc2cscc2C)cc1C ZINC000094877282 1129455134 /nfs/dbraw/zinc/45/51/34/1129455134.db2.gz UMRVMNHMPUMTEO-UHFFFAOYSA-N 1 0 261.390 3.663 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H](C)CCc2ccco2)cc1C ZINC000742366364 1129472018 /nfs/dbraw/zinc/47/20/18/1129472018.db2.gz ZBUYBSFRFHAKGH-AWEZNQCLSA-N 1 0 273.376 3.713 20 10 CHCDRO COc1ccc(C[NH2+]Cc2c(C)cccc2F)cc1C ZINC000742381585 1129473011 /nfs/dbraw/zinc/47/30/11/1129473011.db2.gz YFXZUGAGVRCYBK-UHFFFAOYSA-N 1 0 273.351 3.741 20 10 CHCDRO CCCN(CCC)c1ccc(C[NH2+]CC(C)(C)OC)cc1 ZINC000742380994 1129473115 /nfs/dbraw/zinc/47/31/15/1129473115.db2.gz USBZQUCTGKKLKF-UHFFFAOYSA-N 1 0 292.467 3.828 20 10 CHCDRO Cc1cccc(F)c1C[NH2+]Cc1cc(Cl)ccc1O ZINC000742381192 1129473140 /nfs/dbraw/zinc/47/31/40/1129473140.db2.gz RBBBUJLXTIQGAT-UHFFFAOYSA-N 1 0 279.742 3.783 20 10 CHCDRO c1cc(C[NH2+][C@@H]2C[C@H]2C2CCCCC2)cc2c1OCC2 ZINC000742375411 1129475252 /nfs/dbraw/zinc/47/52/52/1129475252.db2.gz MHPMXCKHLQIRHO-DLBZAZTESA-N 1 0 271.404 3.680 20 10 CHCDRO CCOCc1cc(C[NH2+]C(C)(C)C2CC2)ccc1OC ZINC000742372814 1129475552 /nfs/dbraw/zinc/47/55/52/1129475552.db2.gz IARVBTVBOHWFQN-UHFFFAOYSA-N 1 0 277.408 3.510 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2C[C@H]2Cc2ccccc2)cc1F ZINC000742375694 1129475620 /nfs/dbraw/zinc/47/56/20/1129475620.db2.gz VRGTVGBAIYLAGI-SJLPKXTDSA-N 1 0 298.405 3.613 20 10 CHCDRO c1cc(C[NH2+][C@@H]2CC[C@H]3CCC[C@H]3C2)cc2c1OCC2 ZINC000742379335 1129476011 /nfs/dbraw/zinc/47/60/11/1129476011.db2.gz VNAOUZLLABGIDP-HLLBOEOZSA-N 1 0 271.404 3.680 20 10 CHCDRO CCCCC[C@@H](CCC)[NH2+]Cc1ccc(O)c(O)c1 ZINC001258664711 1129476425 /nfs/dbraw/zinc/47/64/25/1129476425.db2.gz PVYKVCRUHIKTHO-CQSZACIVSA-N 1 0 265.397 3.936 20 10 CHCDRO CC[N@H+](Cc1c(O)ccc2ccncc21)[C@H](C)C(C)C ZINC000742549993 1129487386 /nfs/dbraw/zinc/48/73/86/1129487386.db2.gz JWAVMOJGXPFTQW-CYBMUJFWSA-N 1 0 272.392 3.807 20 10 CHCDRO Oc1cc2c(cc1C[N@@H+]1CCC3(CCCC3)C1)CCC2 ZINC000743391085 1129522274 /nfs/dbraw/zinc/52/22/74/1129522274.db2.gz WLULGTGLLBELMO-UHFFFAOYSA-N 1 0 271.404 3.647 20 10 CHCDRO CCOc1cccc(C[N@H+](C)C2(C)CCCC2)c1O ZINC000720386357 1129526675 /nfs/dbraw/zinc/52/66/75/1129526675.db2.gz AXXYPLXWMQUGLJ-UHFFFAOYSA-N 1 0 263.381 3.555 20 10 CHCDRO Cc1ccc(C[C@H](C)[NH2+]Cc2ccc3c(c2)CCO3)c(C)c1 ZINC000303289514 1129538783 /nfs/dbraw/zinc/53/87/83/1129538783.db2.gz AUQWPFRZEDHTGM-INIZCTEOSA-N 1 0 295.426 3.959 20 10 CHCDRO CCC[N@H+](CCOCCC(C)C)Cc1ccccc1O ZINC000743870540 1129542251 /nfs/dbraw/zinc/54/22/51/1129542251.db2.gz WTFKGKCVFWTIDU-UHFFFAOYSA-N 1 0 279.424 3.667 20 10 CHCDRO CCSCCC[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000305690545 1129659219 /nfs/dbraw/zinc/65/92/19/1129659219.db2.gz DZSUZDHKEBGRFB-ZDUSSCGKSA-N 1 0 266.454 3.546 20 10 CHCDRO CC[N@@H+](Cc1cc(C(C)C)c(C)cc1O)C[C@@H]1CCOC1 ZINC000738082185 1129665177 /nfs/dbraw/zinc/66/51/77/1129665177.db2.gz PFFFNAVOGXWGMP-HNNXBMFYSA-N 1 0 291.435 3.682 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H]2CCCSC2)cc1 ZINC000766447648 1129666338 /nfs/dbraw/zinc/66/63/38/1129666338.db2.gz XPPYVOAACQBALM-HIFRSBDPSA-N 1 0 278.465 3.689 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](C)c1ccncc1)c1ccc(N(C)C)cc1 ZINC000766487763 1129669625 /nfs/dbraw/zinc/66/96/25/1129669625.db2.gz KDTPGLNDDNOZMD-DNVCBOLYSA-N 1 0 297.446 3.992 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](C)Cc2ccncc2)cc1 ZINC000766488510 1129669692 /nfs/dbraw/zinc/66/96/92/1129669692.db2.gz JPRPKPHATBGPDQ-JKSUJKDBSA-N 1 0 297.446 3.820 20 10 CHCDRO CSC1CCC(C[NH2+][C@H](C)c2ccccc2O)CC1 ZINC000720605406 1129670515 /nfs/dbraw/zinc/67/05/15/1129670515.db2.gz CEDQVNAHSKCVBI-IYXRBSQSSA-N 1 0 279.449 3.965 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](O)[C@H](C)c1ccccc1)c1ccccc1O ZINC000828687178 1131396057 /nfs/dbraw/zinc/39/60/57/1131396057.db2.gz GCAQSEAIYRPXCC-LJHODMEESA-N 1 0 299.414 3.598 20 10 CHCDRO CC(C)C[C@H](Cc1ccccc1)[NH2+]Cc1ccc(O)cc1O ZINC001169059530 1129693616 /nfs/dbraw/zinc/69/36/16/1129693616.db2.gz RDCXOMRZBBJZTP-QGZVFWFLSA-N 1 0 299.414 3.845 20 10 CHCDRO CNc1ccccc1N[C@@H]1CC(C)(C)C[C@@](C)(C[NH3+])C1 ZINC001169152408 1129705430 /nfs/dbraw/zinc/70/54/30/1129705430.db2.gz PNTJLNLSYZUNAO-DYVFJYSZSA-N 1 0 275.440 3.684 20 10 CHCDRO C[C@@H]([NH2+]CC1(C)CC(F)(F)C1)c1cc(F)ccc1O ZINC000720911171 1129720788 /nfs/dbraw/zinc/72/07/88/1129720788.db2.gz HJMMOHRTANERMT-SECBINFHSA-N 1 0 273.298 3.617 20 10 CHCDRO CC[N@H+](Cc1sccc1C)Cc1ccccc1O ZINC001204024430 1129723683 /nfs/dbraw/zinc/72/36/83/1129723683.db2.gz XAPOLWBVMUZLTH-UHFFFAOYSA-N 1 0 261.390 3.784 20 10 CHCDRO CC1(C[NH2+]Cc2c(O)cccc2Cl)CC(F)(F)C1 ZINC000720976493 1129731963 /nfs/dbraw/zinc/73/19/63/1129731963.db2.gz FTYVWBVWSOJGDV-UHFFFAOYSA-N 1 0 275.726 3.571 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(NCC[C@H]2CCC[NH2+]2)cc1 ZINC001169563823 1129737139 /nfs/dbraw/zinc/73/71/39/1129737139.db2.gz BRZVOTKRHCPFEV-MRXNPFEDSA-N 1 0 283.419 3.648 20 10 CHCDRO CC/C=C/CC[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1 ZINC000767339064 1129785871 /nfs/dbraw/zinc/78/58/71/1129785871.db2.gz SGVLVEAGZAFALP-DWTRPJMMSA-N 1 0 288.435 3.530 20 10 CHCDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]CCCF ZINC000767927982 1129822382 /nfs/dbraw/zinc/82/23/82/1129822382.db2.gz SHBOHQJFNXPLKG-UHFFFAOYSA-N 1 0 259.324 3.508 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cc(C)cs2)c1 ZINC000380898112 1129832957 /nfs/dbraw/zinc/83/29/57/1129832957.db2.gz MQOAJBLFWRVCNO-LLVKDONJSA-N 1 0 277.389 3.622 20 10 CHCDRO COc1cccc(O)c1C[N@@H+]1CCC[C@@H]1c1cccs1 ZINC000768194815 1129842133 /nfs/dbraw/zinc/84/21/33/1129842133.db2.gz FFHNPVKEOBHAGR-CYBMUJFWSA-N 1 0 289.400 3.799 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](C)[C@H]2CCc3ccccc32)c1 ZINC000768233233 1129845419 /nfs/dbraw/zinc/84/54/19/1129845419.db2.gz LZWQFWSBRCLFLM-SFHVURJKSA-N 1 0 297.398 3.910 20 10 CHCDRO COc1cccc(O)c1C[N@H+](C)[C@H]1CCc2ccccc21 ZINC000768233698 1129845909 /nfs/dbraw/zinc/84/59/09/1129845909.db2.gz PJUCLLHWZBIIKE-INIZCTEOSA-N 1 0 283.371 3.520 20 10 CHCDRO CO[C@@H](C[NH2+][C@@H](C)c1ccc2ccccc2c1O)C(C)C ZINC000381772518 1129849386 /nfs/dbraw/zinc/84/93/86/1129849386.db2.gz JSJFABCDZQQAGY-GUYCJALGSA-N 1 0 287.403 3.867 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCC[C@@H]2c2ccccn2)c1O ZINC000768354144 1129853981 /nfs/dbraw/zinc/85/39/81/1129853981.db2.gz FPFHJKHWDUVJJZ-MRXNPFEDSA-N 1 0 298.386 3.523 20 10 CHCDRO COc1cccc(C[NH2+][C@H](C)[C@@H]2CC3CCC2CC3)c1O ZINC000382126143 1129854605 /nfs/dbraw/zinc/85/46/05/1129854605.db2.gz MFADNZJWMDQRGP-WOICTCIZSA-N 1 0 289.419 3.705 20 10 CHCDRO Oc1cc(Br)ccc1C[NH2+]C1(C2CCC2)CC1 ZINC000691456326 1129858987 /nfs/dbraw/zinc/85/89/87/1129858987.db2.gz SMSSFPTVNYAFIE-UHFFFAOYSA-N 1 0 296.208 3.577 20 10 CHCDRO Cc1cc(Cl)nc(C[NH2+]Cc2cc(Cl)ccc2O)c1 ZINC000800284995 1129864024 /nfs/dbraw/zinc/86/40/24/1129864024.db2.gz SCMGMBSWSKXAMT-UHFFFAOYSA-N 1 0 297.185 3.692 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]CCc2cccc3[nH]ccc32)c1 ZINC000800296356 1129865360 /nfs/dbraw/zinc/86/53/60/1129865360.db2.gz LOEVBYRHSBDGRL-UHFFFAOYSA-N 1 0 280.371 3.514 20 10 CHCDRO CC(C)[N@@H+](Cc1ccc(N(C)C)c(F)c1)CC1CC1 ZINC000768673086 1129868302 /nfs/dbraw/zinc/86/83/02/1129868302.db2.gz IDFMVSNGSPKSSX-UHFFFAOYSA-N 1 0 264.388 3.512 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]CCc1ccccc1F ZINC000768692298 1129868820 /nfs/dbraw/zinc/86/88/20/1129868820.db2.gz ZRDZYASGIAMVRU-UHFFFAOYSA-N 1 0 286.394 3.532 20 10 CHCDRO C[C@]12C[C@H]1CCC[C@H]2[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000800476155 1129875745 /nfs/dbraw/zinc/87/57/45/1129875745.db2.gz IKDZYHRJJKWZEI-QRQLOZEOSA-N 1 0 284.447 3.955 20 10 CHCDRO C[C@]12C[C@H]1CCC[C@@H]2[NH2+]CCCSc1nccs1 ZINC000800479991 1129876466 /nfs/dbraw/zinc/87/64/66/1129876466.db2.gz MIBXMPOMHFQZBO-DYEKYZERSA-N 1 0 282.478 3.794 20 10 CHCDRO C[N@H+](Cc1cccc2c1OC(C)(C)C2)Cc1ccccc1O ZINC000768872091 1129877678 /nfs/dbraw/zinc/87/76/78/1129877678.db2.gz CCXYUDZZPSNMSG-UHFFFAOYSA-N 1 0 297.398 3.738 20 10 CHCDRO C/C(=C/c1ccccc1)C[N@@H+](C)Cc1ccccc1O ZINC000768873616 1129878350 /nfs/dbraw/zinc/87/83/50/1129878350.db2.gz RTDMJXPEMJFOQA-QINSGFPZSA-N 1 0 267.372 3.928 20 10 CHCDRO CCSCCC[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000800492108 1129879067 /nfs/dbraw/zinc/87/90/67/1129879067.db2.gz BXSQCQSGCQTLTB-PWSUYJOCSA-N 1 0 283.412 3.812 20 10 CHCDRO CCSCCC[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000800492519 1129878988 /nfs/dbraw/zinc/87/89/88/1129878988.db2.gz KBWYKVULAHMKAB-CYBMUJFWSA-N 1 0 267.438 3.803 20 10 CHCDRO CC[C@@H]([NH2+]CC1(COC)CCC1)c1ccc(N(C)C)cc1 ZINC000800492589 1129880576 /nfs/dbraw/zinc/88/05/76/1129880576.db2.gz MOJKFPSUHFSTKR-QGZVFWFLSA-N 1 0 290.451 3.610 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CCC[C@@H]3CCC[C@H]32)c(O)c1 ZINC000769102526 1129889573 /nfs/dbraw/zinc/88/95/73/1129889573.db2.gz OLAOKXHOLFKVDL-XJKSGUPXSA-N 1 0 275.392 3.555 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(O)cc2)cc1 ZINC000769107654 1129891772 /nfs/dbraw/zinc/89/17/72/1129891772.db2.gz ZAEFMDSECPKOPH-LJQANCHMSA-N 1 0 296.414 3.795 20 10 CHCDRO COc1ccc(C[NH2+]CC(C)(C)C(F)(F)F)cc1C ZINC000800890014 1129896650 /nfs/dbraw/zinc/89/66/50/1129896650.db2.gz ZPDIOKBUVPHYEP-UHFFFAOYSA-N 1 0 275.314 3.682 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2[C@H](C)C[C@@H]3CCCC[C@@H]32)c1 ZINC000769404170 1129907081 /nfs/dbraw/zinc/90/70/81/1129907081.db2.gz KCPOFQSWTJOMMY-KEYYUXOJSA-N 1 0 289.419 3.944 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC[C@@H](Cc3ccc(F)cc3)C2)c1 ZINC000769426124 1129907543 /nfs/dbraw/zinc/90/75/43/1129907543.db2.gz MRBWFHXZWCEBTH-INIZCTEOSA-N 1 0 299.389 3.904 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC3(CCCC3)C2)cc1 ZINC000769395125 1129908933 /nfs/dbraw/zinc/90/89/33/1129908933.db2.gz MTQNWEFKJPHFSQ-UHFFFAOYSA-N 1 0 258.409 3.519 20 10 CHCDRO CC[C@@H](Cc1ccccc1)[N@H+](C)Cc1c(O)cccc1OC ZINC000769488608 1129909376 /nfs/dbraw/zinc/90/93/76/1129909376.db2.gz GKAOMZDUAPQNFK-INIZCTEOSA-N 1 0 299.414 3.854 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2Cc3ccccc3C[C@H]2C)c1 ZINC000769483818 1129909457 /nfs/dbraw/zinc/90/94/57/1129909457.db2.gz SHMYDLXDEMEXEH-CQSZACIVSA-N 1 0 297.398 3.738 20 10 CHCDRO CC[C@H](C)[C@@H]1CCCC[N@@H+]1Cc1cccc(OC)c1O ZINC000769466982 1129911643 /nfs/dbraw/zinc/91/16/43/1129911643.db2.gz RRQWXLZEPHOYEJ-ZFWWWQNUSA-N 1 0 277.408 3.801 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CCOC2(CCCCC2)C1 ZINC000769491762 1129913464 /nfs/dbraw/zinc/91/34/64/1129913464.db2.gz ASFKEPHAMXGFSQ-UHFFFAOYSA-N 1 0 295.810 3.581 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CC[C@@H]2Cc2ccccc2)c(O)c1 ZINC000769506171 1129913878 /nfs/dbraw/zinc/91/38/78/1129913878.db2.gz NIYWPBHKUWHWGZ-QGZVFWFLSA-N 1 0 297.398 3.608 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CC[C@@H]2Cc2ccccc2)cc1 ZINC000769506807 1129914525 /nfs/dbraw/zinc/91/45/25/1129914525.db2.gz WTSWNFBXRPGWJN-LJQANCHMSA-N 1 0 280.415 3.570 20 10 CHCDRO CCC[C@H]1[C@@H](C)CCC[N@@H+]1Cc1cccc(OC)c1O ZINC000769507492 1129914906 /nfs/dbraw/zinc/91/49/06/1129914906.db2.gz LXUUFHQTFWOPBG-ZFWWWQNUSA-N 1 0 277.408 3.801 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CC[C@H]1Cc1ccccc1 ZINC000769506890 1129915169 /nfs/dbraw/zinc/91/51/69/1129915169.db2.gz XZASGVIFVQRJOO-AWEZNQCLSA-N 1 0 287.790 3.863 20 10 CHCDRO CCC[C@H](C)[C@H]1CCC[N@@H+]1Cc1c(O)cccc1OC ZINC000769536641 1129916295 /nfs/dbraw/zinc/91/62/95/1129916295.db2.gz CEAKINSKSOFHON-DZGCQCFKSA-N 1 0 277.408 3.801 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CC[C@@H]2C[C@@H](C)O[C@@H](C)C2)cc1C ZINC000801730108 1129940819 /nfs/dbraw/zinc/94/08/19/1129940819.db2.gz FMVZCNGVSYMCPN-MUJYYYPQSA-N 1 0 291.435 3.692 20 10 CHCDRO CCOc1cccc(C[N@H+]2CC=C(C(C)(C)C)CC2)c1O ZINC000770382475 1129944821 /nfs/dbraw/zinc/94/48/21/1129944821.db2.gz FQDQGEOSTYGONL-UHFFFAOYSA-N 1 0 289.419 3.969 20 10 CHCDRO c1cc(N2CCCCC2)ccc1C[N@H+]1[C@H]2C=CC[C@@H]1CC2 ZINC000770382045 1129945064 /nfs/dbraw/zinc/94/50/64/1129945064.db2.gz LTDTYINNMRLQBQ-RBUKOAKNSA-N 1 0 282.431 3.970 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CC[C@H](c2ccccc2F)C1 ZINC000770511022 1129948829 /nfs/dbraw/zinc/94/88/29/1129948829.db2.gz VRSQMNOOIDXNTM-ZDUSSCGKSA-N 1 0 271.335 3.521 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]CC2(Cc3ccc(F)cc3)CC2)c1 ZINC000770741176 1129958655 /nfs/dbraw/zinc/95/86/55/1129958655.db2.gz KTVCDTCJYKSBSK-UHFFFAOYSA-N 1 0 299.389 3.952 20 10 CHCDRO CCc1cccc(C[NH2+]Cc2ccc(C)cc2)c1O ZINC000691503754 1129981552 /nfs/dbraw/zinc/98/15/52/1129981552.db2.gz GUODOSSWGWXWGE-UHFFFAOYSA-N 1 0 255.361 3.553 20 10 CHCDRO CCNc1ccccc1C[NH2+]Cc1ccc(N(C)C)cc1C ZINC000902246345 1129993504 /nfs/dbraw/zinc/99/35/04/1129993504.db2.gz XKSPMJQDVYVDRB-UHFFFAOYSA-N 1 0 297.446 3.783 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CC[C@@H]2c2ccccc2)c1O ZINC000771938447 1129997289 /nfs/dbraw/zinc/99/72/89/1129997289.db2.gz LTJLQJIVBULNAO-MRXNPFEDSA-N 1 0 283.371 3.738 20 10 CHCDRO CCCC[N@H+](Cc1ccc(C)nc1)Cc1ccccc1O ZINC000802657791 1130028304 /nfs/dbraw/zinc/02/83/04/1130028304.db2.gz SMPUGHHFJIZJFD-UHFFFAOYSA-N 1 0 284.403 3.898 20 10 CHCDRO CN(C)c1ccc(C[NH+]2CCC(c3cccnc3)CC2)cc1 ZINC000785762081 1130054248 /nfs/dbraw/zinc/05/42/48/1130054248.db2.gz CANVLTDEXNSDHV-UHFFFAOYSA-N 1 0 295.430 3.527 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2nccc3c2CCCC3)c1 ZINC000903182396 1130125010 /nfs/dbraw/zinc/12/50/10/1130125010.db2.gz QAOFZRSKFHZSFA-AWEZNQCLSA-N 1 0 296.414 3.825 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC(C)(C)C2CCOCC2)c(O)c1 ZINC000903244621 1130134684 /nfs/dbraw/zinc/13/46/84/1130134684.db2.gz ZYIVVOYFGURBAH-CQSZACIVSA-N 1 0 291.435 3.804 20 10 CHCDRO COC(C)(C)CC[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000787185176 1130138622 /nfs/dbraw/zinc/13/86/22/1130138622.db2.gz XQYCJRHYQPYINP-UHFFFAOYSA-N 1 0 290.451 3.532 20 10 CHCDRO CC[C@H]([NH2+]C1CC2(C1)CO[C@@H](C)C2)c1ccc(C)cc1O ZINC000903281489 1130145422 /nfs/dbraw/zinc/14/54/22/1130145422.db2.gz HDUOXBVIZDKHGH-QBPRILJRSA-N 1 0 289.419 3.699 20 10 CHCDRO C[C@@H]([NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F)c1cncs1 ZINC000903310523 1130150762 /nfs/dbraw/zinc/15/07/62/1130150762.db2.gz KKQCHXIUBLRRBS-KKZNHRDASA-N 1 0 292.379 3.887 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H](c2ccccn2)C2CC2)c(O)c1 ZINC000903335662 1130160311 /nfs/dbraw/zinc/16/03/11/1130160311.db2.gz RLCUJRDYZSFQNQ-UGSOOPFHSA-N 1 0 282.387 3.898 20 10 CHCDRO CC[C@H]([NH2+][C@H](c1ccccn1)C1CC1)c1ccccc1O ZINC000903335474 1130160831 /nfs/dbraw/zinc/16/08/31/1130160831.db2.gz QEPGTBCKIVXGFG-YJBOKZPZSA-N 1 0 282.387 3.979 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CC[C@@H](c3ccccc3)C2)cc1C ZINC000746716706 1130166970 /nfs/dbraw/zinc/16/69/70/1130166970.db2.gz RAADEPRETVNHDZ-QGZVFWFLSA-N 1 0 281.399 3.999 20 10 CHCDRO C[C@@H]([NH2+][C@H](c1ccncc1)C1CC1)c1ccc(N(C)C)cc1 ZINC000903428998 1130175492 /nfs/dbraw/zinc/17/54/92/1130175492.db2.gz RLJKIOVSNVAQHK-KUHUBIRLSA-N 1 0 295.430 3.950 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H](c2ccncc2)C2CC2)c1O ZINC000903428859 1130175581 /nfs/dbraw/zinc/17/55/81/1130175581.db2.gz LVIJKPCKWCOLNY-SJCJKPOMSA-N 1 0 298.386 3.598 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@H](c1ccncc1)C1CC1)CC2 ZINC000903427471 1130175944 /nfs/dbraw/zinc/17/59/44/1130175944.db2.gz GMCJOCAICSEJEC-QAPCUYQASA-N 1 0 280.371 3.515 20 10 CHCDRO CC1(C)CC[N@H+](Cc2cc3c(cc2O)CCC3)CCS1 ZINC000788376917 1130184512 /nfs/dbraw/zinc/18/45/12/1130184512.db2.gz PLZISWSNGOZNFY-UHFFFAOYSA-N 1 0 291.460 3.598 20 10 CHCDRO C[C@@H]1C[C@H]1C[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000788442235 1130186495 /nfs/dbraw/zinc/18/64/95/1130186495.db2.gz BVEWQVWMOBQWPA-WBVHZDCISA-N 1 0 272.436 3.765 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CCc2cccs2)c(O)c1 ZINC000788506574 1130192196 /nfs/dbraw/zinc/19/21/96/1130192196.db2.gz WHCZVBYMFXIDDM-CYBMUJFWSA-N 1 0 275.417 3.964 20 10 CHCDRO CSC1(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)CC1 ZINC000788605161 1130197539 /nfs/dbraw/zinc/19/75/39/1130197539.db2.gz GUPJLLXXBOIDBH-GXSJLCMTSA-N 1 0 281.396 3.565 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CCO[C@@H](C(C)C)C2)c(O)c1 ZINC000788652989 1130197945 /nfs/dbraw/zinc/19/79/45/1130197945.db2.gz UREWTZPVQNENES-ZMSDIMECSA-N 1 0 291.435 3.863 20 10 CHCDRO CCC1(O)CCC([NH2+][C@H](C)c2c(C)cc(C)cc2O)CC1 ZINC000788646456 1130198408 /nfs/dbraw/zinc/19/84/08/1130198408.db2.gz CRWVJFSBRVNHTH-KSTDHSDQSA-N 1 0 291.435 3.743 20 10 CHCDRO CC[C@H]([NH2+]CCSCC(C)C)c1ccccc1O ZINC000397388032 1130216668 /nfs/dbraw/zinc/21/66/68/1130216668.db2.gz IQSJLGFYKLJFOA-AWEZNQCLSA-N 1 0 267.438 3.822 20 10 CHCDRO CCOC[C@H]([NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F)C(C)C ZINC000788985784 1130221720 /nfs/dbraw/zinc/22/17/20/1130221720.db2.gz RXMTXMLFOVTWCR-XBFCOCLRSA-N 1 0 295.398 3.730 20 10 CHCDRO CCOC[C@H]([NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F)C(C)C ZINC000788985782 1130222207 /nfs/dbraw/zinc/22/22/07/1130222207.db2.gz RXMTXMLFOVTWCR-BNOWGMLFSA-N 1 0 295.398 3.730 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]CCCCOC(C)(C)C)c1 ZINC000789360525 1130247574 /nfs/dbraw/zinc/24/75/74/1130247574.db2.gz DBFDZZVFEXEAMP-CYBMUJFWSA-N 1 0 295.423 3.647 20 10 CHCDRO CC[C@@H](COCC1CC1)[NH2+]Cc1ccc2ccccc2c1O ZINC000826868357 1130299101 /nfs/dbraw/zinc/29/91/01/1130299101.db2.gz ROMBYSSEGGQIOR-KRWDZBQOSA-N 1 0 299.414 3.840 20 10 CHCDRO COCC[N@H+](Cc1cc(C)cc(C)c1O)[C@@H]1CC[C@H](C)C1 ZINC000790480601 1130314943 /nfs/dbraw/zinc/31/49/43/1130314943.db2.gz SNPRJYXNZMWEJL-SUMWQHHRSA-N 1 0 291.435 3.646 20 10 CHCDRO COCC[N@H+](Cc1cc(C)cc(C)c1O)[C@@H]1CC[C@@H](C)C1 ZINC000790480598 1130315106 /nfs/dbraw/zinc/31/51/06/1130315106.db2.gz SNPRJYXNZMWEJL-CXAGYDPISA-N 1 0 291.435 3.646 20 10 CHCDRO CC(C)=CC[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000790698570 1130326439 /nfs/dbraw/zinc/32/64/39/1130326439.db2.gz PIUNMRZTTGARML-ZDUSSCGKSA-N 1 0 259.393 3.888 20 10 CHCDRO CC(C)C1(C[NH2+]Cc2c([O-])ccc(Cl)c2F)CC1 ZINC000790973599 1130343690 /nfs/dbraw/zinc/34/36/90/1130343690.db2.gz ONDXITCENMDQPK-UHFFFAOYSA-N 1 0 271.763 3.711 20 10 CHCDRO Cc1cccc(F)c1C[NH2+]Cc1c([O-])ccc(Cl)c1F ZINC000790971948 1130343858 /nfs/dbraw/zinc/34/38/58/1130343858.db2.gz BIGSHYMKZNMXHI-UHFFFAOYSA-N 1 0 297.732 3.922 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCc3cc(C)ccc3C2)c1 ZINC000792181621 1130437931 /nfs/dbraw/zinc/43/79/31/1130437931.db2.gz SYKMNMKNXRTXEY-UHFFFAOYSA-N 1 0 267.372 3.567 20 10 CHCDRO CCC[N@H+](C)Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000792777580 1130498366 /nfs/dbraw/zinc/49/83/66/1130498366.db2.gz PBGXFTNJXALKOI-UHFFFAOYSA-N 1 0 274.330 3.613 20 10 CHCDRO CCCC[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000792895070 1130505238 /nfs/dbraw/zinc/50/52/38/1130505238.db2.gz LOOPFVAYIMWICD-UHFFFAOYSA-N 1 0 274.330 3.661 20 10 CHCDRO C[C@H]1C[C@H]1C[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000792917832 1130506698 /nfs/dbraw/zinc/50/66/98/1130506698.db2.gz LNYSNFDRCFFLKZ-JQWIXIFHSA-N 1 0 286.341 3.517 20 10 CHCDRO COc1ccc([C@H](C)[C@H](C)[NH2+]Cc2cc(C)ccc2O)cc1 ZINC000747100326 1130517471 /nfs/dbraw/zinc/51/74/71/1130517471.db2.gz XCDORORDGGZGOB-CABCVRRESA-N 1 0 299.414 3.991 20 10 CHCDRO C[C@@H]1C[C@@H](C)[NH+]1Cc1ccc(OCc2ccccc2)cc1O ZINC000793220979 1130530825 /nfs/dbraw/zinc/53/08/25/1130530825.db2.gz SQGHDGHBEMGUHD-HUUCEWRRSA-N 1 0 297.398 3.954 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CCc2cccc(C)n2)cc1 ZINC000793213610 1130530925 /nfs/dbraw/zinc/53/09/25/1130530925.db2.gz WXXCHJDBVFCESA-UHFFFAOYSA-N 1 0 297.446 3.569 20 10 CHCDRO CCC[C@H]([NH2+]Cc1cccc(C)c1O)[C@@H](O)c1ccccc1 ZINC000793237935 1130532834 /nfs/dbraw/zinc/53/28/34/1130532834.db2.gz HFIGVNGLPBENJM-HKUYNNGSSA-N 1 0 299.414 3.693 20 10 CHCDRO CCC[C@@H]([NH2+]Cc1cc(C)ccc1O)[C@H](O)c1ccccc1 ZINC000793245514 1130536235 /nfs/dbraw/zinc/53/62/35/1130536235.db2.gz YBZPLFWXNFNTPD-IEBWSBKVSA-N 1 0 299.414 3.693 20 10 CHCDRO COC(C)(C)C[N@H+](C)Cc1cc(C(C)C)c(C)cc1O ZINC000758405162 1130610738 /nfs/dbraw/zinc/61/07/38/1130610738.db2.gz NGIKAIUAAYMWQB-UHFFFAOYSA-N 1 0 279.424 3.681 20 10 CHCDRO COc1ccc(O)c(C[NH2+]Cc2ccc3sccc3c2)c1 ZINC000811510017 1130618231 /nfs/dbraw/zinc/61/82/31/1130618231.db2.gz QNJRAZGOIQSONG-UHFFFAOYSA-N 1 0 299.395 3.905 20 10 CHCDRO Cc1ccc(C(C)(C)[NH2+]Cc2cc(C)c(C)cc2O)cn1 ZINC000759183909 1130642136 /nfs/dbraw/zinc/64/21/36/1130642136.db2.gz DAZHGXSWSUEQSU-UHFFFAOYSA-N 1 0 284.403 3.737 20 10 CHCDRO CC(C)[N@H+](Cc1c(O)ccc2ccccc21)[C@H]1CCOC1 ZINC000812291303 1130681590 /nfs/dbraw/zinc/68/15/90/1130681590.db2.gz MOYBBXMMUTXBAD-HNNXBMFYSA-N 1 0 285.387 3.545 20 10 CHCDRO COc1ccc(C[NH2+]C(C)(C)CC(F)(F)F)cc1C ZINC000780587450 1130685642 /nfs/dbraw/zinc/68/56/42/1130685642.db2.gz NHBRLYQXBSZPJI-UHFFFAOYSA-N 1 0 275.314 3.824 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)[C@@H]1CCCOC1)c1ccc(N(C)C)cc1 ZINC000780743979 1130689628 /nfs/dbraw/zinc/68/96/28/1130689628.db2.gz CHZVOSWWZXFFLV-LESCRADOSA-N 1 0 290.451 3.608 20 10 CHCDRO C[N@H+](Cc1cccc(-c2ccccc2)c1O)[C@@H]1CCCOC1 ZINC001235000292 1130699654 /nfs/dbraw/zinc/69/96/54/1130699654.db2.gz QENFVDXHWUYBAX-QGZVFWFLSA-N 1 0 297.398 3.670 20 10 CHCDRO Oc1c(C[NH+]2CC3CC(C3)C2)cccc1-c1ccccc1 ZINC001234996309 1130700217 /nfs/dbraw/zinc/70/02/17/1130700217.db2.gz AFCPGHWDDZDVAE-UHFFFAOYSA-N 1 0 279.383 3.901 20 10 CHCDRO C[C@@H]1CC(=O)CC[N@@H+]1Cc1cccc(-c2ccccc2)c1O ZINC001235000502 1130700243 /nfs/dbraw/zinc/70/02/43/1130700243.db2.gz JKLAHKYFYOACQB-CQSZACIVSA-N 1 0 295.382 3.613 20 10 CHCDRO CC1(C)C[NH+](Cc2cccc(-c3ccccc3)c2O)C1 ZINC001234992733 1130700811 /nfs/dbraw/zinc/70/08/11/1130700811.db2.gz QWQUQLKHOCJIGS-UHFFFAOYSA-N 1 0 267.372 3.901 20 10 CHCDRO C[N@@H+](Cc1cccc(-c2ccccc2)c1O)CC1CC1 ZINC001234992633 1130701089 /nfs/dbraw/zinc/70/10/89/1130701089.db2.gz PXGSSTLPAXXLTR-UHFFFAOYSA-N 1 0 267.372 3.901 20 10 CHCDRO Oc1c(C[N@@H+]2CCC[C@H](F)C2)cccc1-c1ccccc1 ZINC001234995978 1130701157 /nfs/dbraw/zinc/70/11/57/1130701157.db2.gz RUWHEEJWCGYQGH-INIZCTEOSA-N 1 0 285.362 3.993 20 10 CHCDRO Oc1c(C[N@@H+]2CC[C@H](F)C2)cccc1-c1ccccc1 ZINC001235003248 1130702932 /nfs/dbraw/zinc/70/29/32/1130702932.db2.gz UXUITVUPTOXCBI-HNNXBMFYSA-N 1 0 271.335 3.603 20 10 CHCDRO C[N@H+](Cc1cccc(N2CCCC2)c1)Cc1ccccc1O ZINC001235097199 1130710655 /nfs/dbraw/zinc/71/06/55/1130710655.db2.gz RNYCXKLMXWOIIJ-UHFFFAOYSA-N 1 0 296.414 3.624 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CC[C@@]3(CC[C@@H](C)C3)C2)c(O)c1 ZINC000781926891 1130748011 /nfs/dbraw/zinc/74/80/11/1130748011.db2.gz BIURNNFQIMLGLL-RDTXWAMCSA-N 1 0 289.419 3.803 20 10 CHCDRO C[C@H]1CCC[N@H+](Cc2ccc(C(C)(C)C)cc2O)C1 ZINC001235676811 1130765421 /nfs/dbraw/zinc/76/54/21/1130765421.db2.gz VQXSIKOMANUQTM-ZDUSSCGKSA-N 1 0 261.409 3.922 20 10 CHCDRO C[N@H+](Cc1cccnc1)Cc1ccc(C(C)(C)C)cc1O ZINC001235676338 1130766159 /nfs/dbraw/zinc/76/61/59/1130766159.db2.gz QMDAKPNHFXVXNM-UHFFFAOYSA-N 1 0 284.403 3.717 20 10 CHCDRO CC1CC[NH+](Cc2ccc(C(C)(C)C)cc2O)CC1 ZINC001235676827 1130766304 /nfs/dbraw/zinc/76/63/04/1130766304.db2.gz WEVHRVCSNDXOMX-UHFFFAOYSA-N 1 0 261.409 3.922 20 10 CHCDRO CC(C)O[C@H]1CC[N@H+](Cc2ccc(C(C)(C)C)cc2O)C1 ZINC001235681092 1130767082 /nfs/dbraw/zinc/76/70/82/1130767082.db2.gz XXYPSTZDUWZFPN-INIZCTEOSA-N 1 0 291.435 3.689 20 10 CHCDRO CC(C)(C)c1ccc(C[N@@H+]2CCc3ncccc3C2)c(O)c1 ZINC001235684731 1130768006 /nfs/dbraw/zinc/76/80/06/1130768006.db2.gz IXTSHLJJFXKTAA-UHFFFAOYSA-N 1 0 296.414 3.643 20 10 CHCDRO Nc1ccc(C[N@@H+]2CCC[C@H]2c2cc(F)ccc2F)cc1 ZINC001235714432 1130771391 /nfs/dbraw/zinc/77/13/91/1130771391.db2.gz LHEFHWCBUQIKDW-KRWDZBQOSA-N 1 0 288.341 3.884 20 10 CHCDRO Cc1cc(O)c(CNc2ccccc2CC[NH+](C)C)cc1C ZINC000782544068 1130782410 /nfs/dbraw/zinc/78/24/10/1130782410.db2.gz DWWTXERXEBQEGM-UHFFFAOYSA-N 1 0 298.430 3.725 20 10 CHCDRO Fc1cc(C2CC2)ccc1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000813781539 1130783734 /nfs/dbraw/zinc/78/37/34/1130783734.db2.gz QDNZUIUFKKBQJK-UHFFFAOYSA-N 1 0 297.373 3.928 20 10 CHCDRO COCC(C)(C)C[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000813790725 1130784640 /nfs/dbraw/zinc/78/46/40/1130784640.db2.gz VHTYQDFJRZRNAZ-UHFFFAOYSA-N 1 0 299.414 3.821 20 10 CHCDRO COCC(C)(C)C[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000813883262 1130794169 /nfs/dbraw/zinc/79/41/69/1130794169.db2.gz RSSDKHZDRIZNKE-ZDUSSCGKSA-N 1 0 291.435 3.594 20 10 CHCDRO C[C@H]([NH2+]CCCOC(C)(C)C)c1ccc(N(C)C)cc1 ZINC000695262634 1130794228 /nfs/dbraw/zinc/79/42/28/1130794228.db2.gz LIFQIJVDAHERFT-AWEZNQCLSA-N 1 0 278.440 3.608 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H]2CC[C@@H]2C)cc1F ZINC000783239049 1130805233 /nfs/dbraw/zinc/80/52/33/1130805233.db2.gz JDMVRVKYIUUUHH-WFASDCNBSA-N 1 0 264.388 3.560 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCC=CO1)c1cc2c(cc1O)CCCC2 ZINC000783312187 1130814816 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Oc1ccccc1C[N@H+](CC[C@H]1CCOC1)C1CCCC1 ZINC000783565522 1130838794 /nfs/dbraw/zinc/83/87/94/1130838794.db2.gz BQGFBWVFXPDGBT-HNNXBMFYSA-N 1 0 289.419 3.563 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2C[C@@H]3[C@H](C2)C3(C)C)cc1C ZINC001170732326 1130841369 /nfs/dbraw/zinc/84/13/69/1130841369.db2.gz YLQXAFSGJHGYFE-QKDCVEJESA-N 1 0 259.393 3.528 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@H](OC)CC2)cc1 ZINC000783603212 1130842563 /nfs/dbraw/zinc/84/25/63/1130842563.db2.gz MUCQOYBCQKSWSO-SFHVURJKSA-N 1 0 290.451 3.534 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CCCC2(CCCC2)C1 ZINC000783743100 1130852667 /nfs/dbraw/zinc/85/26/67/1130852667.db2.gz FYGGMLBFNIPVFY-UHFFFAOYSA-N 1 0 263.356 3.688 20 10 CHCDRO COc1ccc(O)c(C[NH2+]Cc2ccccc2C(C)C)c1 ZINC000783740885 1130853047 /nfs/dbraw/zinc/85/30/47/1130853047.db2.gz UFTAKBAFCHMTPY-UHFFFAOYSA-N 1 0 285.387 3.814 20 10 CHCDRO Nc1ccc(C[NH+]2CCC(Cc3cccc(F)c3)CC2)cc1 ZINC001236093187 1130858099 /nfs/dbraw/zinc/85/80/99/1130858099.db2.gz SJFUQVLADFBNNE-UHFFFAOYSA-N 1 0 298.405 3.863 20 10 CHCDRO CC[C@@H]([NH2+]CCc1cccc(F)c1F)c1ccccc1O ZINC000784266626 1130894345 /nfs/dbraw/zinc/89/43/45/1130894345.db2.gz WNLVFORKHDPFJW-OAHLLOKOSA-N 1 0 291.341 3.954 20 10 CHCDRO CCOc1ccc(C[NH2+]C[C@H](SC)C(C)(C)C)c(O)c1 ZINC000784626411 1130912766 /nfs/dbraw/zinc/91/27/66/1130912766.db2.gz SVVPGXIKDCAWJX-HNNXBMFYSA-N 1 0 297.464 3.658 20 10 CHCDRO CS[C@H](C[NH2+]Cc1c(O)cccc1Cl)C(C)(C)C ZINC000784626409 1130913138 /nfs/dbraw/zinc/91/31/38/1130913138.db2.gz SVHHEOUVAKSSJN-CYBMUJFWSA-N 1 0 287.856 3.913 20 10 CHCDRO CCOc1cccc(C[NH2+]C[C@H](SC)C(C)(C)C)c1O ZINC000784625617 1130914262 /nfs/dbraw/zinc/91/42/62/1130914262.db2.gz HLTSPSHLIQWXOJ-AWEZNQCLSA-N 1 0 297.464 3.658 20 10 CHCDRO Cc1cccc(O)c1C[NH+]1CCC(c2ccc(N)cc2)CC1 ZINC001236337398 1130915268 /nfs/dbraw/zinc/91/52/68/1130915268.db2.gz WHPGYDVNWFPLQI-UHFFFAOYSA-N 1 0 296.414 3.662 20 10 CHCDRO Cc1cc(C[N@H+](C)Cc2ccccc2)ccc1N(C)C ZINC000815011849 1130949726 /nfs/dbraw/zinc/94/97/26/1130949726.db2.gz BWANOKBVTUVSTL-UHFFFAOYSA-N 1 0 268.404 3.693 20 10 CHCDRO Cc1cccc(CCC[NH2+][C@H](C)c2cc(F)ccc2O)n1 ZINC000797016980 1130953107 /nfs/dbraw/zinc/95/31/07/1130953107.db2.gz MRYYNBCNXJXZOW-CYBMUJFWSA-N 1 0 288.366 3.518 20 10 CHCDRO Cc1cc(C[N@@H+](C)[C@@H](C)C2(C)CC2)ccc1N(C)C ZINC000815059640 1130954913 /nfs/dbraw/zinc/95/49/13/1130954913.db2.gz GAJXWLWHXMSGMG-AWEZNQCLSA-N 1 0 260.425 3.681 20 10 CHCDRO CSCC[C@@H](C)[N@H+](C)Cc1ccc(N(C)C)c(C)c1 ZINC000815070549 1130956045 /nfs/dbraw/zinc/95/60/45/1130956045.db2.gz YQJZCQCCQNKDJH-CQSZACIVSA-N 1 0 280.481 3.634 20 10 CHCDRO Cc1cc(C[N@@H+]2CCC[C@H]2c2ccncc2)ccc1N(C)C ZINC000815077106 1130956490 /nfs/dbraw/zinc/95/64/90/1130956490.db2.gz YLMMDGQPDSGOHU-IBGZPJMESA-N 1 0 295.430 3.793 20 10 CHCDRO Cc1ccccc1C(C)(C)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000815150935 1130967459 /nfs/dbraw/zinc/96/74/59/1130967459.db2.gz HNHBRJJHTQULOX-UHFFFAOYSA-N 1 0 281.399 3.955 20 10 CHCDRO CCOc1ccc(C[NH2+]C[C@@H]2C[C@H]2c2ccccc2)c(O)c1 ZINC000815150427 1130968350 /nfs/dbraw/zinc/96/83/50/1130968350.db2.gz CCWUPBGZGFGWOQ-WMZOPIPTSA-N 1 0 297.398 3.684 20 10 CHCDRO CSCCCC[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000815581776 1131002892 /nfs/dbraw/zinc/00/28/92/1131002892.db2.gz PCUXGLJRUBFLRY-ZDUSSCGKSA-N 1 0 267.438 3.803 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@H](O)c2ccccc2C)c(O)c1 ZINC000815579938 1131003146 /nfs/dbraw/zinc/00/31/46/1131003146.db2.gz YUHKBMZNYAWOCO-QAPCUYQASA-N 1 0 299.414 3.702 20 10 CHCDRO CO[C@H](C[NH2+][C@H](C)c1c(C)cc(C)cc1O)C(C)(C)C ZINC000815585221 1131003915 /nfs/dbraw/zinc/00/39/15/1131003915.db2.gz BDNCAQISDXQXQG-UKRRQHHQSA-N 1 0 279.424 3.721 20 10 CHCDRO C[N@H+](Cc1cc(OCc2ccccc2)ccc1O)C1CC1 ZINC001236780066 1131005718 /nfs/dbraw/zinc/00/57/18/1131005718.db2.gz XQMLXQUWNMPXCM-UHFFFAOYSA-N 1 0 283.371 3.565 20 10 CHCDRO CCc1ccc(C[N@@H+]2CCC[C@H]2c2ccncc2)c(O)c1 ZINC001236790368 1131005861 /nfs/dbraw/zinc/00/58/61/1131005861.db2.gz WMVUOJVMEBKSTL-KRWDZBQOSA-N 1 0 282.387 3.687 20 10 CHCDRO CCc1ccc(C[N@@H+]2CC[C@@H](c3ccccc3)C2)c(O)c1 ZINC001236784286 1131007077 /nfs/dbraw/zinc/00/70/77/1131007077.db2.gz TZBJBFROEHSULO-QGZVFWFLSA-N 1 0 281.399 3.944 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CCOCCC(C)C)c(O)c1 ZINC000815570746 1131007225 /nfs/dbraw/zinc/00/72/25/1131007225.db2.gz LHLMLIQHXYGRCS-OAHLLOKOSA-N 1 0 279.424 3.722 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CC[C@@H](C)C[C@H]2C)c(Cl)c1 ZINC001236800732 1131009397 /nfs/dbraw/zinc/00/93/97/1131009397.db2.gz AZPUYJHMRADJCG-GHMZBOCLSA-N 1 0 283.799 3.675 20 10 CHCDRO CCc1ccc(C[NH+]2C3CCCC2CCC3)c(O)c1 ZINC001236792331 1131009673 /nfs/dbraw/zinc/00/96/73/1131009673.db2.gz PGRLSRPKXGKLBO-UHFFFAOYSA-N 1 0 259.393 3.862 20 10 CHCDRO CO[C@H](C)C[NH2+][C@@H](CCc1ccccc1)c1ccccc1O ZINC000815619640 1131010033 /nfs/dbraw/zinc/01/00/33/1131010033.db2.gz TXXYXUAQACIEGS-QAPCUYQASA-N 1 0 299.414 3.691 20 10 CHCDRO COc1cc(O)c(C[N@H+](C)Cc2ccccc2)c(Cl)c1 ZINC001236801201 1131010646 /nfs/dbraw/zinc/01/06/46/1131010646.db2.gz BQEOYDLSKPQXCU-UHFFFAOYSA-N 1 0 291.778 3.686 20 10 CHCDRO COc1cc(C)c(C[N@@H+]2CCC[C@H]3CCCC[C@@H]32)c(O)c1 ZINC001236811645 1131010907 /nfs/dbraw/zinc/01/09/07/1131010907.db2.gz UQHPHSDXTQZLPG-PBHICJAKSA-N 1 0 289.419 3.864 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CCCc2cccc(C)n2)c(O)c1 ZINC000815625049 1131011104 /nfs/dbraw/zinc/01/11/04/1131011104.db2.gz RLGJOWMGNFYKRK-MRXNPFEDSA-N 1 0 298.430 3.996 20 10 CHCDRO COc1cc(C)c(C[N@H+](Cc2ccccc2)C2CC2)c(O)c1 ZINC001236820930 1131013656 /nfs/dbraw/zinc/01/36/56/1131013656.db2.gz PGQOETZTYZIMHZ-UHFFFAOYSA-N 1 0 297.398 3.874 20 10 CHCDRO CCC[N@H+](Cc1c(C)cc(OC)cc1O)[C@H](C)CC ZINC001236819525 1131014338 /nfs/dbraw/zinc/01/43/38/1131014338.db2.gz VZQYYSNGAJCQOO-CYBMUJFWSA-N 1 0 265.397 3.720 20 10 CHCDRO CC(C)C1([NH2+][C@H](C)c2cc(Br)ccc2O)CC1 ZINC000815647417 1131016045 /nfs/dbraw/zinc/01/60/45/1131016045.db2.gz JXQNQXGUWSBQQT-SNVBAGLBSA-N 1 0 298.224 3.994 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)c1cc(F)ccc1O ZINC000815648291 1131016385 /nfs/dbraw/zinc/01/63/85/1131016385.db2.gz IQELHKGMOMHQTA-IFIJOSMWSA-N 1 0 285.362 3.986 20 10 CHCDRO CC(C)C1([NH2+][C@@H](C)c2ccc(Br)cc2O)CC1 ZINC000815647790 1131016534 /nfs/dbraw/zinc/01/65/34/1131016534.db2.gz VCJBLASTDCFKON-JTQLQIEISA-N 1 0 298.224 3.994 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](CO)C1CCCCC1)c1ccccc1O ZINC000815648117 1131016796 /nfs/dbraw/zinc/01/67/96/1131016796.db2.gz FDCQXESLDYQXHA-DOTOQJQBSA-N 1 0 291.435 3.622 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CC)C(C)(C)O)c1cc(Cl)ccc1O ZINC000815651882 1131017844 /nfs/dbraw/zinc/01/78/44/1131017844.db2.gz HLCALNUGIDHDPS-OCCSQVGLSA-N 1 0 285.815 3.636 20 10 CHCDRO Cc1cccc(C[N@H+](C)Cc2ccccc2O)c1Cl ZINC001236859314 1131026245 /nfs/dbraw/zinc/02/62/45/1131026245.db2.gz SMFCALRKEDIBEB-UHFFFAOYSA-N 1 0 275.779 3.986 20 10 CHCDRO Cc1[nH+]ccc(N[C@@H](C)c2ccc(N(C)C)cc2)c1Cl ZINC000798397658 1131037426 /nfs/dbraw/zinc/03/74/26/1131037426.db2.gz DYCDCQTWUCHDLK-NSHDSACASA-N 1 0 289.810 3.704 20 10 CHCDRO CCOc1ccc(C[NH+]2CCC3(CC(F)C3)CC2)c(O)c1 ZINC001237049397 1131039406 /nfs/dbraw/zinc/03/94/06/1131039406.db2.gz DZNISDDDDMVFMJ-UHFFFAOYSA-N 1 0 293.382 3.505 20 10 CHCDRO CC(C)c1ccc(C[N@@H+]2C[C@@H](C)C[C@H]2CF)c(O)c1 ZINC001237044998 1131040087 /nfs/dbraw/zinc/04/00/87/1131040087.db2.gz GXWRODBANKNDCC-WFASDCNBSA-N 1 0 265.372 3.696 20 10 CHCDRO CC(C)c1ccc(C[N@@H+]2CC[C@H](c3ccccn3)C2)c(O)c1 ZINC001237053103 1131042925 /nfs/dbraw/zinc/04/29/25/1131042925.db2.gz GSKPIHQFHSVQBV-INIZCTEOSA-N 1 0 296.414 3.900 20 10 CHCDRO CC(C)c1ccc(C[N@@H+]2CCc3cc(O)ccc3C2)c(O)c1 ZINC001237051958 1131043278 /nfs/dbraw/zinc/04/32/78/1131043278.db2.gz PTSOLECNVZTFJM-UHFFFAOYSA-N 1 0 297.398 3.780 20 10 CHCDRO CC(C)c1ccc(C[N@@H+]2CC[C@H](c3ccncc3)C2)c(O)c1 ZINC001237053967 1131043570 /nfs/dbraw/zinc/04/35/70/1131043570.db2.gz RXPHNLRTJXAZAG-KRWDZBQOSA-N 1 0 296.414 3.900 20 10 CHCDRO CC[C@@H]1CC[N@H+](Cc2c(O)cccc2OC(F)(F)F)C1 ZINC001237124907 1131054473 /nfs/dbraw/zinc/05/44/73/1131054473.db2.gz GXKRDCMDTKLVRM-SNVBAGLBSA-N 1 0 289.297 3.523 20 10 CHCDRO CCC[N@H+](CC)Cc1c(O)cccc1OC(F)(F)F ZINC001237121116 1131056596 /nfs/dbraw/zinc/05/65/96/1131056596.db2.gz VAOYZTKTSHJNKJ-UHFFFAOYSA-N 1 0 277.286 3.523 20 10 CHCDRO C[N@H+](Cc1ccc2ccccc2c1O)C1CCCC1 ZINC000816483639 1131097667 /nfs/dbraw/zinc/09/76/67/1131097667.db2.gz ZKBAVGBLDUNGAB-UHFFFAOYSA-N 1 0 255.361 3.920 20 10 CHCDRO Oc1c(C[NH2+]Cc2cccs2)ccc2ccccc21 ZINC000816528959 1131103312 /nfs/dbraw/zinc/10/33/12/1131103312.db2.gz ZZQFSHHSCYSHQX-UHFFFAOYSA-N 1 0 269.369 3.897 20 10 CHCDRO CN(Cc1nccs1)Cc1ccc2ccccc2c1O ZINC000816514466 1131103405 /nfs/dbraw/zinc/10/34/05/1131103405.db2.gz ZDHJJQDONXBQEO-UHFFFAOYSA-N 1 0 284.384 3.634 20 10 CHCDRO Cc1ccccc1O[C@@H]1CC[N@H+](Cc2c(C)cccc2O)C1 ZINC001237489392 1131104503 /nfs/dbraw/zinc/10/45/03/1131104503.db2.gz HEEBOOKVNRTEAF-MRXNPFEDSA-N 1 0 297.398 3.662 20 10 CHCDRO C[C@H](C[NH2+]Cc1ccc2ccccc2c1O)N1CCCCC1 ZINC000816536816 1131105736 /nfs/dbraw/zinc/10/57/36/1131105736.db2.gz KPHCLKSVPUYORH-OAHLLOKOSA-N 1 0 298.430 3.509 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CCCC[C@@H]1OC)c1ccc(N(C)C)cc1 ZINC000799729758 1131106114 /nfs/dbraw/zinc/10/61/14/1131106114.db2.gz RAOOPUUHZZGRLN-SQNIBIBYSA-N 1 0 290.451 3.751 20 10 CHCDRO CCOC1CC(CC[NH2+]Cc2ccc3ccccc3c2O)C1 ZINC000816589559 1131108620 /nfs/dbraw/zinc/10/86/20/1131108620.db2.gz BPGVKLOHGMTNGI-UHFFFAOYSA-N 1 0 299.414 3.840 20 10 CHCDRO CCC(C)(C)C[NH2+]Cc1cc(Cl)c(F)cc1[O-] ZINC000816591353 1131108651 /nfs/dbraw/zinc/10/86/51/1131108651.db2.gz CCKFTYDVYJVORD-UHFFFAOYSA-N 1 0 259.752 3.711 20 10 CHCDRO CC1(C)C[NH+](Cc2ccc3ccccc3c2O)CC(C)(C)O1 ZINC000816586627 1131108658 /nfs/dbraw/zinc/10/86/58/1131108658.db2.gz NCAUAQGYHYPJQF-UHFFFAOYSA-N 1 0 299.414 3.935 20 10 CHCDRO Oc1c(C[NH2+]C[C@@H]2CCCS2)ccc2ccccc21 ZINC000816556424 1131110042 /nfs/dbraw/zinc/11/00/42/1131110042.db2.gz IRQXKLRAURVRBA-AWEZNQCLSA-N 1 0 273.401 3.531 20 10 CHCDRO Cc1cnc(C[NH2+]Cc2ccc3ccccc3c2O)s1 ZINC000816551696 1131110162 /nfs/dbraw/zinc/11/01/62/1131110162.db2.gz LKGGBPSAYJPGMY-UHFFFAOYSA-N 1 0 284.384 3.600 20 10 CHCDRO C[C@H]1C[N@H+](Cc2ccc3ccccc3c2O)C[C@@H](C2CC2)O1 ZINC000816594519 1131110284 /nfs/dbraw/zinc/11/02/84/1131110284.db2.gz HBVIFPMINIQMRZ-UGSOOPFHSA-N 1 0 297.398 3.545 20 10 CHCDRO Oc1c(C[NH2+][C@@H]2CCC(F)(F)C2)ccc2ccccc21 ZINC000816557482 1131110904 /nfs/dbraw/zinc/11/09/04/1131110904.db2.gz RQMFLJRUDUSPPP-CYBMUJFWSA-N 1 0 277.314 3.823 20 10 CHCDRO COC[C@H]1CCCC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816570749 1131112926 /nfs/dbraw/zinc/11/29/26/1131112926.db2.gz GMBHJGQHAXQOJJ-HNNXBMFYSA-N 1 0 299.414 3.794 20 10 CHCDRO Oc1c(C[N@@H+]2CCC[C@@H]2[C@H]2CCCO2)ccc2ccccc21 ZINC000816603923 1131114706 /nfs/dbraw/zinc/11/47/06/1131114706.db2.gz SQLMRJKNMKPITP-QZTJIDSGSA-N 1 0 297.398 3.689 20 10 CHCDRO COc1cccc(C[NH2+]Cc2cc(C)cc(Cl)c2)c1O ZINC000816610238 1131115974 /nfs/dbraw/zinc/11/59/74/1131115974.db2.gz CYOBCWSNDJILNC-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2CCCO[C@@H](C(C)C)C2)c1O ZINC000816676134 1131122901 /nfs/dbraw/zinc/12/29/01/1131122901.db2.gz TZMXULKOOKLXOK-OAHLLOKOSA-N 1 0 297.826 3.601 20 10 CHCDRO CC[N@H+](C)Cc1cc(-c2ccc(F)cc2)ccc1O ZINC001237640492 1131123144 /nfs/dbraw/zinc/12/31/44/1131123144.db2.gz BZCMSKTWIPBNBZ-UHFFFAOYSA-N 1 0 259.324 3.650 20 10 CHCDRO CCC1CC[NH+](Cc2cc(Cl)cc(C)c2O)CC1 ZINC001237681374 1131126419 /nfs/dbraw/zinc/12/64/19/1131126419.db2.gz OGUQIJMQYNBBOE-UHFFFAOYSA-N 1 0 267.800 3.976 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+](C)C[C@H]2CC2(C)C)c1O ZINC001237685070 1131126676 /nfs/dbraw/zinc/12/66/76/1131126676.db2.gz DRQWNMKBUXOSHR-GFCCVEGCSA-N 1 0 267.800 3.832 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](C)C[C@H]2C)c1O ZINC001237687232 1131128963 /nfs/dbraw/zinc/12/89/63/1131128963.db2.gz VVZXADQTPOMNQY-ZYHUDNBSSA-N 1 0 267.800 3.974 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)Cc1cc(OC)ccc1C ZINC001237711735 1131132616 /nfs/dbraw/zinc/13/26/16/1131132616.db2.gz UOOXQOXFSDOSFV-UHFFFAOYSA-N 1 0 285.387 3.731 20 10 CHCDRO C[C@H]1CCC[N@H+](Cc2ccc(N3CCCC3)cc2)[C@H]1C ZINC001116444438 1131147032 /nfs/dbraw/zinc/14/70/32/1131147032.db2.gz SVPKESUXFGXILR-HOTGVXAUSA-N 1 0 272.436 3.907 20 10 CHCDRO COc1ccc(O)c(C[NH2+]Cc2cccc(C3CC3)c2)c1 ZINC000817407436 1131159185 /nfs/dbraw/zinc/15/91/85/1131159185.db2.gz OHMDVUIVSLPMBT-UHFFFAOYSA-N 1 0 283.371 3.568 20 10 CHCDRO Cc1cc(F)cc(C[N@H+]2CCC[C@@H](C)[C@@H](C)C2)c1O ZINC001238058767 1131165358 /nfs/dbraw/zinc/16/53/58/1131165358.db2.gz VKNHJNAQXLEKER-YPMHNXCESA-N 1 0 265.372 3.708 20 10 CHCDRO Cc1cc(F)cc(CN(C)Cc2cccc(F)c2F)c1O ZINC001238065865 1131166206 /nfs/dbraw/zinc/16/62/06/1131166206.db2.gz FYWMCQNCDUPIQP-UHFFFAOYSA-N 1 0 295.304 3.750 20 10 CHCDRO Cc1cc(F)cc(C[N@@H+]2CCC[C@H]2c2ccncc2)c1O ZINC001238062441 1131166313 /nfs/dbraw/zinc/16/63/13/1131166313.db2.gz PWPLTTBQRHCLSY-INIZCTEOSA-N 1 0 286.350 3.572 20 10 CHCDRO Cc1cc(F)cc(C[NH+]2C3CCCC2CCC3)c1O ZINC001238066694 1131166854 /nfs/dbraw/zinc/16/68/54/1131166854.db2.gz IXSVOASNHPLSKJ-UHFFFAOYSA-N 1 0 263.356 3.747 20 10 CHCDRO Cc1cc(F)cc(C[N@H+](C)C/C=C/c2ccccc2)c1O ZINC001238071469 1131168089 /nfs/dbraw/zinc/16/80/89/1131168089.db2.gz XXKRAWWPNMYXQE-RMKNXTFCSA-N 1 0 285.362 3.985 20 10 CHCDRO Cc1cc(F)cc(C[N@@H+]2CC[C@@H]2c2ccccc2)c1O ZINC001238071034 1131168365 /nfs/dbraw/zinc/16/83/65/1131168365.db2.gz QYYNJUWFHATRGQ-MRXNPFEDSA-N 1 0 271.335 3.787 20 10 CHCDRO CC[C@@H]1C[C@H]([NH2+][C@H](C)c2ccc(N(C)CC)cc2)CCO1 ZINC000817586083 1131173948 /nfs/dbraw/zinc/17/39/48/1131173948.db2.gz LPFVIJKKALCZLQ-QGPMSJSTSA-N 1 0 290.451 3.751 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CC12CCSCC2)c1ccccc1O ZINC000817590660 1131175428 /nfs/dbraw/zinc/17/54/28/1131175428.db2.gz ZOXZNMYCHBQCKV-OLZOCXBDSA-N 1 0 277.433 3.576 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccc(N)cc1)c1cc(C)ccc1OC ZINC000817955847 1131190540 /nfs/dbraw/zinc/19/05/40/1131190540.db2.gz JEZOBGDYQNKPBB-GOSISDBHSA-N 1 0 298.430 3.869 20 10 CHCDRO Cc1ccc2c(c1)OCCC[C@@H]2[NH2+]CCc1ccc(N)cc1 ZINC000817955627 1131190606 /nfs/dbraw/zinc/19/06/06/1131190606.db2.gz DCRKTBIJHOEXFG-SFHVURJKSA-N 1 0 296.414 3.623 20 10 CHCDRO CC(C)C[C@H]([NH2+]CCc1ccc(N)cc1)c1ccccn1 ZINC000817956415 1131191232 /nfs/dbraw/zinc/19/12/32/1131191232.db2.gz YPVGCWXEVUQNFO-SFHVURJKSA-N 1 0 283.419 3.583 20 10 CHCDRO CC[C@@H]1CC[C@@H](C)C[C@H]1[NH2+]CCc1ccc(N)cc1 ZINC000817957376 1131191357 /nfs/dbraw/zinc/19/13/57/1131191357.db2.gz LSGZJMBWLRVCIM-FRFSOERESA-N 1 0 260.425 3.616 20 10 CHCDRO CC(C)CC[C@@H]([NH2+]CCc1ccc(N)cc1)C1CC1 ZINC000817957192 1131191644 /nfs/dbraw/zinc/19/16/44/1131191644.db2.gz KCKGQZTYYPYWRQ-QGZVFWFLSA-N 1 0 260.425 3.616 20 10 CHCDRO COc1ccc(N2CC[C@@H](C[NH2+][C@@H](C)CC(C)C)C2)cc1 ZINC000818220085 1131205238 /nfs/dbraw/zinc/20/52/38/1131205238.db2.gz IXACIJBNHPOLSU-HOTGVXAUSA-N 1 0 290.451 3.546 20 10 CHCDRO Cc1cc(N)cc(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)c1 ZINC001118058854 1131207837 /nfs/dbraw/zinc/20/78/37/1131207837.db2.gz ICWBLGQDKJRKQT-CZUORRHYSA-N 1 0 296.414 3.929 20 10 CHCDRO C[C@H]([NH2+][C@H]1C[C@]1(F)c1ccccc1)c1ccccc1O ZINC000818357243 1131211566 /nfs/dbraw/zinc/21/15/66/1131211566.db2.gz XEBLUOHDLWSGJN-ZLIFDBKOSA-N 1 0 271.335 3.680 20 10 CHCDRO FC1(F)C[C@]12CC[N@H+](Cc1ccc(N3CCCC3)cc1)C2 ZINC001118240304 1131216229 /nfs/dbraw/zinc/21/62/29/1131216229.db2.gz QKBVLIDFDIXSGD-INIZCTEOSA-N 1 0 292.373 3.518 20 10 CHCDRO Cc1cc(C[N@@H+](C)C2CC2)c(C)n1-c1ccccc1 ZINC001137853937 1131424558 /nfs/dbraw/zinc/42/45/58/1131424558.db2.gz BIZIJWJHNAGBOC-UHFFFAOYSA-N 1 0 254.377 3.688 20 10 CHCDRO CCO[C@@H]1CC[N@H+](Cc2cc(C)n(-c3ccccc3)c2C)C1 ZINC001137859049 1131425261 /nfs/dbraw/zinc/42/52/61/1131425261.db2.gz GQQOSRKDYIPHJO-LJQANCHMSA-N 1 0 298.430 3.705 20 10 CHCDRO C[C@H]([NH2+]Cc1cc2cccnc2o1)c1ccc(N(C)C)cc1 ZINC000824196015 1131457680 /nfs/dbraw/zinc/45/76/80/1131457680.db2.gz MYMOEXAJBQIOFM-ZDUSSCGKSA-N 1 0 295.386 3.745 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCC[C@@H](C)C1)c1cc(F)ccc1O ZINC000227372490 1131460684 /nfs/dbraw/zinc/46/06/84/1131460684.db2.gz WVZIHYXFSPNKBD-NQBHXWOUSA-N 1 0 251.345 3.761 20 10 CHCDRO C[C@]1(F)CCC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC000824472878 1131470484 /nfs/dbraw/zinc/47/04/84/1131470484.db2.gz ZYKHXDCEUSWZEA-KRWDZBQOSA-N 1 0 273.351 3.869 20 10 CHCDRO CC(F)(F)CC[NH2+]Cc1ccc2ccccc2c1O ZINC000824482686 1131470608 /nfs/dbraw/zinc/47/06/08/1131470608.db2.gz CBKPZUCBJVDGAZ-UHFFFAOYSA-N 1 0 265.303 3.680 20 10 CHCDRO Oc1ccc(-c2ccccc2)cc1C[NH+]1CC2(CC2)C1 ZINC000824534005 1131472787 /nfs/dbraw/zinc/47/27/87/1131472787.db2.gz WSGZSPKHBSSCPF-UHFFFAOYSA-N 1 0 265.356 3.655 20 10 CHCDRO c1cc(N2CCCCC2)ccc1C[N@@H+]1CC[C@H]1C1CC1 ZINC000824650447 1131477030 /nfs/dbraw/zinc/47/70/30/1131477030.db2.gz NTXUJEWCZJBNEY-SFHVURJKSA-N 1 0 270.420 3.661 20 10 CHCDRO c1cc(N2CCCCC2)ccc1C[N@@H+]1CCC2(CC2)C1 ZINC001138215587 1131478284 /nfs/dbraw/zinc/47/82/84/1131478284.db2.gz KKPGOZAPMOPNAV-UHFFFAOYSA-N 1 0 270.420 3.663 20 10 CHCDRO CCC[C@@H]([NH2+]Cc1cccc(OC)c1O)C(C)(C)C ZINC000824722954 1131480500 /nfs/dbraw/zinc/48/05/00/1131480500.db2.gz ZGWUTCTUCIWIIV-CQSZACIVSA-N 1 0 265.397 3.705 20 10 CHCDRO Cc1ccc(O)c(C[N@H+]2CC[C@@H](C(F)(F)F)C[C@H]2C)c1 ZINC000824714792 1131480859 /nfs/dbraw/zinc/48/08/59/1131480859.db2.gz GIWFOCNJRMTSAU-DGCLKSJQSA-N 1 0 287.325 3.863 20 10 CHCDRO Cc1c(C[N@H+]2CCC[C@@H](C)C2)c2ccccc2n1C ZINC001138252809 1131482104 /nfs/dbraw/zinc/48/21/04/1131482104.db2.gz VNFHDLBFSCUXGV-CYBMUJFWSA-N 1 0 256.393 3.719 20 10 CHCDRO Cc1c(C[NH+]2C3CCC2CC3)c2ccccc2n1C ZINC001138256849 1131483104 /nfs/dbraw/zinc/48/31/04/1131483104.db2.gz NBDORWIFWXGYBY-UHFFFAOYSA-N 1 0 254.377 3.614 20 10 CHCDRO Cc1c(C[N@H+](C)CC2CCC2)c2ccccc2n1C ZINC001138256878 1131483121 /nfs/dbraw/zinc/48/31/21/1131483121.db2.gz OBLJOXFUAFOTCO-UHFFFAOYSA-N 1 0 256.393 3.719 20 10 CHCDRO Cc1c(C[N@H+](C)Cc2cccnc2C)c2ccccc2n1C ZINC001138260215 1131483422 /nfs/dbraw/zinc/48/34/22/1131483422.db2.gz ZJEPIWBORZSORB-UHFFFAOYSA-N 1 0 293.414 3.822 20 10 CHCDRO COC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1c2ccccc2n(C)c1C ZINC001138258014 1131483539 /nfs/dbraw/zinc/48/35/39/1131483539.db2.gz IITGUBSTBLFAFB-XYPWUTKMSA-N 1 0 298.430 3.629 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCOC2(CCC2)C1)c1ccccc1O ZINC000824750798 1131484102 /nfs/dbraw/zinc/48/41/02/1131484102.db2.gz PEXHFHLEFQIDMR-ZBFHGGJFSA-N 1 0 289.419 3.782 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@@H]2CCCC2(F)F)cc1C ZINC000824800194 1131484783 /nfs/dbraw/zinc/48/47/83/1131484783.db2.gz UZGZBUDTFYHSKM-ZDUSSCGKSA-N 1 0 269.335 3.534 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]C23CCC(CC2)CC3)c1 ZINC000824936268 1131489817 /nfs/dbraw/zinc/48/98/17/1131489817.db2.gz WMPBAMYMEWDIGF-UHFFFAOYSA-N 1 0 275.392 3.603 20 10 CHCDRO CN1CCCc2cc(C[N@H+](C)C3CCCCC3)ccc21 ZINC001138353893 1131493663 /nfs/dbraw/zinc/49/36/63/1131493663.db2.gz MPSGWWFEBVPTNX-UHFFFAOYSA-N 1 0 272.436 3.834 20 10 CHCDRO CN1CCCc2cc(C[NH+]3C4CCCC3CCC4)ccc21 ZINC001138359759 1131493837 /nfs/dbraw/zinc/49/38/37/1131493837.db2.gz YNRARSVFVCOIQJ-UHFFFAOYSA-N 1 0 284.447 3.976 20 10 CHCDRO CN1CCCc2cc(C[N@@H+]3CCC[C@@](C)(F)CC3)ccc21 ZINC001138354989 1131493970 /nfs/dbraw/zinc/49/39/70/1131493970.db2.gz XSNHUJNJBIWJRG-GOSISDBHSA-N 1 0 290.426 3.783 20 10 CHCDRO CN1CCCc2cc(C[N@@H+]3CC[C@@H]4CCC[C@H]4C3)ccc21 ZINC001138355359 1131494060 /nfs/dbraw/zinc/49/40/60/1131494060.db2.gz OVESZQKVIPWFQF-WMZOPIPTSA-N 1 0 284.447 3.691 20 10 CHCDRO CC[C@@H]1CCC[N@@H+]1Cc1ccc(N(CC)CC)cc1OC ZINC001138389176 1131497029 /nfs/dbraw/zinc/49/70/29/1131497029.db2.gz LGZYMDCCNNDGQY-MRXNPFEDSA-N 1 0 290.451 3.916 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](CC)C2CC2)c(OC)c1 ZINC001138388148 1131497415 /nfs/dbraw/zinc/49/74/15/1131497415.db2.gz QSCHVIQTVWBBFE-UHFFFAOYSA-N 1 0 276.424 3.526 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H](C)c2cccnc2)cc1Cl ZINC000825072320 1131498086 /nfs/dbraw/zinc/49/80/86/1131498086.db2.gz YNVIQUJRXRQJEC-NSHDSACASA-N 1 0 276.767 3.600 20 10 CHCDRO Oc1c(Cl)cccc1CNc1ccc2c([nH+]1)CCC2 ZINC000825124287 1131499782 /nfs/dbraw/zinc/49/97/82/1131499782.db2.gz LXNOHBKITSKAJT-UHFFFAOYSA-N 1 0 274.751 3.541 20 10 CHCDRO Cc1cc(C[N@@H+]2[C@H](C)CCC2(C)C)ccc1N(C)C ZINC001171078717 1131504116 /nfs/dbraw/zinc/50/41/16/1131504116.db2.gz RLQPONKCIQFLQF-CQSZACIVSA-N 1 0 260.425 3.824 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](C)[C@@H](C)c2cccnc2)cc1Cl ZINC000825502338 1131512920 /nfs/dbraw/zinc/51/29/20/1131512920.db2.gz WPPNXNWFSHXGFV-LBPRGKRZSA-N 1 0 290.794 3.942 20 10 CHCDRO Oc1ccccc1C[NH2+][C@H]1CCc2cc(Cl)ccc2C1 ZINC001171092849 1131517528 /nfs/dbraw/zinc/51/75/28/1131517528.db2.gz ACUUKFMWWYJYDR-INIZCTEOSA-N 1 0 287.790 3.693 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CNc3ccccc3C2)c(O)c1C ZINC000844921601 1131608125 /nfs/dbraw/zinc/60/81/25/1131608125.db2.gz QCRXOYOIIJFIES-GOEBONIOSA-N 1 0 296.414 3.696 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CNc3ccccc3C2)c(O)c1C ZINC000844921600 1131608477 /nfs/dbraw/zinc/60/84/77/1131608477.db2.gz QCRXOYOIIJFIES-GDBMZVCRSA-N 1 0 296.414 3.696 20 10 CHCDRO Cc1cccc(C[NH2+]CC[C@@H]2CCc3ccccc3N2)c1O ZINC000844912762 1131609258 /nfs/dbraw/zinc/60/92/58/1131609258.db2.gz XBOGVUPJEUOKIB-KRWDZBQOSA-N 1 0 296.414 3.607 20 10 CHCDRO Cc1ccc(C[N@H+](C)Cc2ccc(N3CCCC3)cc2)cn1 ZINC001139931031 1131650511 /nfs/dbraw/zinc/65/05/11/1131650511.db2.gz AQPOLDGVCMUIBE-UHFFFAOYSA-N 1 0 295.430 3.622 20 10 CHCDRO Cc1ccc(C)c(C[N@H+]2C[C@@H]3CCCC[C@@H]3C2)c1O ZINC001140178287 1131673068 /nfs/dbraw/zinc/67/30/68/1131673068.db2.gz HCCVGKJZBJLUGA-GASCZTMLSA-N 1 0 259.393 3.631 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CS[C@@H](C(C)C)C2)c1 ZINC000845972281 1131673132 /nfs/dbraw/zinc/67/31/32/1131673132.db2.gz QQWHYLLVCZGNPT-MQIPJXDCSA-N 1 0 295.448 3.582 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCC[C@@](C)(F)CC2)c1O ZINC001140178713 1131673450 /nfs/dbraw/zinc/67/34/50/1131673450.db2.gz VGCDVYAWRDNDPE-MRXNPFEDSA-N 1 0 265.372 3.723 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cscc2Cl)c1 ZINC000845972733 1131673494 /nfs/dbraw/zinc/67/34/94/1131673494.db2.gz TWZSIKSQDJCTHB-VIFPVBQESA-N 1 0 297.807 3.967 20 10 CHCDRO C[C@@H](CCC(F)(F)F)[NH2+]Cc1cc(Cl)ccc1O ZINC000846056283 1131679115 /nfs/dbraw/zinc/67/91/15/1131679115.db2.gz SMDJEIDINBEURU-QMMMGPOBSA-N 1 0 281.705 3.866 20 10 CHCDRO COc1ccc(C[NH2+]CC[C@@]2(C)C[C@@]2(F)Cl)cc1C ZINC000846039682 1131682869 /nfs/dbraw/zinc/68/28/69/1131682869.db2.gz VLBDPHCAMAAWGB-GJZGRUSLSA-N 1 0 285.790 3.798 20 10 CHCDRO CCOc1cc(C)ccc1C[NH2+][C@H]1CCc2cccc(O)c21 ZINC000834620375 1131688144 /nfs/dbraw/zinc/68/81/44/1131688144.db2.gz QIGORFLIVULDKL-INIZCTEOSA-N 1 0 297.398 3.876 20 10 CHCDRO CCOc1cc(C)ccc1C[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000834620376 1131688416 /nfs/dbraw/zinc/68/84/16/1131688416.db2.gz QIGORFLIVULDKL-MRXNPFEDSA-N 1 0 297.398 3.876 20 10 CHCDRO CCCC1(C[NH2+][C@H](C)c2cccc(OC)c2O)CC1 ZINC000846153122 1131692166 /nfs/dbraw/zinc/69/21/66/1131692166.db2.gz GCLVGLMWNHJBRO-GFCCVEGCSA-N 1 0 263.381 3.632 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]C[C@@H]2CCC[C@H]2C2CC2)c1O ZINC000846168662 1131692832 /nfs/dbraw/zinc/69/28/32/1131692832.db2.gz LKIQERSVBCLMHD-NOLJZWGESA-N 1 0 289.419 3.878 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CC2=CCCCC2)c1O ZINC000846169052 1131692974 /nfs/dbraw/zinc/69/29/74/1131692974.db2.gz FLXKSDNINZHTKZ-GFCCVEGCSA-N 1 0 261.365 3.552 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]C2(C3CCC3)CCC2)c1O ZINC000846168794 1131693244 /nfs/dbraw/zinc/69/32/44/1131693244.db2.gz LNNXSGMEPPMCIH-GFCCVEGCSA-N 1 0 275.392 3.774 20 10 CHCDRO Cc1cccc(C)c1C[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000834685147 1131693531 /nfs/dbraw/zinc/69/35/31/1131693531.db2.gz JHYCJZPZKCEKNS-MRXNPFEDSA-N 1 0 267.372 3.786 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CC2CCC(F)CC2)c1O ZINC000846171179 1131693582 /nfs/dbraw/zinc/69/35/82/1131693582.db2.gz FDLCBXHLHYMHFZ-PNESKVBLSA-N 1 0 281.371 3.580 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CC(C)(C)C2CCC2)c1O ZINC000846169737 1131693914 /nfs/dbraw/zinc/69/39/14/1131693914.db2.gz SJUBYDUAJPICLQ-LBPRGKRZSA-N 1 0 277.408 3.878 20 10 CHCDRO COc1cccc([C@@H](C)Nc2cc3c(c[nH+]2)CCCC3)c1O ZINC000846172636 1131693992 /nfs/dbraw/zinc/69/39/92/1131693992.db2.gz ZPZOLGNGFATDKN-GFCCVEGCSA-N 1 0 298.386 3.848 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CC2(c3ccccc3)CC2)c1O ZINC000846139089 1131694048 /nfs/dbraw/zinc/69/40/48/1131694048.db2.gz PTCKRLZSJSGSCU-CQSZACIVSA-N 1 0 297.398 3.783 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]Cc2ccccc2C)c1O ZINC000846137792 1131694123 /nfs/dbraw/zinc/69/41/23/1131694123.db2.gz QNORKZXHVDDZQG-CYBMUJFWSA-N 1 0 271.360 3.560 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H]2CCC[C@@H](C)C2)c1O ZINC000846141835 1131694554 /nfs/dbraw/zinc/69/45/54/1131694554.db2.gz AKBASQLMMAJAIG-FRRDWIJNSA-N 1 0 263.381 3.630 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H](C)Cc2ccccc2C)c1O ZINC000846141320 1131694644 /nfs/dbraw/zinc/69/46/44/1131694644.db2.gz HSHSFUOFSJMNAQ-CABCVRRESA-N 1 0 299.414 3.991 20 10 CHCDRO CCc1cccc(C[NH2+][C@H]2CCc3cccc(O)c32)c1 ZINC000846209732 1131696051 /nfs/dbraw/zinc/69/60/51/1131696051.db2.gz TWAGBOYAPHQOMY-INIZCTEOSA-N 1 0 267.372 3.732 20 10 CHCDRO C[C@H]([NH2+]CC[C@@]1(C)C[C@@]1(F)Cl)c1cc(F)ccc1O ZINC000846185229 1131697909 /nfs/dbraw/zinc/69/79/09/1131697909.db2.gz RESCNIYONLGIMF-HERUPUMHSA-N 1 0 289.753 3.887 20 10 CHCDRO CO[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000846200604 1131699502 /nfs/dbraw/zinc/69/95/02/1131699502.db2.gz GFOPLWHWELVLNN-PSOPSSQASA-N 1 0 283.799 3.654 20 10 CHCDRO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1c(O)cccc1Cl ZINC001140342075 1131703753 /nfs/dbraw/zinc/70/37/53/1131703753.db2.gz SQCVBMAVYAYUQD-LBPRGKRZSA-N 1 0 287.790 3.992 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@@H]1CCOc3c(F)cccc31)CC2 ZINC000834779476 1131704477 /nfs/dbraw/zinc/70/44/77/1131704477.db2.gz MHLKCVFAVCJZAX-HUUCEWRRSA-N 1 0 299.345 3.632 20 10 CHCDRO CC(C)[C@@H](CC(F)(F)F)[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000834779698 1131704628 /nfs/dbraw/zinc/70/46/28/1131704628.db2.gz RFUVOAOLYRZCBS-VXGBXAGGSA-N 1 0 287.325 3.946 20 10 CHCDRO CC(C)C[C@@H]1OCCC[C@@H]1[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000834769403 1131704836 /nfs/dbraw/zinc/70/48/36/1131704836.db2.gz MPQVSGIBSZBBTC-UXLLHSPISA-N 1 0 289.419 3.563 20 10 CHCDRO COC1(C[NH2+][C@@H]2CCc3cccc(O)c32)CCC(C)CC1 ZINC000834790661 1131705341 /nfs/dbraw/zinc/70/53/41/1131705341.db2.gz UIQZCMGSJHPIMH-NSWWBONSSA-N 1 0 289.419 3.564 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H](C)CCCCO)c1O ZINC000834876318 1131715835 /nfs/dbraw/zinc/71/58/35/1131715835.db2.gz AKZPWWOTSYAQKN-NEPJUHHUSA-N 1 0 285.815 3.556 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2CCOC2(C)C)c1O ZINC000834875440 1131715844 /nfs/dbraw/zinc/71/58/44/1131715844.db2.gz OYPVZSMOKNGFGZ-GXFFZTMASA-N 1 0 283.799 3.572 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CCOC3(CCC3)C2)c1 ZINC000834882648 1131716457 /nfs/dbraw/zinc/71/64/57/1131716457.db2.gz NJEFFEIJSDWJFF-CABCVRRESA-N 1 0 289.419 3.701 20 10 CHCDRO CO[C@@](C)(C[NH2+][C@H](C)c1cc(C)ccc1O)c1ccccc1 ZINC000834884115 1131717422 /nfs/dbraw/zinc/71/74/22/1131717422.db2.gz KKLVLKPLDJRVDW-BEFAXECRSA-N 1 0 299.414 3.913 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@]2(C)CC2(Cl)Cl)c1 ZINC000834885241 1131718228 /nfs/dbraw/zinc/71/82/28/1131718228.db2.gz UKTSEJKHUJSMQQ-MFKMUULPSA-N 1 0 288.218 3.935 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cnccc1C)c1ccc(C)cc1O ZINC000834886107 1131718733 /nfs/dbraw/zinc/71/87/33/1131718733.db2.gz HVVUMYHZLLKZTF-MRXNPFEDSA-N 1 0 270.376 3.645 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@]2(C)CC2(Cl)Cl)c(O)c1 ZINC000834885903 1131718894 /nfs/dbraw/zinc/71/88/94/1131718894.db2.gz YVAFSMJPRGAAEB-GXFFZTMASA-N 1 0 288.218 3.935 20 10 CHCDRO C[C@H]([NH2+][C@@H]1C[C@@H](C)n2ccnc21)c1cc(Cl)ccc1O ZINC000834892696 1131719121 /nfs/dbraw/zinc/71/91/21/1131719121.db2.gz CSHULWRKEPQQRS-GBIKHYSHSA-N 1 0 291.782 3.599 20 10 CHCDRO Cc1ccncc1C[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000834887299 1131719430 /nfs/dbraw/zinc/71/94/30/1131719430.db2.gz RVNBJVSKEKDGJB-LLVKDONJSA-N 1 0 276.767 3.600 20 10 CHCDRO CCO[C@@H]1CCC[C@H]1[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000834912902 1131731703 /nfs/dbraw/zinc/73/17/03/1131731703.db2.gz NGQGOFIAVCBJST-PSOPSSQASA-N 1 0 283.799 3.654 20 10 CHCDRO Oc1cc(Cl)ccc1C[N@@H+]1CC[C@@H]2CCC[C@H]2C1 ZINC001140462207 1131749547 /nfs/dbraw/zinc/74/95/47/1131749547.db2.gz AKDOIHLNVAPKHL-RYUDHWBXSA-N 1 0 265.784 3.668 20 10 CHCDRO Oc1cc(Cl)ccc1C[NH+]1CCC(C(F)F)CC1 ZINC001140465435 1131750359 /nfs/dbraw/zinc/75/03/59/1131750359.db2.gz NFPHRGVNZSKBLE-UHFFFAOYSA-N 1 0 275.726 3.523 20 10 CHCDRO COc1ccccc1C[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC000835034015 1131760372 /nfs/dbraw/zinc/76/03/72/1131760372.db2.gz NDDMVFFVMQDFER-VOTSOKGWSA-N 1 0 296.414 3.564 20 10 CHCDRO C[C@@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)c1cccc(O)c1 ZINC000835037357 1131760407 /nfs/dbraw/zinc/76/04/07/1131760407.db2.gz JOSLACMSESLQPK-IYKSTZQJSA-N 1 0 296.414 3.822 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]C[C@@H]2CCC(F)(F)C2)cc1 ZINC000835050910 1131764640 /nfs/dbraw/zinc/76/46/40/1131764640.db2.gz GEGOVZXKJHCUCK-NHZBNJEXSA-N 1 0 294.389 3.791 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+]C[C@@H]2CCOC(C)(C)C2)c1O ZINC000835060004 1131766639 /nfs/dbraw/zinc/76/66/39/1131766639.db2.gz NXHLPDJEUVJAKY-GFCCVEGCSA-N 1 0 297.826 3.649 20 10 CHCDRO CCC1C[NH+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000835075445 1131767593 /nfs/dbraw/zinc/76/75/93/1131767593.db2.gz UCLPXYNPWZCVSD-UHFFFAOYSA-N 1 0 258.409 3.519 20 10 CHCDRO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1c(O)cccc1Cl ZINC000128029703 1131831960 /nfs/dbraw/zinc/83/19/60/1131831960.db2.gz XCRSLXNLSXSLSQ-PHIMTYICSA-N 1 0 253.773 3.809 20 10 CHCDRO COc1cccc(C[NH2+]CC2(SC)CCCCC2)c1O ZINC000234988682 1131842461 /nfs/dbraw/zinc/84/24/61/1131842461.db2.gz JJOVMEJLDDDNLG-UHFFFAOYSA-N 1 0 295.448 3.556 20 10 CHCDRO Cc1c(O)ccc(C[N@@H+]2CCC[C@@H](c3ccccc3)C2)c1O ZINC001140745368 1131905212 /nfs/dbraw/zinc/90/52/12/1131905212.db2.gz HFVRMXPSFVYZNT-MRXNPFEDSA-N 1 0 297.398 3.786 20 10 CHCDRO CCC[C@H]1CCCC[N@@H+]1Cc1ccc(O)c(C)c1O ZINC001140746006 1131905289 /nfs/dbraw/zinc/90/52/89/1131905289.db2.gz SBYYUQBXIWRGHA-AWEZNQCLSA-N 1 0 263.381 3.561 20 10 CHCDRO CC[C@H]1c2ccccc2CC[N@H+]1Cc1ccc(O)c(C)c1O ZINC001140748350 1131906315 /nfs/dbraw/zinc/90/63/15/1131906315.db2.gz WXDWELIFYVBGIQ-KRWDZBQOSA-N 1 0 297.398 3.916 20 10 CHCDRO CC[N@H+](Cc1ccc(F)cc1)Cc1ccc(O)c(C)c1O ZINC001140749389 1131906606 /nfs/dbraw/zinc/90/66/06/1131906606.db2.gz XRJDDJPDWHVRQV-UHFFFAOYSA-N 1 0 289.350 3.567 20 10 CHCDRO Cc1c(O)ccc(C[N@@H+]2CCC[C@@H]2C2CCCCC2)c1O ZINC001140748322 1131906685 /nfs/dbraw/zinc/90/66/85/1131906685.db2.gz WCJSGIUQXVKLBJ-MRXNPFEDSA-N 1 0 289.419 3.951 20 10 CHCDRO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1ccc(O)c(C)c1O ZINC001140748351 1131906852 /nfs/dbraw/zinc/90/68/52/1131906852.db2.gz WXDWELIFYVBGIQ-QGZVFWFLSA-N 1 0 297.398 3.916 20 10 CHCDRO CCC[NH+](CCC)Cc1ccc(N(CC)CC)cc1O ZINC001140851929 1131947561 /nfs/dbraw/zinc/94/75/61/1131947561.db2.gz UVEYNVLEEAPBPG-UHFFFAOYSA-N 1 0 278.440 3.860 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1ccc[nH]1)c1ccc(N(C)C)cc1 ZINC000773114000 1131947575 /nfs/dbraw/zinc/94/75/75/1131947575.db2.gz CCQPHVWTTCDWCR-XJKSGUPXSA-N 1 0 271.408 3.883 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](C)c2ccc[nH]2)cc1 ZINC000773118325 1131950216 /nfs/dbraw/zinc/95/02/16/1131950216.db2.gz OBJVLKUDMMBYEO-KBPBESRZSA-N 1 0 271.408 3.883 20 10 CHCDRO C[C@H]([NH2+][C@@H](c1cccnc1)C1CC1)c1ccc(N(C)C)cc1 ZINC000773120923 1131950916 /nfs/dbraw/zinc/95/09/16/1131950916.db2.gz SUKWJLPKIJOVGV-IFXJQAMLSA-N 1 0 295.430 3.950 20 10 CHCDRO CN(C)c1ccc(C[NH+]2C[C@H]3CCC[C@@H]3C2)c(Cl)c1 ZINC001140921897 1131962653 /nfs/dbraw/zinc/96/26/53/1131962653.db2.gz VCOHZFGNAVTAFS-CHWSQXEVSA-N 1 0 278.827 3.638 20 10 CHCDRO Cc1ccc(C[N@H+](C)Cc2ccc(Cl)cc2)c(O)c1 ZINC001140950001 1131968970 /nfs/dbraw/zinc/96/89/70/1131968970.db2.gz QIGVFWGDRBZGPV-UHFFFAOYSA-N 1 0 275.779 3.986 20 10 CHCDRO Cc1ccc(C[N@H+]2CC[C@@H](C)C(F)(F)CC2)c(O)c1 ZINC001140947978 1131970341 /nfs/dbraw/zinc/97/03/41/1131970341.db2.gz ODTAGTUCAWKTLE-GFCCVEGCSA-N 1 0 269.335 3.568 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CCc3c(F)cccc3C2)cc1C ZINC001171411719 1131980086 /nfs/dbraw/zinc/98/00/86/1131980086.db2.gz MRPIKRPKCZEWBP-MRXNPFEDSA-N 1 0 299.389 3.790 20 10 CHCDRO Cc1cc(C)c(C[NH2+][C@H]2CCc3c(F)cccc3C2)c(O)c1 ZINC001171412062 1131981201 /nfs/dbraw/zinc/98/12/01/1131981201.db2.gz RSJPNSSCIAURCS-HNNXBMFYSA-N 1 0 299.389 3.795 20 10 CHCDRO C[C@@H](Cc1ccccc1Cl)[NH2+]Cc1ccccc1O ZINC000036936255 1131984900 /nfs/dbraw/zinc/98/49/00/1131984900.db2.gz FWSKCSPFIJBNQP-LBPRGKRZSA-N 1 0 275.779 3.766 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)Cc1ccco1)c1ccccc1O ZINC000036993589 1131985708 /nfs/dbraw/zinc/98/57/08/1131985708.db2.gz WUNCNCKKLKQFEO-DOMZBBRYSA-N 1 0 259.349 3.657 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cccc(OC)c1O)c1ccc(C)cc1 ZINC000037048170 1131989702 /nfs/dbraw/zinc/98/97/02/1131989702.db2.gz NAMHBBNBEDCFFN-MRXNPFEDSA-N 1 0 285.387 3.950 20 10 CHCDRO CCOc1ccc([C@@H](C)[NH2+]Cc2ccccc2O)cc1 ZINC000037107898 1131996610 /nfs/dbraw/zinc/99/66/10/1131996610.db2.gz YPFVXEATIMMUKA-CYBMUJFWSA-N 1 0 271.360 3.642 20 10 CHCDRO C[C@@H]([NH2+]Cc1cc(Cl)ccc1O)c1cccc(O)c1 ZINC000037151539 1132002030 /nfs/dbraw/zinc/00/20/30/1132002030.db2.gz BDPNIRDQMIMVAU-SNVBAGLBSA-N 1 0 277.751 3.602 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H]2CSCc3ccccc32)cc1 ZINC000037233662 1132023060 /nfs/dbraw/zinc/02/30/60/1132023060.db2.gz WCRDHRZHZAZKMW-SFHVURJKSA-N 1 0 298.455 3.830 20 10 CHCDRO C[C@@H]([NH2+]CCc1cccc(F)c1)c1ccc(N(C)C)cc1 ZINC000037262354 1132026159 /nfs/dbraw/zinc/02/61/59/1132026159.db2.gz IMGNHVNSPSFHPV-CQSZACIVSA-N 1 0 286.394 3.785 20 10 CHCDRO Oc1ccc(O)c(C[N@@H+]2CCC[C@@H](Cc3ccccc3)C2)c1 ZINC001141158482 1132030720 /nfs/dbraw/zinc/03/07/20/1132030720.db2.gz AVSWKUJXLXZNGS-INIZCTEOSA-N 1 0 297.398 3.553 20 10 CHCDRO Cc1cccc2c1CC[C@H]([NH2+]Cc1ccc(N(C)C)cc1)C2 ZINC001171557953 1132054333 /nfs/dbraw/zinc/05/43/33/1132054333.db2.gz XVKFRPBYWIRDKP-SFHVURJKSA-N 1 0 294.442 3.708 20 10 CHCDRO Cc1ccc(CC[C@H](C)[NH2+]Cc2ccccc2O)cc1 ZINC001171655246 1132068824 /nfs/dbraw/zinc/06/88/24/1132068824.db2.gz HAIRGWGIHUANMW-HNNXBMFYSA-N 1 0 269.388 3.812 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CCC[C@H](OC(C)C)C2)cc1 ZINC001171741104 1132098008 /nfs/dbraw/zinc/09/80/08/1132098008.db2.gz LPUPDBVVOKNQJZ-SFHVURJKSA-N 1 0 290.451 3.532 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)c2ccccc2O)c(Cl)n1 ZINC000838916003 1132157600 /nfs/dbraw/zinc/15/76/00/1132157600.db2.gz DNVNCNJCMZFBKC-NSHDSACASA-N 1 0 276.767 3.600 20 10 CHCDRO CC[C@@H](C)OCC[C@H](C)[NH2+]Cc1ccc(OC)c(C)c1 ZINC001172322198 1132159660 /nfs/dbraw/zinc/15/96/60/1132159660.db2.gz ARYXDEHGUBATRW-LSDHHAIUSA-N 1 0 279.424 3.687 20 10 CHCDRO C[C@@H]1CC[C@@H]([N@@H+]2CCCc3cc(O)c(O)cc3C2)C[C@@H]1C ZINC001172379412 1132171613 /nfs/dbraw/zinc/17/16/13/1132171613.db2.gz OGJDVXGEPJBOSU-DVOMOZLQSA-N 1 0 289.419 3.671 20 10 CHCDRO CCOc1cccc(C[NH2+]C2CCC(C(F)F)CC2)c1O ZINC000839179667 1132187761 /nfs/dbraw/zinc/18/77/61/1132187761.db2.gz MYPZZNTYNTXVHP-UHFFFAOYSA-N 1 0 299.361 3.704 20 10 CHCDRO Cc1cc(NCc2cc(F)ccc2O)ccc1C[NH+](C)C ZINC000839190263 1132189801 /nfs/dbraw/zinc/18/98/01/1132189801.db2.gz YVTFHRKMYAKUGC-UHFFFAOYSA-N 1 0 288.366 3.513 20 10 CHCDRO Cc1cc(NCc2ccc(N(C)C)cc2)ccc1C[NH+](C)C ZINC000839189088 1132190011 /nfs/dbraw/zinc/19/00/11/1132190011.db2.gz PDUIDRGCCVGTEH-UHFFFAOYSA-N 1 0 297.446 3.735 20 10 CHCDRO Cc1cc(C)c(C[NH2+][C@@H]2CC[C@@H](C)[C@H](C)C2)c(O)c1 ZINC001172368505 1132192931 /nfs/dbraw/zinc/19/29/31/1132192931.db2.gz PFELYSXSEYBARQ-UMVBOHGHSA-N 1 0 261.409 3.923 20 10 CHCDRO Cc1cc(C)c(C[NH2+][C@@H]2CC[C@@H](C)[C@@H](C)C2)c(O)c1 ZINC001172369110 1132193947 /nfs/dbraw/zinc/19/39/47/1132193947.db2.gz PFELYSXSEYBARQ-VNHYZAJKSA-N 1 0 261.409 3.923 20 10 CHCDRO C[C@@H](O)CC[N@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000839530947 1132221448 /nfs/dbraw/zinc/22/14/48/1132221448.db2.gz GLYYFYOYIHLZKV-HZPDHXFCSA-N 1 0 299.414 3.726 20 10 CHCDRO CC(C)OCC[C@@H](C)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC001172444864 1132236427 /nfs/dbraw/zinc/23/64/27/1132236427.db2.gz ZMCNJTKPMNDOJH-CABCVRRESA-N 1 0 278.440 3.607 20 10 CHCDRO CO[C@@H]1CC[N@H+](Cc2cc(C(C)C)c(C)cc2O)C[C@@H]1C ZINC000840127111 1132247816 /nfs/dbraw/zinc/24/78/16/1132247816.db2.gz RLPJDUTWEWZWHZ-KBXCAEBGSA-N 1 0 291.435 3.681 20 10 CHCDRO COC[C@H]1CC[N@@H+]1Cc1cc2oc3ccccc3c2cc1O ZINC000840083746 1132248254 /nfs/dbraw/zinc/24/82/54/1132248254.db2.gz RBQLJXZONJWDLC-CYBMUJFWSA-N 1 0 297.354 3.512 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CCO[C@H](C2CCC2)C1 ZINC000840175078 1132248806 /nfs/dbraw/zinc/24/88/06/1132248806.db2.gz GBJJMDQUIRDLBT-IBGZPJMESA-N 1 0 297.398 3.546 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCSC3(CCC3)CC2)cc1C ZINC000840174559 1132249844 /nfs/dbraw/zinc/24/98/44/1132249844.db2.gz QFVIRXZTFUZEJG-UHFFFAOYSA-N 1 0 291.460 3.871 20 10 CHCDRO Oc1ccc(C[NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)c(O)c1 ZINC001172554536 1132265948 /nfs/dbraw/zinc/26/59/48/1132265948.db2.gz WZHOBFGCARANBL-GDBMZVCRSA-N 1 0 283.371 3.524 20 10 CHCDRO CC[C@H]([NH2+]CCCSc1nccs1)[C@H]1C[C@@H]1C ZINC000840720951 1132277482 /nfs/dbraw/zinc/27/74/82/1132277482.db2.gz BENSIGSOPMAWIN-SRVKXCTJSA-N 1 0 270.467 3.650 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCC[C@@H]3C[C@@H]32)c(O)c1C ZINC000840820101 1132290536 /nfs/dbraw/zinc/29/05/36/1132290536.db2.gz JVKKDWBLASAHCS-XRGAULLZSA-N 1 0 259.393 3.848 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCC[C@@H]2C[C@@H]21)c1cc(Cl)ccc1O ZINC000840820046 1132290619 /nfs/dbraw/zinc/29/06/19/1132290619.db2.gz IYBBVCMIGKUHBJ-DJBIQUGXSA-N 1 0 265.784 3.885 20 10 CHCDRO CO[C@@H]1C[C@@H]([NH2+][C@@H](C)c2cc(Cl)ccc2O)C12CCC2 ZINC000840807282 1132290727 /nfs/dbraw/zinc/29/07/27/1132290727.db2.gz SCCZATCKSRTBJJ-COLVAYQJSA-N 1 0 295.810 3.654 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1C[C@H](C)O[C@@H]1C)c1ccc(N(C)C)cc1 ZINC000840874052 1132299104 /nfs/dbraw/zinc/29/91/04/1132299104.db2.gz WJVMUPNJXWRPHV-KPEUIFRASA-N 1 0 290.451 3.607 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1C[C@@H](C)O[C@H]1C)c1ccc(C)cc1O ZINC000840872307 1132299615 /nfs/dbraw/zinc/29/96/15/1132299615.db2.gz KHQXXYSVLPZEMF-HOSILWTGSA-N 1 0 277.408 3.555 20 10 CHCDRO COCC1CCC([NH2+][C@@H](C)c2cc(F)cc(F)c2[O-])CC1 ZINC000840881132 1132301128 /nfs/dbraw/zinc/30/11/28/1132301128.db2.gz OCASNUPWMYSRQS-ZBOXLXRLSA-N 1 0 299.361 3.526 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCC[C@H](CO)C1)c1cc(Cl)ccc1O ZINC000840893277 1132305442 /nfs/dbraw/zinc/30/54/42/1132305442.db2.gz FSDZKGRFEWRTDQ-LNSITVRQSA-N 1 0 297.826 3.637 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H]2CCOC3(CCC3)C2)c(Cl)c1 ZINC000840908578 1132308241 /nfs/dbraw/zinc/30/82/41/1132308241.db2.gz FSXXGZHRMYSGGC-GFCCVEGCSA-N 1 0 295.810 3.545 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H]2CCC(F)(F)C2)c(Cl)c1 ZINC000840908546 1132308256 /nfs/dbraw/zinc/30/82/56/1132308256.db2.gz FBAUYJKBSIGTLB-VIFPVBQESA-N 1 0 275.726 3.631 20 10 CHCDRO CS[C@@H]1CC[C@H]([NH2+]Cc2c(O)cc(C)cc2Cl)C1 ZINC000840906185 1132309039 /nfs/dbraw/zinc/30/90/39/1132309039.db2.gz VUBZQPUFMKRIKF-WDEREUQCSA-N 1 0 285.840 3.728 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCCC[C@@H]1c1cc[nH]n1 ZINC000840947971 1132311076 /nfs/dbraw/zinc/31/10/76/1132311076.db2.gz IFUACPRPAOSYGW-GOSISDBHSA-N 1 0 298.434 3.511 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CC[C@H]2CCO[C@H](C)C2)c(Cl)c1 ZINC000840939982 1132311254 /nfs/dbraw/zinc/31/12/54/1132311254.db2.gz STBZBFGGYBEARX-OLZOCXBDSA-N 1 0 297.826 3.649 20 10 CHCDRO CCOC1CC(CC[NH2+]Cc2c(O)cc(C)cc2Cl)C1 ZINC000840942260 1132311304 /nfs/dbraw/zinc/31/13/04/1132311304.db2.gz XAZOCAUGYHQGDE-UHFFFAOYSA-N 1 0 297.826 3.649 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CCCC2CCOCC2)c(Cl)c1 ZINC000840948164 1132311714 /nfs/dbraw/zinc/31/17/14/1132311714.db2.gz ACIBUAQUXILKED-UHFFFAOYSA-N 1 0 297.826 3.650 20 10 CHCDRO Oc1c(C[N@@H+]2CCO[C@@H](C3CCC3)C2)ccc2ccccc21 ZINC000840954157 1132313027 /nfs/dbraw/zinc/31/30/27/1132313027.db2.gz HTRKNQITUKOBMV-GOSISDBHSA-N 1 0 297.398 3.546 20 10 CHCDRO CC(C)(C)c1ccncc1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000840957815 1132313902 /nfs/dbraw/zinc/31/39/02/1132313902.db2.gz GJVWLTYDEATNGD-UHFFFAOYSA-N 1 0 296.414 3.604 20 10 CHCDRO CCCOC1CC[NH+](Cc2c(O)ccc3ccccc32)CC1 ZINC001231590137 1132316785 /nfs/dbraw/zinc/31/67/85/1132316785.db2.gz LVFPNMRYFMQCLH-UHFFFAOYSA-N 1 0 299.414 3.936 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@H+](CC1CC1)C1CC1 ZINC001231589415 1132317480 /nfs/dbraw/zinc/31/74/80/1132317480.db2.gz HXQOGJFVYOMITL-UHFFFAOYSA-N 1 0 267.372 3.920 20 10 CHCDRO C[C@@]1(CF)CC[N@H+](Cc2c(O)ccc3ccccc32)C1 ZINC001231588504 1132317651 /nfs/dbraw/zinc/31/76/51/1132317651.db2.gz RZIQZPUAGJQIHB-KRWDZBQOSA-N 1 0 273.351 3.727 20 10 CHCDRO C[N@H+](Cc1cccc(O)c1)Cc1c(O)ccc2ccccc21 ZINC001231587449 1132319496 /nfs/dbraw/zinc/31/94/96/1132319496.db2.gz CIBNJHRQSYCPMC-UHFFFAOYSA-N 1 0 293.366 3.883 20 10 CHCDRO Cc1cccc(C[N@@H+]2C[C@@H]3C[C@H](C2)c2ccccc23)c1O ZINC001231594003 1132320011 /nfs/dbraw/zinc/32/00/11/1132320011.db2.gz AGRDHABCXQRZMH-IYBDPMFKSA-N 1 0 279.383 3.787 20 10 CHCDRO CC[C@H](Cc1ccc(C)cc1)[NH2+]CCc1ccc(N)cc1 ZINC000841033822 1132321341 /nfs/dbraw/zinc/32/13/41/1132321341.db2.gz BSTKEAIGXHOCFO-LJQANCHMSA-N 1 0 282.431 3.731 20 10 CHCDRO COc1cccc(CCC[N@H+](C)Cc2cccc(C)c2O)c1 ZINC001231593911 1132321593 /nfs/dbraw/zinc/32/15/93/1132321593.db2.gz OEUFCHAKYOFAAK-UHFFFAOYSA-N 1 0 299.414 3.774 20 10 CHCDRO C[C@@H](Cc1ccc(Cl)cc1)[NH2+]CCc1ccc(N)cc1 ZINC000841036977 1132321931 /nfs/dbraw/zinc/32/19/31/1132321931.db2.gz XREWLKWLSXGCKJ-ZDUSSCGKSA-N 1 0 288.822 3.686 20 10 CHCDRO C[C@@]1(c2ccccc2)CC[C@H]([NH2+]CCc2ccc(N)cc2)C1 ZINC000841039047 1132322478 /nfs/dbraw/zinc/32/24/78/1132322478.db2.gz YHPIEWTUILHLQN-VQTJNVASSA-N 1 0 294.442 3.911 20 10 CHCDRO CC[NH2+]Cc1cccc(NCc2cc(Cl)ccc2O)c1 ZINC000841042059 1132324067 /nfs/dbraw/zinc/32/40/67/1132324067.db2.gz DJRZQZXYZISVBT-UHFFFAOYSA-N 1 0 290.794 3.767 20 10 CHCDRO Cc1ccc2c(c1)C[C@H]([NH2+]Cc1cccc(C)c1O)CC2 ZINC001172831827 1132326047 /nfs/dbraw/zinc/32/60/47/1132326047.db2.gz PWJPDADPKGBTBJ-GOSISDBHSA-N 1 0 281.399 3.656 20 10 CHCDRO Cc1cc(C)c(C[NH+]2CCC(OC3CCC3)CC2)c(O)c1 ZINC001231843237 1132375606 /nfs/dbraw/zinc/37/56/06/1132375606.db2.gz TVDSPNCPLBYONV-UHFFFAOYSA-N 1 0 289.419 3.543 20 10 CHCDRO Cc1cc(C)c(C[N@H+]2CCC[C@@H](C)[C@H](C)C2)c(O)c1 ZINC001231842456 1132375956 /nfs/dbraw/zinc/37/59/56/1132375956.db2.gz MKDSJJPWFXFLNU-UKRRQHHQSA-N 1 0 261.409 3.877 20 10 CHCDRO CCC[C@@H]1CCCC[N@@H+]1Cc1ccc(N(C)C)cc1OC ZINC001231854135 1132378741 /nfs/dbraw/zinc/37/87/41/1132378741.db2.gz ZTQUOAVQMHYGJW-MRXNPFEDSA-N 1 0 290.451 3.916 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCC[C@H]2Cc2ccccn2)c(O)c1 ZINC001231847347 1132379195 /nfs/dbraw/zinc/37/91/95/1132379195.db2.gz XPZHCDGTSIZMBF-KRWDZBQOSA-N 1 0 296.414 3.611 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCC[C@H]3CCC[C@@H]32)c(O)c1 ZINC001231846967 1132379576 /nfs/dbraw/zinc/37/95/76/1132379576.db2.gz TYPFBKJYSMBKNF-ZBFHGGJFSA-N 1 0 259.393 3.774 20 10 CHCDRO Cc1cc(C)c(C[N@H+]2Cc3ccccc3C[C@H]2C)c(O)c1 ZINC001231849944 1132379714 /nfs/dbraw/zinc/37/97/14/1132379714.db2.gz XFFHRWRUHWFFPQ-OAHLLOKOSA-N 1 0 281.399 3.956 20 10 CHCDRO CCC[N@H+](Cc1ccc(N(C)C)cc1OC)[C@@H](C)CC ZINC001231849773 1132379837 /nfs/dbraw/zinc/37/98/37/1132379837.db2.gz ZAOPAWLFGYUHIC-AWEZNQCLSA-N 1 0 278.440 3.772 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC[C@](C)(F)C2)cc1Cl ZINC001231867379 1132380740 /nfs/dbraw/zinc/38/07/40/1132380740.db2.gz JVZQMAKZWOXEEY-AWEZNQCLSA-N 1 0 271.763 3.678 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccccn1)c1ccc(Cl)cc1O ZINC000841743133 1132387809 /nfs/dbraw/zinc/38/78/09/1132387809.db2.gz CTYYDKACWIMJOF-MNOVXSKESA-N 1 0 276.767 3.852 20 10 CHCDRO C[C@H]1CC[N@H+](Cc2ccc3ccccc3c2O)CC[C@@]1(C)O ZINC001231879354 1132388862 /nfs/dbraw/zinc/38/88/62/1132388862.db2.gz CJPHJIUJKVJYNF-IFXJQAMLSA-N 1 0 299.414 3.528 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1ccc(Cl)cc1O)[C@H]1CCCO1 ZINC000841751115 1132389777 /nfs/dbraw/zinc/38/97/77/1132389777.db2.gz KSSUWMXDEQKTJG-RIEGTJTDSA-N 1 0 283.799 3.654 20 10 CHCDRO C[C@H]1C[N@H+](Cc2ccc3ccccc3c2O)C2(CC2)C1 ZINC001231883710 1132390620 /nfs/dbraw/zinc/39/06/20/1132390620.db2.gz SYIVXYZOUKZYAI-CYBMUJFWSA-N 1 0 267.372 3.920 20 10 CHCDRO Oc1c(C[NH+]2CC3(C2)CC(F)(F)C3)ccc2ccccc21 ZINC001231878522 1132391189 /nfs/dbraw/zinc/39/11/89/1132391189.db2.gz LZJNRBGUZYXTQW-UHFFFAOYSA-N 1 0 289.325 3.777 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1COCc2ccccc21)c1ccccc1O ZINC000841758371 1132393801 /nfs/dbraw/zinc/39/38/01/1132393801.db2.gz AOTZWCWURABLGJ-SJORKVTESA-N 1 0 283.371 3.704 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CO)CC1CCCCC1)c1ccccc1O ZINC000841760452 1132394254 /nfs/dbraw/zinc/39/42/54/1132394254.db2.gz FLDUTHAHSPIJOB-NVXWUHKLSA-N 1 0 291.435 3.764 20 10 CHCDRO CCc1nc(C)c(C[NH2+][C@H](C)c2ccc(Cl)cc2O)o1 ZINC000841759273 1132395128 /nfs/dbraw/zinc/39/51/28/1132395128.db2.gz XZILBEABJUFLTG-SECBINFHSA-N 1 0 294.782 3.755 20 10 CHCDRO CCn1ccnc1[C@H](C)[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841756752 1132395283 /nfs/dbraw/zinc/39/52/83/1132395283.db2.gz JXWMBCWPLPBNOC-MNOVXSKESA-N 1 0 293.798 3.674 20 10 CHCDRO CO[C@@](C)(C[NH2+][C@H](C)c1ccc(Cl)cc1O)C1CC1 ZINC000841758564 1132395331 /nfs/dbraw/zinc/39/53/31/1132395331.db2.gz SVJUWWIZTTWIFG-BMIGLBTASA-N 1 0 283.799 3.511 20 10 CHCDRO CC(C)n1ccc(C[NH2+][C@H](C)c2ccc(Cl)cc2O)n1 ZINC000841764540 1132396696 /nfs/dbraw/zinc/39/66/96/1132396696.db2.gz QDHGGQJZMNMKGK-LLVKDONJSA-N 1 0 293.798 3.674 20 10 CHCDRO CO[C@@H](C[NH2+]Cc1ccc2ccccc2c1O)CC(C)C ZINC000841888010 1132399833 /nfs/dbraw/zinc/39/98/33/1132399833.db2.gz BUACWAWSXSRLJV-MRXNPFEDSA-N 1 0 287.403 3.696 20 10 CHCDRO CCN(Cc1ccccc1O)Cc1nc(Cl)ccc1F ZINC001232162519 1132429283 /nfs/dbraw/zinc/42/92/83/1132429283.db2.gz KMVPVBUFVMJJSP-UHFFFAOYSA-N 1 0 294.757 3.602 20 10 CHCDRO COc1cc(O)c(C[NH+]2[C@H](C)CCC[C@H]2C)cc1Cl ZINC001232266049 1132446284 /nfs/dbraw/zinc/44/62/84/1132446284.db2.gz QBVHTKFLJPCYBR-GHMZBOCLSA-N 1 0 283.799 3.817 20 10 CHCDRO COc1cc(O)c(C[NH+]2CC3CCC(CC3)C2)cc1Cl ZINC001232269317 1132446948 /nfs/dbraw/zinc/44/69/48/1132446948.db2.gz VKQGNLISETUAHG-UHFFFAOYSA-N 1 0 295.810 3.676 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@@H](C)CC(F)F)c(Cl)c1 ZINC000842728678 1132455460 /nfs/dbraw/zinc/45/54/60/1132455460.db2.gz HEZOLYGFTBHZLC-VIFPVBQESA-N 1 0 277.742 3.735 20 10 CHCDRO Fc1ccccc1C1([NH2+]Cc2ccc3c(c2)CCO3)CCC1 ZINC000842746042 1132458191 /nfs/dbraw/zinc/45/81/91/1132458191.db2.gz ARCJGBQTRUNYMW-UHFFFAOYSA-N 1 0 297.373 3.930 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+][C@@H]2CC[C@@H]3C[C@@H]3C2)cc1 ZINC000842777732 1132460558 /nfs/dbraw/zinc/46/05/58/1132460558.db2.gz CVLKNQNBHMPCQP-KRJKFKNKSA-N 1 0 270.420 3.544 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]CC2CCC(F)CC2)c1 ZINC000842926675 1132476165 /nfs/dbraw/zinc/47/61/65/1132476165.db2.gz APGVAUVQQHRARV-HIFPTAJRSA-N 1 0 281.371 3.580 20 10 CHCDRO CC[C@@H]([NH2+][C@H](CO)C[C@@H](C)CC)c1ccc(C)cc1O ZINC000842915911 1132476767 /nfs/dbraw/zinc/47/67/67/1132476767.db2.gz HWKSZKIMKSSULO-DUVNUKRYSA-N 1 0 279.424 3.538 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@H]2CCS[C@@H]2C)c(O)c1 ZINC000842930946 1132478033 /nfs/dbraw/zinc/47/80/33/1132478033.db2.gz ZJZCTGSULKEBKM-XQQFMLRXSA-N 1 0 265.422 3.554 20 10 CHCDRO CC(C)(C)c1cccc(C[N@@H+]2CC[C@@](C)(CF)C2)c1O ZINC001143104508 1132502643 /nfs/dbraw/zinc/50/26/43/1132502643.db2.gz UMMCBESQNNRHES-KRWDZBQOSA-N 1 0 279.399 3.871 20 10 CHCDRO Cc1cc2c(cn1)CN(Cc1cccc(C(C)(C)C)c1O)C2 ZINC001143112457 1132504861 /nfs/dbraw/zinc/50/48/61/1132504861.db2.gz RKNSNXLOCCDLCU-UHFFFAOYSA-N 1 0 296.414 3.909 20 10 CHCDRO C[N@H+](Cc1ccc2ncsc2c1)Cc1ccccc1O ZINC001232743300 1132513478 /nfs/dbraw/zinc/51/34/78/1132513478.db2.gz QUIJXGXAIBKYPQ-UHFFFAOYSA-N 1 0 284.384 3.634 20 10 CHCDRO CCC[C@H]1CCCC[N@@H+]1Cc1ccc(N(C)C)cc1O ZINC001232838181 1132528144 /nfs/dbraw/zinc/52/81/44/1132528144.db2.gz BDEPODQEZZOFOF-HNNXBMFYSA-N 1 0 276.424 3.613 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2ccc(N(C)C)cc2O)cc1C ZINC001232840648 1132529230 /nfs/dbraw/zinc/52/92/30/1132529230.db2.gz FETBBSXGVMJCDY-UHFFFAOYSA-N 1 0 298.430 3.707 20 10 CHCDRO C[C@H]1C[N@H+](Cc2ccc(N(C)C)cc2O)Cc2ccccc21 ZINC001232833625 1132529496 /nfs/dbraw/zinc/52/94/96/1132529496.db2.gz BIZFAJXHPNXHLT-AWEZNQCLSA-N 1 0 296.414 3.578 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cc(C)cc(O)c1 ZINC001232881751 1132536081 /nfs/dbraw/zinc/53/60/81/1132536081.db2.gz IRLNXXDTTNBFOK-UHFFFAOYSA-N 1 0 298.430 3.789 20 10 CHCDRO CC[N@H+](Cc1ccc2ncoc2c1)Cc1ccccc1O ZINC001232945595 1132548233 /nfs/dbraw/zinc/54/82/33/1132548233.db2.gz YMQGVFXUNJATSP-UHFFFAOYSA-N 1 0 282.343 3.556 20 10 CHCDRO CC(C)(C)c1ccc(O)c(C[NH+]2CC3CC(C3)C2)c1 ZINC001233286934 1132594462 /nfs/dbraw/zinc/59/44/62/1132594462.db2.gz OZIHPAPKLSMEIF-UHFFFAOYSA-N 1 0 259.393 3.532 20 10 CHCDRO CCO[C@H]1CCC[N@H+](Cc2cc(C(C)(C)C)ccc2O)C1 ZINC001233286431 1132595205 /nfs/dbraw/zinc/59/52/05/1132595205.db2.gz UECBAKULPPPSEV-INIZCTEOSA-N 1 0 291.435 3.691 20 10 CHCDRO Oc1cc(C(F)(F)F)ccc1C[NH+]1C[C@H]2CCC[C@@H]2C1 ZINC001233451509 1132624894 /nfs/dbraw/zinc/62/48/94/1132624894.db2.gz NBXQVYYKSBLXFN-GHMZBOCLSA-N 1 0 285.309 3.643 20 10 CHCDRO CCC[N@H+](CC)Cc1cccc(OC(F)(F)F)c1O ZINC001233726330 1132670595 /nfs/dbraw/zinc/67/05/95/1132670595.db2.gz CFBLTCAJRFUNCB-UHFFFAOYSA-N 1 0 277.286 3.523 20 10 CHCDRO C[C@H]1CCCC[N@@H+]1Cc1cccc(OC(F)(F)F)c1O ZINC001233727135 1132671522 /nfs/dbraw/zinc/67/15/22/1132671522.db2.gz JCGGTAQEDBPQIP-JTQLQIEISA-N 1 0 289.297 3.665 20 10 CHCDRO COc1ccc2c(Nc3ccc4c(c3)CCN4)cc[nH+]c2c1 ZINC001159522387 1132858332 /nfs/dbraw/zinc/85/83/32/1132858332.db2.gz JNSKNQJVKZZYLT-UHFFFAOYSA-N 1 0 291.354 3.955 20 10 CHCDRO CC(C)Nc1ccc(Nc2ccc3c(c2)CC[NH2+]C3)cc1 ZINC001159600281 1132871048 /nfs/dbraw/zinc/87/10/48/1132871048.db2.gz GRFSWIVNRGDHIV-UHFFFAOYSA-N 1 0 281.403 3.896 20 10 CHCDRO CNc1ccc(Nc2ccc(C3CC[NH2+]CC3)cc2)cc1 ZINC001159827538 1132914298 /nfs/dbraw/zinc/91/42/98/1132914298.db2.gz QGQDQBOUEWEATI-UHFFFAOYSA-N 1 0 281.403 3.939 20 10 CHCDRO Cc1cccc(CNc2ccc3c([nH+]2)CCCC3)c1O ZINC001160769342 1132980797 /nfs/dbraw/zinc/98/07/97/1132980797.db2.gz LFUNQZPZNAUCKP-UHFFFAOYSA-N 1 0 268.360 3.587 20 10 CHCDRO COC(C)(C)[C@H](C)[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC000720244745 1133334388 /nfs/dbraw/zinc/33/43/88/1133334388.db2.gz ASVQSZPCYJDCIU-AGIUHOORSA-N 1 0 277.408 3.652 20 10 CHCDRO COc1cccc(C[N@@H+]2CC[C@@H](C3CCCCC3)C2)c1O ZINC001203597088 1133343619 /nfs/dbraw/zinc/34/36/19/1133343619.db2.gz UTVRFFUEPJVPSJ-OAHLLOKOSA-N 1 0 289.419 3.803 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCC23CCCCC3)c1O ZINC001203603173 1133343741 /nfs/dbraw/zinc/34/37/41/1133343741.db2.gz JLWHRASLCHDQKQ-UHFFFAOYSA-N 1 0 275.392 3.700 20 10 CHCDRO COc1ccc(C[N@H+](C)C/C=C/c2ccccc2)c(O)c1 ZINC001203628795 1133345964 /nfs/dbraw/zinc/34/59/64/1133345964.db2.gz IKLIEHNMYDNLBH-RMKNXTFCSA-N 1 0 283.371 3.546 20 10 CHCDRO COc1ccc(O)c(C[NH+]2CCC3(CC[C@@H](F)C3)CC2)c1 ZINC001203680369 1133352808 /nfs/dbraw/zinc/35/28/08/1133352808.db2.gz RORRACYETAETGF-CQSZACIVSA-N 1 0 293.382 3.505 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2ccc3c(c2)CCCO3)cc1F ZINC001203799551 1133369751 /nfs/dbraw/zinc/36/97/51/1133369751.db2.gz HGHGUDKHHJMXGO-UHFFFAOYSA-N 1 0 285.362 3.749 20 10 CHCDRO CCC[N@H+](Cc1ccccc1)Cc1ccc(O)c(O)c1 ZINC001203879337 1133377814 /nfs/dbraw/zinc/37/78/14/1133377814.db2.gz OIDMVQWLAVSIKL-UHFFFAOYSA-N 1 0 271.360 3.510 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)C2CC(F)(F)C2)cc1 ZINC001203937438 1133385662 /nfs/dbraw/zinc/38/56/62/1133385662.db2.gz YSRLRPDVBNZECW-UHFFFAOYSA-N 1 0 282.378 3.762 20 10 CHCDRO CCN(CC)c1ccc(CN2CC[C@@](C)(F)[C@H](F)C2)cc1 ZINC001203939952 1133385770 /nfs/dbraw/zinc/38/57/70/1133385770.db2.gz GUSXOEQCQBWSMQ-IAGOWNOFSA-N 1 0 296.405 3.805 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)cc1)C1CCCCC1 ZINC001203930474 1133385880 /nfs/dbraw/zinc/38/58/80/1133385880.db2.gz VCUMKAUKWGLDQJ-UHFFFAOYSA-N 1 0 260.425 3.907 20 10 CHCDRO CN(C)c1ccc(C[NH+]2CCC3(CC(F)(F)C3)CC2)cc1 ZINC001203931937 1133386193 /nfs/dbraw/zinc/38/61/93/1133386193.db2.gz YXMBTQGAPLDLPC-UHFFFAOYSA-N 1 0 294.389 3.764 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H](F)CC2)cc1 ZINC001203936284 1133387180 /nfs/dbraw/zinc/38/71/80/1133387180.db2.gz LPDHOIBKCYRBAO-MRXNPFEDSA-N 1 0 278.415 3.857 20 10 CHCDRO CC(C)C[N@H+](C)Cc1ccc(N(C)C)c2ccccc12 ZINC001204232862 1133423192 /nfs/dbraw/zinc/42/31/92/1133423192.db2.gz KSLACLICLUUWFB-UHFFFAOYSA-N 1 0 270.420 3.994 20 10 CHCDRO COC[C@H]1CCC[N@@H+]1Cc1ccc(N(C)C)c2ccccc12 ZINC001204232868 1133423284 /nfs/dbraw/zinc/42/32/84/1133423284.db2.gz KWLSMQLZFXBYCT-MRXNPFEDSA-N 1 0 298.430 3.517 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCOCC2(C)C)c2ccccc21 ZINC001204243297 1133424746 /nfs/dbraw/zinc/42/47/46/1133424746.db2.gz VNIPTBPYBBRJQI-UHFFFAOYSA-N 1 0 298.430 3.517 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC[C@H]3C[C@H]32)c2ccccc21 ZINC001204240572 1133424802 /nfs/dbraw/zinc/42/48/02/1133424802.db2.gz YYLYFGNHHDDLEX-IFXJQAMLSA-N 1 0 280.415 3.890 20 10 CHCDRO CC[C@@H](c1ccccc1)[N@H+](C)Cc1ccc(O)cc1O ZINC001204281611 1133428960 /nfs/dbraw/zinc/42/89/60/1133428960.db2.gz XGFULBUOECYOGY-INIZCTEOSA-N 1 0 271.360 3.681 20 10 CHCDRO C[N@@H+](Cc1ccc(N2CCCC2)cc1)C[C@@H]1CC1(C)C ZINC001204320868 1133436896 /nfs/dbraw/zinc/43/68/96/1133436896.db2.gz BSPLWEWYRRIVIV-INIZCTEOSA-N 1 0 272.436 3.765 20 10 CHCDRO C[C@@H]1CCCC[N@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001204324953 1133438142 /nfs/dbraw/zinc/43/81/42/1133438142.db2.gz PQNVKNAJYDXEAZ-MRXNPFEDSA-N 1 0 272.436 3.909 20 10 CHCDRO CC[N@H+](Cc1cc(F)c(F)c(F)c1)Cc1ccccc1O ZINC001204529507 1133459881 /nfs/dbraw/zinc/45/98/81/1133459881.db2.gz GZRGMAJZDSRQTA-UHFFFAOYSA-N 1 0 295.304 3.832 20 10 CHCDRO CC(C)(C)[NH2+]Cc1ccc(Nc2cccc(O)c2O)cc1 ZINC001204700291 1133477149 /nfs/dbraw/zinc/47/71/49/1133477149.db2.gz OMXVDLUPIKBMKS-UHFFFAOYSA-N 1 0 286.375 3.730 20 10 CHCDRO CC(C)C[C@H]1CC[N@H+](Cc2cc(F)c(N(C)C)cc2F)C1 ZINC001204875614 1133494717 /nfs/dbraw/zinc/49/47/17/1133494717.db2.gz OWIKGPXQPWGJND-CYBMUJFWSA-N 1 0 296.405 3.899 20 10 CHCDRO COc1cc(C)c(C[N@H+](C)[C@@H]2CCc3ccccc32)c(O)c1 ZINC001205184897 1133542990 /nfs/dbraw/zinc/54/29/90/1133542990.db2.gz JFNHCXQBSPKPQD-GOSISDBHSA-N 1 0 297.398 3.829 20 10 CHCDRO CC[N@@H+](C/C=C/c1ccc(N(C)C)cc1)CCC1CC1 ZINC001205254146 1133550208 /nfs/dbraw/zinc/55/02/08/1133550208.db2.gz UHCBXIOBBDMASE-AATRIKPKSA-N 1 0 272.436 3.888 20 10 CHCDRO CC(C)c1ccc(O)c(C[N@@H+]2CCOCC3(CCC3)C2)c1 ZINC001205348191 1133566855 /nfs/dbraw/zinc/56/68/55/1133566855.db2.gz YYDTVVYJAFYNFC-UHFFFAOYSA-N 1 0 289.419 3.518 20 10 CHCDRO CC[C@@H]1CC[N@H+](Cc2ccc(Br)cc2O)[C@@H]1C ZINC001205470631 1133580079 /nfs/dbraw/zinc/58/00/79/1133580079.db2.gz BEHYKYJAGMWUDP-GHMZBOCLSA-N 1 0 298.224 3.775 20 10 CHCDRO CC[N@H+](Cc1ccc2[nH]ccc2c1)Cc1ccccc1O ZINC001205606589 1133593604 /nfs/dbraw/zinc/59/36/04/1133593604.db2.gz ZKHNKQKMFRSJJV-UHFFFAOYSA-N 1 0 280.371 3.896 20 10 CHCDRO CCCN(Cc1ccc(SC)o1)c1ccc(C[NH3+])cc1 ZINC001205655877 1133600095 /nfs/dbraw/zinc/60/00/95/1133600095.db2.gz FBWSHFOUFOXWNV-UHFFFAOYSA-N 1 0 290.432 3.877 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@H](C)CC1CCC1 ZINC001205656127 1133600386 /nfs/dbraw/zinc/60/03/86/1133600386.db2.gz MTQJDAKYZLDKKQ-CQSZACIVSA-N 1 0 260.425 3.940 20 10 CHCDRO Cc1cnccc1C[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001205858117 1133623557 /nfs/dbraw/zinc/62/35/57/1133623557.db2.gz YNBCZTHOXQTOLZ-UHFFFAOYSA-N 1 0 295.430 3.622 20 10 CHCDRO Cc1ccoc1CN(C)Cc1c(O)cc(C)cc1Cl ZINC001205999496 1133640406 /nfs/dbraw/zinc/64/04/06/1133640406.db2.gz YRSMRCOHCOBVHX-UHFFFAOYSA-N 1 0 279.767 3.887 20 10 CHCDRO CCc1cccc(C[NH+]2CC(C3CCCCC3)C2)c1O ZINC001206181140 1133668311 /nfs/dbraw/zinc/66/83/11/1133668311.db2.gz YJXPDQHKRHIFNT-UHFFFAOYSA-N 1 0 273.420 3.967 20 10 CHCDRO CCC[C@@H]([NH2+]Cc1cc(F)ccc1O)C1CCCC1 ZINC001206248532 1133675698 /nfs/dbraw/zinc/67/56/98/1133675698.db2.gz YNHYEDSIEGWXDS-OAHLLOKOSA-N 1 0 265.372 3.980 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CC[C@@H](C3CCC3)C2)cc1Cl ZINC001206284812 1133682562 /nfs/dbraw/zinc/68/25/62/1133682562.db2.gz DCLGWSZVJYXJJS-CYBMUJFWSA-N 1 0 279.811 3.976 20 10 CHCDRO CCC[C@H](C[NH2+]Cc1cc(C(C)C)ccc1O)OCC ZINC001206800730 1133749349 /nfs/dbraw/zinc/74/93/49/1133749349.db2.gz MAYAASFNMUOICZ-MRXNPFEDSA-N 1 0 279.424 3.810 20 10 CHCDRO Oc1cccc2c1C[N@H+](CCC1CCCCC1)CC2 ZINC001207260661 1133782789 /nfs/dbraw/zinc/78/27/89/1133782789.db2.gz FKVGOJGFOCMEBJ-UHFFFAOYSA-N 1 0 259.393 3.721 20 10 CHCDRO COc1ccc2oc(C[N@@H+]3Cc4cccc(O)c4C3)cc2c1 ZINC001207242761 1133782847 /nfs/dbraw/zinc/78/28/47/1133782847.db2.gz GIMUXRHLKMXCLX-UHFFFAOYSA-N 1 0 295.338 3.663 20 10 CHCDRO Oc1cccc2c1C[N@H+](CC1CCC(F)(F)CC1)CC2 ZINC001207348982 1133794180 /nfs/dbraw/zinc/79/41/80/1133794180.db2.gz GLWOAYQOFBHHKV-UHFFFAOYSA-N 1 0 281.346 3.576 20 10 CHCDRO Oc1cc(Cl)ccc1C[NH2+][C@@H]1CCc2cc(F)ccc21 ZINC001207723286 1133842027 /nfs/dbraw/zinc/84/20/27/1133842027.db2.gz GMYASLFEXOUWIJ-OAHLLOKOSA-N 1 0 291.753 3.962 20 10 CHCDRO CCCCC1([NH2+]Cc2cc(C)cc(OC)c2O)CC1 ZINC001207757212 1133845782 /nfs/dbraw/zinc/84/57/82/1133845782.db2.gz FSZHIXJOLBULHK-UHFFFAOYSA-N 1 0 263.381 3.522 20 10 CHCDRO CO[C@@H](C[NH2+][C@@H](C)c1ccccc1O)c1ccc(F)cc1 ZINC000183613673 1134672912 /nfs/dbraw/zinc/67/29/12/1134672912.db2.gz WYNGLNAUEUXHML-SJCJKPOMSA-N 1 0 289.350 3.570 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1Oc1ccc(N)cc1 ZINC001217967694 1135033048 /nfs/dbraw/zinc/03/30/48/1135033048.db2.gz UAGDOVWEJLHWBR-BEFAXECRSA-N 1 0 296.414 3.558 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2ccccc2)C[C@H]1Oc1ccc(N)cc1 ZINC001217967696 1135033154 /nfs/dbraw/zinc/03/31/54/1135033154.db2.gz UAGDOVWEJLHWBR-DNVCBOLYSA-N 1 0 296.414 3.558 20 10 CHCDRO CCCc1cc(N=Nc2ccncc2)ccc1OC1C[NH2+]C1 ZINC001218053284 1135050456 /nfs/dbraw/zinc/05/04/56/1135050456.db2.gz VQNUQRLWEKTPIP-UHFFFAOYSA-N 1 0 296.374 3.800 20 10 CHCDRO COC1(CC[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)CCC1 ZINC000315246668 1135152384 /nfs/dbraw/zinc/15/23/84/1135152384.db2.gz RGNRUPFHJYLOAP-UONOGXRCSA-N 1 0 289.419 3.798 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2CCc3ccccc3C2)c1 ZINC000315472608 1135154732 /nfs/dbraw/zinc/15/47/32/1135154732.db2.gz RJVOGXJMEASIHB-BBRMVZONSA-N 1 0 297.398 3.609 20 10 CHCDRO Cc1noc(C)c1[C@H](C)[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000316720410 1135169319 /nfs/dbraw/zinc/16/93/19/1135169319.db2.gz TXHPRQDBPSUDHL-LBPRGKRZSA-N 1 0 299.418 3.525 20 10 CHCDRO C[C@H]([NH2+]CC(C)(C)N(C)C)c1ccc2ccccc2c1O ZINC000020125768 171008884 /nfs/dbraw/zinc/00/88/84/171008884.db2.gz QVXLRLOZWGGLIP-ZDUSSCGKSA-N 1 0 286.419 3.536 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1cccnc1)c1ccccc1O ZINC000020127751 171013387 /nfs/dbraw/zinc/01/33/87/171013387.db2.gz JXOUXQKIEHEHMX-IUODEOHRSA-N 1 0 256.349 3.589 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2CCc3ccccc32)cc1 ZINC000020129632 171017833 /nfs/dbraw/zinc/01/78/33/171017833.db2.gz STXGDVUGZRHDKH-GOSISDBHSA-N 1 0 266.388 3.530 20 10 CHCDRO COc1cccc(C[NH2+][C@H]2CCCc3ccccc32)c1O ZINC000020133584 171021038 /nfs/dbraw/zinc/02/10/38/171021038.db2.gz OQMOFMJFLDMJHU-INIZCTEOSA-N 1 0 283.371 3.568 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]C[C@@H](C)c2ccccc2)c1 ZINC000020137297 171024300 /nfs/dbraw/zinc/02/43/00/171024300.db2.gz MEQXPZUOCXBGOY-KGLIPLIRSA-N 1 0 285.387 3.855 20 10 CHCDRO C[C@@H](C[NH2+][C@H](C)c1ccccc1O)c1ccccc1 ZINC000020137105 171024317 /nfs/dbraw/zinc/02/43/17/171024317.db2.gz NHTSKVCAGUVVSE-UONOGXRCSA-N 1 0 255.361 3.847 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2ccc(N(C)C)cc2)c(C)c1 ZINC000020145991 171031730 /nfs/dbraw/zinc/03/17/30/171031730.db2.gz ZWCBCLFJYHFGIL-UHFFFAOYSA-N 1 0 268.404 3.659 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccccc1F ZINC000020146054 171031746 /nfs/dbraw/zinc/03/17/46/171031746.db2.gz ACLWMVQLGIVFGF-ZDUSSCGKSA-N 1 0 272.367 3.743 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(Cl)cc1)c1ccccc1O ZINC000020209668 171073350 /nfs/dbraw/zinc/07/33/50/171073350.db2.gz SODVBUYTUZOTGU-NSHDSACASA-N 1 0 261.752 3.896 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2cccnc2)c1 ZINC000035628819 172307684 /nfs/dbraw/zinc/30/76/84/172307684.db2.gz ZJIXYQGASNQNNS-QWHCGFSZSA-N 1 0 256.349 3.507 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccccc1)c1ccc(N(C)C)cc1 ZINC000037187688 260073442 /nfs/dbraw/zinc/07/34/42/260073442.db2.gz FQNOSLGXYULJBK-CQSZACIVSA-N 1 0 254.377 3.603 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccc(F)c(F)c1 ZINC000037363185 260094917 /nfs/dbraw/zinc/09/49/17/260094917.db2.gz VBNJVDGBTPXMKN-LLVKDONJSA-N 1 0 289.325 3.751 20 10 CHCDRO C[C@H](NCc1ccc2c(c1)CCO2)c1c(F)cccc1F ZINC000037771882 260116273 /nfs/dbraw/zinc/11/62/73/260116273.db2.gz HRNPFIKKDYEKPB-NSHDSACASA-N 1 0 289.325 3.751 20 10 CHCDRO CC[C@](C)([NH2+]Cc1ccc(N(C)C)cc1)c1nccs1 ZINC000152630454 261066814 /nfs/dbraw/zinc/06/68/14/261066814.db2.gz KKIKAFGATIFTLT-INIZCTEOSA-N 1 0 289.448 3.624 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](O)c1ccccc1)c1ccc(N(C)C)cc1 ZINC000153831087 261083494 /nfs/dbraw/zinc/08/34/94/261083494.db2.gz XGQNBEUTKMSXTM-RTBURBONSA-N 1 0 298.430 3.527 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](OC)c1ccccc1)c1ccccc1O ZINC000155259241 261099790 /nfs/dbraw/zinc/09/97/90/261099790.db2.gz XFVTUFBZVOBTMR-WMZOPIPTSA-N 1 0 285.387 3.821 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CCCO)c1ccccc1)c1ccccc1O ZINC000155983660 261111191 /nfs/dbraw/zinc/11/11/91/261111191.db2.gz COXIKLJYSOTAPO-MSOLQXFVSA-N 1 0 299.414 3.947 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)CC(C)(C)OC)c1ccccc1O ZINC000156052370 261112433 /nfs/dbraw/zinc/11/24/33/261112433.db2.gz SMOLYRDZQXHDDK-JSGCOSHPSA-N 1 0 265.397 3.637 20 10 CHCDRO CC[C@H]([NH2+]CC1(CCO)CCCCC1)c1ccccc1O ZINC000156287078 261119070 /nfs/dbraw/zinc/11/90/70/261119070.db2.gz BYCSHMGUQXYWCC-INIZCTEOSA-N 1 0 291.435 3.766 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCOC2(CCCC2)C1)c1ccccc1O ZINC000156766141 261131735 /nfs/dbraw/zinc/13/17/35/261131735.db2.gz JAEXAPGNQBSFGC-ZBFHGGJFSA-N 1 0 289.419 3.925 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCO[C@H](C2CC2)C1)c1cc(Cl)ccc1O ZINC000157884668 261154557 /nfs/dbraw/zinc/15/45/57/261154557.db2.gz YIJYIBHAKFQSRF-HICWGWBUSA-N 1 0 295.810 3.654 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCCOC1)c1ccc(N2CCCCC2)cc1 ZINC000177926687 261720787 /nfs/dbraw/zinc/72/07/87/261720787.db2.gz VYOJKPXJZGDUNN-DOTOQJQBSA-N 1 0 288.435 3.507 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1ccccc1O)c1ccncc1 ZINC000183529149 261978924 /nfs/dbraw/zinc/97/89/24/261978924.db2.gz ZHMKWWMJOQPOBC-SWLSCSKDSA-N 1 0 256.349 3.589 20 10 CHCDRO Cc1cncc([C@@H](C)[NH2+]Cc2ccc(N3CCCC3)cc2)c1 ZINC000184276580 262014936 /nfs/dbraw/zinc/01/49/36/262014936.db2.gz NNPHZWPABIWWRL-MRXNPFEDSA-N 1 0 295.430 3.841 20 10 CHCDRO CCOCCCC[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000185071432 262039954 /nfs/dbraw/zinc/03/99/54/262039954.db2.gz GAUPAOHJXZOQAP-CQSZACIVSA-N 1 0 291.435 3.738 20 10 CHCDRO CCOCCCC[NH2+][C@@H](C)c1cc2c(cc1O)CCCC2 ZINC000185071418 262040269 /nfs/dbraw/zinc/04/02/69/262040269.db2.gz GAUPAOHJXZOQAP-AWEZNQCLSA-N 1 0 291.435 3.738 20 10 CHCDRO CCc1nc(CC[NH2+][C@H](C)c2cc(C)ccc2O)cs1 ZINC000185310650 262049956 /nfs/dbraw/zinc/04/99/56/262049956.db2.gz BCKKSORAVKSMTR-GFCCVEGCSA-N 1 0 290.432 3.613 20 10 CHCDRO CC[C@H](C)[C@H](O)C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000185438886 262054610 /nfs/dbraw/zinc/05/46/10/262054610.db2.gz DDRSNLBTGONYTA-GDZNZVCISA-N 1 0 287.403 3.603 20 10 CHCDRO COc1cc(C)ccc1C[NH2+][C@H](C)c1cc(F)ccc1O ZINC000185715546 262067910 /nfs/dbraw/zinc/06/79/10/262067910.db2.gz BOSMYLMDOQEIPO-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO COc1cc(C)ccc1C[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000185715527 262068089 /nfs/dbraw/zinc/06/80/89/262068089.db2.gz BOSMYLMDOQEIPO-LBPRGKRZSA-N 1 0 289.350 3.699 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCC[C@H]2OCC[C@@H]21)c1cc(Cl)ccc1O ZINC000185771757 262069672 /nfs/dbraw/zinc/06/96/72/262069672.db2.gz AASAGWINFRAWIS-UOJODKQESA-N 1 0 295.810 3.654 20 10 CHCDRO COc1cc(C)cc(C[NH2+][C@H](C)c2ccc(C)cc2O)c1 ZINC000186156317 262081723 /nfs/dbraw/zinc/08/17/23/262081723.db2.gz XUSCBDMWCUTQOS-CQSZACIVSA-N 1 0 285.387 3.868 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](CCO)c1ccccc1)c1ccccc1O ZINC000186207843 262084548 /nfs/dbraw/zinc/08/45/48/262084548.db2.gz HSXDEFPATSDSEA-FUHWJXTLSA-N 1 0 299.414 3.599 20 10 CHCDRO C[C@@H]([NH2+]CCCCCCO)c1ccc2ccccc2c1O ZINC000186231341 262312231 /nfs/dbraw/zinc/31/22/31/262312231.db2.gz SCVUYGCUTLIWEY-CQSZACIVSA-N 1 0 287.403 3.749 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCCCOC(C)C)c(O)c1 ZINC000186530077 262315792 /nfs/dbraw/zinc/31/57/92/262315792.db2.gz RRLFOEDDCUTMCR-CQSZACIVSA-N 1 0 265.397 3.556 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)[C@@H]1CCOC1)c1cccc(Cl)c1[O-] ZINC000287850623 263102880 /nfs/dbraw/zinc/10/28/80/263102880.db2.gz WSWOTKSTSNZCDU-WDMOLILDSA-N 1 0 283.799 3.511 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1COc2ccc(C)cc21)c1ccccc1O ZINC000368369949 267166602 /nfs/dbraw/zinc/16/66/02/267166602.db2.gz IUIYJQSUVODHQF-HZPDHXFCSA-N 1 0 283.371 3.875 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CN(C)Cc3ccccc32)c(O)c1 ZINC000370375080 267313061 /nfs/dbraw/zinc/31/30/61/267313061.db2.gz QWWMVJFOAANCDB-KBXCAEBGSA-N 1 0 296.414 3.538 20 10 CHCDRO COc1ccc(C[NH2+][C@H]2CCOC3(CCCC3)C2)cc1C ZINC000268959942 328187254 /nfs/dbraw/zinc/18/72/54/328187254.db2.gz ICQQPDYYESOCAM-INIZCTEOSA-N 1 0 289.419 3.585 20 10 CHCDRO C[C@@H]([NH2+]C1(c2ccccc2)CC1)c1ccccc1O ZINC000272845331 328200987 /nfs/dbraw/zinc/20/09/87/328200987.db2.gz KHQDCRBGDORHFL-CYBMUJFWSA-N 1 0 253.345 3.732 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@H](C)c2nccs2)c(O)c1 ZINC000285128803 328247236 /nfs/dbraw/zinc/24/72/36/328247236.db2.gz LKPJSVROZRMMAZ-QWHCGFSZSA-N 1 0 290.432 3.920 20 10 CHCDRO CC(C)Cc1ccccc1C[NH2+]Cc1ccccc1O ZINC000527732517 330278373 /nfs/dbraw/zinc/27/83/73/330278373.db2.gz JLMJHTUORDPSOP-UHFFFAOYSA-N 1 0 269.388 3.881 20 10 CHCDRO CCC([NH2+]Cc1cc(C)ccc1O)(C1CC1)C1CC1 ZINC000527761980 330281398 /nfs/dbraw/zinc/28/13/98/330281398.db2.gz GUSMKIUYRJSEPV-UHFFFAOYSA-N 1 0 259.393 3.759 20 10 CHCDRO C[C@@H]([NH2+]CC[C@H]1CCCOC1)c1cc(Cl)ccc1O ZINC000527925215 330296560 /nfs/dbraw/zinc/29/65/60/330296560.db2.gz IJEZJULSIRSTED-VXGBXAGGSA-N 1 0 283.799 3.513 20 10 CHCDRO COCCC1CC[NH+]([C@@H](C)c2cc(C)ccc2O)CC1 ZINC000527931101 330297446 /nfs/dbraw/zinc/29/74/46/330297446.db2.gz BLQVLCFROGWVRX-AWEZNQCLSA-N 1 0 277.408 3.510 20 10 CHCDRO CC[C@@H]([NH2+]CC[C@H]1CCCOC1)c1ccc(C)cc1O ZINC000527935760 330298062 /nfs/dbraw/zinc/29/80/62/330298062.db2.gz ZAMULROARGXSMU-GDBMZVCRSA-N 1 0 277.408 3.558 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2cccnc2C)c(O)c1 ZINC000527986285 330298661 /nfs/dbraw/zinc/29/86/61/330298661.db2.gz KYUOAEKADGLJBY-CQSZACIVSA-N 1 0 270.376 3.563 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@@H](c1ccccn1)C1CCC1)CC2 ZINC000527969286 330301463 /nfs/dbraw/zinc/30/14/63/330301463.db2.gz SWOFYKQFMCQTNX-DNVCBOLYSA-N 1 0 294.398 3.906 20 10 CHCDRO CC(C)[C@H](CCO)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000230664220 333320056 /nfs/dbraw/zinc/32/00/56/333320056.db2.gz SVLDXMFOWJHGCX-GUYCJALGSA-N 1 0 287.403 3.603 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccc2ccccc2c1O)[C@H]1CCOC1 ZINC000252814062 334394493 /nfs/dbraw/zinc/39/44/93/334394493.db2.gz SJFWPODATBDRFA-IPYPFGDCSA-N 1 0 285.387 3.621 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@H]2CCSC2)cc1 ZINC000280208436 520287872 /nfs/dbraw/zinc/28/78/72/520287872.db2.gz VZDGMEOXBGCOKH-UONOGXRCSA-N 1 0 278.465 3.546 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](C)C2CCOCC2)cc1 ZINC000126131948 520288351 /nfs/dbraw/zinc/28/83/51/520288351.db2.gz IEZIQQURGLTHEC-CABCVRRESA-N 1 0 290.451 3.608 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2cccnc2)cc1 ZINC000020127953 520907332 /nfs/dbraw/zinc/90/73/32/520907332.db2.gz HNXQYKURAGNWNY-HNNXBMFYSA-N 1 0 283.419 3.779 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]Cc2ccc(C)nc2)cc1 ZINC000057591298 520908845 /nfs/dbraw/zinc/90/88/45/520908845.db2.gz NYOFVZMBIRLLKO-UHFFFAOYSA-N 1 0 283.419 3.526 20 10 CHCDRO CC1CCN(c2ccc(C[NH2+]Cc3cc[nH]c3)cc2)CC1 ZINC000086253357 521040929 /nfs/dbraw/zinc/04/09/29/521040929.db2.gz CNSRWXDMVGJJRL-UHFFFAOYSA-N 1 0 283.419 3.541 20 10 CHCDRO CCc1ccccc1C[NH2+][C@@H](C)c1ccccc1O ZINC000084200318 521843916 /nfs/dbraw/zinc/84/39/16/521843916.db2.gz NYLPLVSSOHSXPF-ZDUSSCGKSA-N 1 0 255.361 3.805 20 10 CHCDRO CC[C@H]([NH2+]CCCOCC1CC1)c1ccc(C)cc1O ZINC000280130211 522585211 /nfs/dbraw/zinc/58/52/11/522585211.db2.gz OWGWGUFRXKUOQC-INIZCTEOSA-N 1 0 277.408 3.558 20 10 CHCDRO CC[C@H]([NH2+]CC[C@@H]1CCO[C@H](C)C1)c1ccccc1O ZINC000274776065 522600373 /nfs/dbraw/zinc/60/03/73/522600373.db2.gz OAEUXLLVLWDWOB-FMKPAKJESA-N 1 0 277.408 3.638 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCC[C@H]2OCC[C@H]21)c1ccc(C)cc1O ZINC000280036856 522716309 /nfs/dbraw/zinc/71/63/09/522716309.db2.gz IOLQICUMMHZGQI-LISAXSMJSA-N 1 0 289.419 3.699 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1nnc(C)s1)c1ccc(C)cc1O ZINC000280126272 522745227 /nfs/dbraw/zinc/74/52/27/522745227.db2.gz ORGKINCXGNHVPP-MFKMUULPSA-N 1 0 291.420 3.662 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1CCSC1)c1ccc(N(C)C)cc1 ZINC000280200923 522855377 /nfs/dbraw/zinc/85/53/77/522855377.db2.gz VNPGSGFTZGQUDC-XJKSGUPXSA-N 1 0 278.465 3.546 20 10 CHCDRO CO[C@@H](C)[C@H](C)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000276071221 523442472 /nfs/dbraw/zinc/44/24/72/523442472.db2.gz LYSYHVWGEXLREU-KBPBESRZSA-N 1 0 285.387 3.572 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)c2ccccc2OC)cc1C ZINC000035052663 524083836 /nfs/dbraw/zinc/08/38/36/524083836.db2.gz IGDFBUBUPAHVJY-AWEZNQCLSA-N 1 0 285.387 3.863 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)c2ccc(C)o2)cc1C ZINC000035052689 524089043 /nfs/dbraw/zinc/08/90/43/524089043.db2.gz WROIFMJYSSHVKE-CYBMUJFWSA-N 1 0 259.349 3.756 20 10 CHCDRO COc1ccc(F)cc1[C@@H](C)[NH2+]Cc1cc(C)ccc1O ZINC000071407697 524328988 /nfs/dbraw/zinc/32/89/88/524328988.db2.gz VVBXWADCHJXYNM-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO C[C@H](Cc1cccs1)[NH2+][C@@H](C)c1ccccc1O ZINC000036993103 524755185 /nfs/dbraw/zinc/75/51/85/524755185.db2.gz MTBDAUBWCHPXFY-NEPJUHHUSA-N 1 0 261.390 3.736 20 10 CHCDRO Cc1cc(C[NH2+][C@@H](C)c2ccc(N3CCCCC3)cc2)on1 ZINC000125494856 524765757 /nfs/dbraw/zinc/76/57/57/524765757.db2.gz AXGVQLMRUDQUCM-HNNXBMFYSA-N 1 0 299.418 3.824 20 10 CHCDRO Cc1ccccc1C(C)(C)[NH2+]Cc1ccccc1O ZINC000292982458 525072611 /nfs/dbraw/zinc/07/26/11/525072611.db2.gz LIYPDVIBAJCHKW-UHFFFAOYSA-N 1 0 255.361 3.726 20 10 CHCDRO C[C@H]([NH2+]C1CC(F)(F)C1)c1cc2c(cc1O)CCCC2 ZINC000277200031 525288402 /nfs/dbraw/zinc/28/84/02/525288402.db2.gz VQNCHDRTBMMTBY-JTQLQIEISA-N 1 0 281.346 3.719 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](C)[C@H](C)c2ccco2)cc1C ZINC000131069014 525315072 /nfs/dbraw/zinc/31/50/72/525315072.db2.gz CPCZWYUFRLRKAW-CYBMUJFWSA-N 1 0 259.349 3.795 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCSC1)c1cc2c(cc1O)CCCC2 ZINC000280120756 525418845 /nfs/dbraw/zinc/41/88/45/525418845.db2.gz PNLURBGVMFFKBF-QWHCGFSZSA-N 1 0 291.460 3.675 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(F)c(F)c1)c1ccc(N(C)C)cc1 ZINC000049577474 525441198 /nfs/dbraw/zinc/44/11/98/525441198.db2.gz QFAMJDGZKZATJY-LBPRGKRZSA-N 1 0 290.357 3.882 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccco1 ZINC000037260258 525446153 /nfs/dbraw/zinc/44/61/53/525446153.db2.gz DFPUUASHODMLOD-AWEZNQCLSA-N 1 0 270.376 3.731 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(n1)CCCC2)c1ccccc1O ZINC000278170610 525452016 /nfs/dbraw/zinc/45/20/16/525452016.db2.gz AZYTYSOQZXUTKO-ZDUSSCGKSA-N 1 0 282.387 3.517 20 10 CHCDRO CSCCC[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000069434184 525481097 /nfs/dbraw/zinc/48/10/97/525481097.db2.gz MGRZXUYJXNSZNG-LBPRGKRZSA-N 1 0 275.417 3.949 20 10 CHCDRO Cc1ccsc1C[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000094874871 525860056 /nfs/dbraw/zinc/86/00/56/525860056.db2.gz QRCHDDVMFDLFLF-LBPRGKRZSA-N 1 0 261.390 3.921 20 10 CHCDRO COc1cccc(C[N@H+](Cc2cccs2)C2CC2)c1O ZINC000130253410 525924423 /nfs/dbraw/zinc/92/44/23/525924423.db2.gz YVNGWHOVHKNHPA-UHFFFAOYSA-N 1 0 289.400 3.627 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2COc3ccccc32)c(O)c1C ZINC000290334258 525925575 /nfs/dbraw/zinc/92/55/75/525925575.db2.gz OZYDGFKVKWKZBU-GJZGRUSLSA-N 1 0 297.398 3.836 20 10 CHCDRO COc1cccc(C[NH2+]C2CC(c3ccccc3C)C2)c1O ZINC000266178260 526012116 /nfs/dbraw/zinc/01/21/16/526012116.db2.gz UJMNIZKXJWVSNQ-UHFFFAOYSA-N 1 0 297.398 3.745 20 10 CHCDRO Oc1ccccc1C[NH2+][C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000037141684 526374402 /nfs/dbraw/zinc/37/44/02/526374402.db2.gz SVSPKHMHTROQBZ-RYUDHWBXSA-N 1 0 273.298 3.603 20 10 CHCDRO FC(F)(F)[C@@H]1CCC[C@H]([NH2+]Cc2ccc3c(c2)CCO3)C1 ZINC000037363548 527677752 /nfs/dbraw/zinc/67/77/52/527677752.db2.gz XEOXQBZOXBVWHX-KGLIPLIRSA-N 1 0 299.336 3.832 20 10 CHCDRO CCC(C)(C)OCC[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000308687296 1118681842 /nfs/dbraw/zinc/68/18/42/1118681842.db2.gz BBAWKDFOHNARNP-AWEZNQCLSA-N 1 0 278.440 3.608 20 10 CHCDRO CCN(C)c1ccc(C[NH2+]C(C(C)C)C(C)C)cc1 ZINC001192615589 1122652587 /nfs/dbraw/zinc/65/25/87/1122652587.db2.gz HOJUBXMSNYXWBC-UHFFFAOYSA-N 1 0 262.441 3.913 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCC[C@@H](C)O1)c1ccc(Cl)cc1O ZINC000850534044 1123286083 /nfs/dbraw/zinc/28/60/83/1123286083.db2.gz FSZRHRKZCGTOOB-WZRBSPASSA-N 1 0 283.799 3.654 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1C(C)(C)C1(F)F)c1ccccc1O ZINC000850553636 1123289697 /nfs/dbraw/zinc/28/96/97/1123289697.db2.gz ZTLVEOLXQCCNEM-YPMHNXCESA-N 1 0 269.335 3.724 20 10 CHCDRO Cc1scc(C[NH2+]Cc2c(C)cccc2O)c1C ZINC000877674594 1125062825 /nfs/dbraw/zinc/06/28/25/1125062825.db2.gz SKBBXIOBDXOWMI-UHFFFAOYSA-N 1 0 261.390 3.669 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCCC[C@](C)(F)C2)c1O ZINC001140178611 1131673131 /nfs/dbraw/zinc/67/31/31/1131673131.db2.gz QMFYZUZKSAZRFS-INIZCTEOSA-N 1 0 265.372 3.723 20 10 CHCDRO CC[C@@H]([NH2+][C@H](COC)CC(C)(C)C)c1ccccc1O ZINC000845993344 1131679319 /nfs/dbraw/zinc/67/93/19/1131679319.db2.gz YGPOALJTIORNFW-DZGCQCFKSA-N 1 0 279.424 3.884 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+][C@@H]1CCOC2(CCCC2)C1 ZINC000136705724 1125531382 /nfs/dbraw/zinc/53/13/82/1125531382.db2.gz TUWQPIMQANOEEZ-CQSZACIVSA-N 1 0 295.810 3.627 20 10 CHCDRO CCC[C@@H](CC)[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC000134106116 1125532397 /nfs/dbraw/zinc/53/23/97/1125532397.db2.gz SQPABHNDGCYBFD-OAHLLOKOSA-N 1 0 290.451 3.832 20 10 CHCDRO CCC(C)(CC)[NH2+]Cc1cc(Cl)cc(OC)c1O ZINC000184708031 1129238151 /nfs/dbraw/zinc/23/81/51/1129238151.db2.gz UXXCLVWLMUWISX-UHFFFAOYSA-N 1 0 271.788 3.723 20 10 CHCDRO C[N@H+](CCC1CCOCC1)Cc1c(O)ccc2ccccc21 ZINC000121174647 1125557350 /nfs/dbraw/zinc/55/73/50/1125557350.db2.gz KQILDMWETRNLPT-UHFFFAOYSA-N 1 0 299.414 3.794 20 10 CHCDRO C[N@@H+]1Cc2ccc(NCc3c(O)cccc3Cl)cc2C1 ZINC000121283429 1125559520 /nfs/dbraw/zinc/55/95/20/1125559520.db2.gz YUFORRUDGFORGZ-UHFFFAOYSA-N 1 0 288.778 3.603 20 10 CHCDRO C[C@@H]1CC[C@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000135166529 1125580223 /nfs/dbraw/zinc/58/02/23/1125580223.db2.gz GASYKDIUNRZAPU-WBVHZDCISA-N 1 0 272.436 3.955 20 10 CHCDRO Cc1ccccc1C1CC([NH2+]Cc2ccccc2O)C1 ZINC000135235582 1125580887 /nfs/dbraw/zinc/58/08/87/1125580887.db2.gz WOVZWPPIAGYQFC-UHFFFAOYSA-N 1 0 267.372 3.736 20 10 CHCDRO c1cc(N2CCCCC2)ccc1C[NH2+][C@@H]1CCCSC1 ZINC000135704082 1125595573 /nfs/dbraw/zinc/59/55/73/1125595573.db2.gz WASYMSHCNFDSBP-MRXNPFEDSA-N 1 0 290.476 3.662 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)c1cc[nH]c(=O)c1 ZINC000841757262 1125596617 /nfs/dbraw/zinc/59/66/17/1125596617.db2.gz MWEJKWMZYRUSLJ-ZJUUUORDSA-N 1 0 292.766 3.558 20 10 CHCDRO CCO[C@H]1C[C@H]([NH2+]Cc2ccccc2O)C12CCCCC2 ZINC000135805505 1125600856 /nfs/dbraw/zinc/60/08/56/1125600856.db2.gz MJSANSGXYCEOTD-IRXDYDNUSA-N 1 0 289.419 3.610 20 10 CHCDRO Oc1ccccc1C[NH2+]C1(c2ccc(F)cc2F)CCC1 ZINC000136136353 1125621948 /nfs/dbraw/zinc/62/19/48/1125621948.db2.gz SPCVWHAZQZGDAC-UHFFFAOYSA-N 1 0 289.325 3.839 20 10 CHCDRO CC[NH+](CC)CCC[C@@H](C)[NH2+][C@H](C)c1c([O-])cccc1F ZINC000886487855 1125680110 /nfs/dbraw/zinc/68/01/10/1125680110.db2.gz XYAMTAJNJMWBLW-ZIAGYGMSSA-N 1 0 296.430 3.692 20 10 CHCDRO C[C@H]([NH2+]C[C@@]1(C)CCOC2(CCC2)C1)c1ccccc1O ZINC000886774540 1125716112 /nfs/dbraw/zinc/71/61/12/1125716112.db2.gz PNYQOIYHCMFKNK-YOEHRIQHSA-N 1 0 289.419 3.782 20 10 CHCDRO COC[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1ccccc1 ZINC000089668354 1125736682 /nfs/dbraw/zinc/73/66/82/1125736682.db2.gz WOCXOGIPIUHUPO-HNAYVOBHSA-N 1 0 298.430 3.791 20 10 CHCDRO Cc1ccc(O)c(C[NH+]2CCC(OC3CCCC3)CC2)c1 ZINC000092758978 1125761588 /nfs/dbraw/zinc/76/15/88/1125761588.db2.gz RUZJFNVDQNQZGQ-UHFFFAOYSA-N 1 0 289.419 3.624 20 10 CHCDRO C[C@H]([NH2+]Cc1cnc(Cl)s1)c1ccc(N(C)C)cc1 ZINC000718187617 1129257975 /nfs/dbraw/zinc/25/79/75/1129257975.db2.gz PHWBABIROVPZBS-JTQLQIEISA-N 1 0 295.839 3.713 20 10 CHCDRO CCSCC[C@H](C)[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC000769551015 1129917321 /nfs/dbraw/zinc/91/73/21/1129917321.db2.gz UNXGZNSSSQVDHV-AWEZNQCLSA-N 1 0 280.481 3.716 20 10 CHCDRO COc1ccc(O)c(C[N@H+](Cc2cccs2)C2CC2)c1 ZINC000179679756 1126831483 /nfs/dbraw/zinc/83/14/83/1126831483.db2.gz DCOOWYSBYYLVHE-UHFFFAOYSA-N 1 0 289.400 3.627 20 10 CHCDRO Cc1nc(C)c([C@@H](C)[N@H+](C)Cc2cc(F)ccc2O)s1 ZINC000180126841 1126839588 /nfs/dbraw/zinc/83/95/88/1126839588.db2.gz ATJZRTMMMWINHD-SNVBAGLBSA-N 1 0 294.395 3.798 20 10 CHCDRO CC(C)([NH2+]Cc1cc(F)ccc1O)c1ccc(F)c(F)c1 ZINC000180825878 1126849402 /nfs/dbraw/zinc/84/94/02/1126849402.db2.gz QGIMBRHZXIQKFD-UHFFFAOYSA-N 1 0 295.304 3.834 20 10 CHCDRO Cc1cccc(C[NH2+]C2(c3cccc(F)c3)CC2)c1O ZINC000182358395 1126871051 /nfs/dbraw/zinc/87/10/51/1126871051.db2.gz GPPVEKODZURWJW-UHFFFAOYSA-N 1 0 271.335 3.619 20 10 CHCDRO C[C@@H]([NH2+]CCCc1nc2ccccc2[nH]1)c1ccccc1O ZINC000183450546 1126887597 /nfs/dbraw/zinc/88/75/97/1126887597.db2.gz GDBCAHGDHAVDEY-CYBMUJFWSA-N 1 0 295.386 3.552 20 10 CHCDRO COc1cc(Cl)ccc1C[NH2+][C@H](C)c1ccccc1O ZINC000183503942 1126887884 /nfs/dbraw/zinc/88/78/84/1126887884.db2.gz GTBKUWPPYBMOAP-LLVKDONJSA-N 1 0 291.778 3.905 20 10 CHCDRO CC(C)[C@H](C[NH2+][C@H](C)c1ccccc1O)c1cccnc1 ZINC000183546885 1126889016 /nfs/dbraw/zinc/88/90/16/1126889016.db2.gz ZUTBNDCSOPEEOV-PBHICJAKSA-N 1 0 284.403 3.878 20 10 CHCDRO C[C@@H](C[C@H](O)c1ccccc1)[NH2+][C@@H](C)c1ccccc1O ZINC000183587306 1126890056 /nfs/dbraw/zinc/89/00/56/1126890056.db2.gz FQERAZBIWBLTRS-DEYYWGMASA-N 1 0 285.387 3.555 20 10 CHCDRO Cc1cc(O)c(C[NH2+]Cc2ccc(C(C)(C)O)cc2)cc1C ZINC000187506101 1126910800 /nfs/dbraw/zinc/91/08/00/1126910800.db2.gz YKPPKWWGAAKVJP-UHFFFAOYSA-N 1 0 299.414 3.526 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc2c(c1)COC2 ZINC000268728956 1127021429 /nfs/dbraw/zinc/02/14/29/1127021429.db2.gz LHWYTJRHAGBDGD-CQSZACIVSA-N 1 0 296.414 3.634 20 10 CHCDRO CC[N@H+](Cc1ccc(N2CCC(OC)CC2)cc1)C(C)C ZINC000269492400 1127040890 /nfs/dbraw/zinc/04/08/90/1127040890.db2.gz MOSYUONIRLQEOO-UHFFFAOYSA-N 1 0 290.451 3.532 20 10 CHCDRO CCOc1cccc(C[N@H+](Cc2ccco2)C(C)C)c1O ZINC000271037231 1127066015 /nfs/dbraw/zinc/06/60/15/1127066015.db2.gz GLDJFFCLMDWXMD-UHFFFAOYSA-N 1 0 289.375 3.795 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H]2CCCc3cn[nH]c32)cc1 ZINC000271436406 1127081495 /nfs/dbraw/zinc/08/14/95/1127081495.db2.gz BQFCUQXAGVXDIE-CXAGYDPISA-N 1 0 298.434 3.594 20 10 CHCDRO COC1(CC[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)CCC1 ZINC000815642011 1131014612 /nfs/dbraw/zinc/01/46/12/1131014612.db2.gz OTUZKGVFSANWNH-LBPRGKRZSA-N 1 0 297.826 3.964 20 10 CHCDRO CC(C)C1([NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)CC1 ZINC000815647599 1131015934 /nfs/dbraw/zinc/01/59/34/1131015934.db2.gz PGUDZWBDTYDRFV-CMPLNLGQSA-N 1 0 263.356 3.858 20 10 CHCDRO COc1cc(O)c(C[N@H+](C)CC2CCCC2)c(Cl)c1 ZINC001236803354 1131012841 /nfs/dbraw/zinc/01/28/41/1131012841.db2.gz MLOQNFVKARBMRR-UHFFFAOYSA-N 1 0 283.799 3.676 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cn2cc(C)ccc2n1)c1ccccc1O ZINC000271691005 1127097004 /nfs/dbraw/zinc/09/70/04/1127097004.db2.gz KHMNEMDKFIPIAY-MRXNPFEDSA-N 1 0 295.386 3.589 20 10 CHCDRO CCCN(Cc1ccccc1)c1ccc(C[NH3+])cc1 ZINC000034654613 1127117297 /nfs/dbraw/zinc/11/72/97/1127117297.db2.gz KBGHACBGMMIZKI-UHFFFAOYSA-N 1 0 254.377 3.562 20 10 CHCDRO C[C@@]1(F)CCC[N@H+](Cc2c(O)ccc(F)c2Cl)CC1 ZINC001237121164 1131054039 /nfs/dbraw/zinc/05/40/39/1131054039.db2.gz KLIURFUTRFTBBC-CQSZACIVSA-N 1 0 289.753 3.899 20 10 CHCDRO CC1CC[NH+](Cc2cc(C(F)(F)F)ccc2O)CC1 ZINC001237138650 1131054720 /nfs/dbraw/zinc/05/47/20/1131054720.db2.gz XFNWOFCFTXVUOO-UHFFFAOYSA-N 1 0 273.298 3.643 20 10 CHCDRO CC[C@@H](CSC)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000163860509 1127145115 /nfs/dbraw/zinc/14/51/15/1127145115.db2.gz HWKBAYZHBDFISK-INIZCTEOSA-N 1 0 292.492 3.908 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)C[C@H](O)c1ccco1)c1ccccc1O ZINC000156416154 1127154719 /nfs/dbraw/zinc/15/47/19/1127154719.db2.gz FNIPOUOUUCNGSN-INWMFGNUSA-N 1 0 289.375 3.538 20 10 CHCDRO CCOc1ccc(C[NH2+][C@@H](CC)CC(F)(F)F)c(O)c1 ZINC000760660837 1127155225 /nfs/dbraw/zinc/15/52/25/1127155225.db2.gz PVQDPIVGSGTJAZ-NSHDSACASA-N 1 0 291.313 3.612 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H](C)c2c(F)cncc2F)cc1C ZINC000285416391 1127226553 /nfs/dbraw/zinc/22/65/53/1127226553.db2.gz GETVSPWHZKDUHB-LLVKDONJSA-N 1 0 292.329 3.533 20 10 CHCDRO CC[C@@H]1C[C@H](C)CC[C@@H]1[NH2+]CCc1ccc(N)cc1 ZINC000817957131 1131191568 /nfs/dbraw/zinc/19/15/68/1131191568.db2.gz JJRCQWWRVABOCY-UNEWFSDZSA-N 1 0 260.425 3.616 20 10 CHCDRO CSc1cccc(F)c1C[NH2+]Cc1cccc(C)c1O ZINC000289353169 1127382523 /nfs/dbraw/zinc/38/25/23/1127382523.db2.gz JKHSAQFCFHCGMW-UHFFFAOYSA-N 1 0 291.391 3.851 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CCC[C@@H]1C1CCCC1 ZINC000226563144 1127410952 /nfs/dbraw/zinc/41/09/52/1127410952.db2.gz OSZUWEZZXMIBPE-OAHLLOKOSA-N 1 0 263.356 3.686 20 10 CHCDRO CC[C@H]1CCC[N@H+](Cc2cc(F)ccc2O)CC1 ZINC000226565499 1127411529 /nfs/dbraw/zinc/41/15/29/1127411529.db2.gz MICXBYINGAQXOB-LBPRGKRZSA-N 1 0 251.345 3.543 20 10 CHCDRO C[C@H]([NH2+]Cc1cc(F)ccc1O)c1ccc(F)cc1F ZINC000226583549 1127412375 /nfs/dbraw/zinc/41/23/75/1127412375.db2.gz CWDAPIUPYIJLNO-VIFPVBQESA-N 1 0 281.277 3.660 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H](c2ccccc2)C2CC2)c1O ZINC000158090492 1127437433 /nfs/dbraw/zinc/43/74/33/1127437433.db2.gz OIRFFHPAOIWZJQ-KRWDZBQOSA-N 1 0 267.372 3.942 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1C[C@H]1C)c1ccc2ccccc2c1O ZINC000168740732 1127464146 /nfs/dbraw/zinc/46/41/46/1127464146.db2.gz BYVWXUMUCATGPU-MBNYWOFBSA-N 1 0 255.361 3.852 20 10 CHCDRO COc1cc(Cl)cc(C[N@H+](CC2CC2)C(C)C)c1O ZINC000761192530 1127517049 /nfs/dbraw/zinc/51/70/49/1127517049.db2.gz QRIPYYXEUMFXCA-UHFFFAOYSA-N 1 0 283.799 3.675 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CCC[C@@H]2C2CCC2)c1O ZINC000761195816 1127517606 /nfs/dbraw/zinc/51/76/06/1127517606.db2.gz OYZKPGXFHQCBIG-CQSZACIVSA-N 1 0 295.810 3.819 20 10 CHCDRO C[C@H](CCCC(F)(F)F)[NH2+]Cc1ccccc1O ZINC000228407680 1127555670 /nfs/dbraw/zinc/55/56/70/1127555670.db2.gz IWNSRKMJLBSCBF-SNVBAGLBSA-N 1 0 261.287 3.603 20 10 CHCDRO CC[C@@H](C)C[N@H+](C)Cc1cc(Cl)cc(OC)c1O ZINC000228629755 1127576160 /nfs/dbraw/zinc/57/61/60/1127576160.db2.gz PLRNPRFMKKGAEL-SNVBAGLBSA-N 1 0 271.788 3.532 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]C2(C)CCCCC2)c1O ZINC000228669934 1127583045 /nfs/dbraw/zinc/58/30/45/1127583045.db2.gz QJDAVOLRLTXFRP-UHFFFAOYSA-N 1 0 283.799 3.867 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+][C@@H](C)C2CCCC2)c1O ZINC000228674592 1127583920 /nfs/dbraw/zinc/58/39/20/1127583920.db2.gz YKAAWJFEMNQTCD-JTQLQIEISA-N 1 0 283.799 3.723 20 10 CHCDRO Cc1cnc([C@@H](C)[NH2+]Cc2ccc(N(C)C)c(C)c2)s1 ZINC000294697772 1127592549 /nfs/dbraw/zinc/59/25/49/1127592549.db2.gz UIPBVBMLZHWKEK-CYBMUJFWSA-N 1 0 289.448 3.677 20 10 CHCDRO COc1ccc(C[NH2+][C@H]2CCc3cc(F)ccc3C2)cc1C ZINC001168415400 1127673168 /nfs/dbraw/zinc/67/31/68/1127673168.db2.gz PKIBXOTUQNBCDR-SFHVURJKSA-N 1 0 299.389 3.790 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccsc1 ZINC000061361705 1127685879 /nfs/dbraw/zinc/68/58/79/1127685879.db2.gz MMVJRQOKKZSKQH-NSHDSACASA-N 1 0 259.374 3.534 20 10 CHCDRO CC[C@@H]([NH2+]CCC(C)(F)F)c1ccc(N(C)C)cc1 ZINC000297404226 1127695401 /nfs/dbraw/zinc/69/54/01/1127695401.db2.gz SSMMNJGCDTYQSU-CQSZACIVSA-N 1 0 270.367 3.839 20 10 CHCDRO CCOc1cccc(C[NH2+]CC2(CC)CCCC2)c1O ZINC000230200186 1127746790 /nfs/dbraw/zinc/74/67/90/1127746790.db2.gz HTKMZXUEXJAYKO-UHFFFAOYSA-N 1 0 277.408 3.851 20 10 CHCDRO Cc1cc(C[N@@H+]2CCCO[C@@H](C)C2)c(O)c(C(C)(C)C)c1 ZINC000172495075 1127766864 /nfs/dbraw/zinc/76/68/64/1127766864.db2.gz KZJXITJJMPPRTD-AWEZNQCLSA-N 1 0 291.435 3.609 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2[C@H]3CCCO[C@@H]3C2(C)C)c(O)c1 ZINC000371870201 1127782688 /nfs/dbraw/zinc/78/26/88/1127782688.db2.gz OCKZUCCVJNIPNW-JFOHDYCDSA-N 1 0 289.419 3.555 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)C1CC1 ZINC000323921088 1127892313 /nfs/dbraw/zinc/89/23/13/1127892313.db2.gz VDFCRKKUAPJONA-QGZVFWFLSA-N 1 0 258.409 3.565 20 10 CHCDRO C[C@H]([NH2+]CCC1CC1)c1ccc2ccccc2c1O ZINC000088454732 1127938402 /nfs/dbraw/zinc/93/84/02/1127938402.db2.gz OJLMTNLAWZEVAX-LBPRGKRZSA-N 1 0 255.361 3.996 20 10 CHCDRO CCC[C@@H](C)[NH2+][C@H](C)c1ccc(Br)cc1O ZINC000134898872 1128048277 /nfs/dbraw/zinc/04/82/77/1128048277.db2.gz ZGKCCWIXTGCDAM-NXEZZACHSA-N 1 0 286.213 3.994 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCO[C@@H](c3ccccc3)C2)cc1C ZINC000029891475 1128068067 /nfs/dbraw/zinc/06/80/67/1128068067.db2.gz IXLFSJSPFUSKLC-LJQANCHMSA-N 1 0 297.398 3.583 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCSCC(F)(F)F)c1 ZINC000698952876 1128069398 /nfs/dbraw/zinc/06/93/98/1128069398.db2.gz MLIBQPNRDPIMCL-JTQLQIEISA-N 1 0 293.354 3.647 20 10 CHCDRO CCC[C@@H](CCO)C[NH2+][C@H](C)c1ccc(N(C)CC)cc1 ZINC000152432342 1128123730 /nfs/dbraw/zinc/12/37/30/1128123730.db2.gz JFTFBUACDRMHOC-CVEARBPZSA-N 1 0 292.467 3.592 20 10 CHCDRO C[C@H](Cc1cccc(F)c1)[NH2+][C@H](C)c1ccccc1O ZINC001168459206 1128142189 /nfs/dbraw/zinc/14/21/89/1128142189.db2.gz KUPXSGFSYWBVGU-CHWSQXEVSA-N 1 0 273.351 3.813 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]C1(c2cccc(F)c2)CC1 ZINC000152877555 1128154939 /nfs/dbraw/zinc/15/49/39/1128154939.db2.gz KEWCQQXIEULHTO-UHFFFAOYSA-N 1 0 291.753 3.964 20 10 CHCDRO C[C@H]1CCC[C@@H]([N@H+](C)Cc2cc3c(cc2O)CCC3)C1 ZINC000914785177 1128244258 /nfs/dbraw/zinc/24/42/58/1128244258.db2.gz RIUPUGBZQJNYNI-SUMWQHHRSA-N 1 0 273.420 3.891 20 10 CHCDRO COc1ccc(C[NH2+]CCCc2ccccc2)cc1C ZINC000035052457 1128253951 /nfs/dbraw/zinc/25/39/51/1128253951.db2.gz WFAUKIPHBPHBBS-UHFFFAOYSA-N 1 0 269.388 3.726 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)C[C@H](C)O2)c1ccccc1O ZINC000926922543 1128203149 /nfs/dbraw/zinc/20/31/49/1128203149.db2.gz ZTMDGEGCEZGORM-SUMWQHHRSA-N 1 0 297.398 3.957 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2C[C@H]2C(F)(F)F)c(O)c1 ZINC000926948272 1128205329 /nfs/dbraw/zinc/20/53/29/1128205329.db2.gz JYIBEPCXXJWHSA-JBLDHEPKSA-N 1 0 273.298 3.550 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2C[C@H]2C(F)(F)F)c(O)c1 ZINC000926948273 1128205377 /nfs/dbraw/zinc/20/53/77/1128205377.db2.gz JYIBEPCXXJWHSA-JFGNBEQYSA-N 1 0 273.298 3.550 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCCC2(CCC2)O1)c1cc(F)ccc1O ZINC000927011921 1128208077 /nfs/dbraw/zinc/20/80/77/1128208077.db2.gz SGZDHWSSNYCBMO-TZMCWYRMSA-N 1 0 293.382 3.674 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCCc3cccnc32)c(O)c1 ZINC000927064154 1128213984 /nfs/dbraw/zinc/21/39/84/1128213984.db2.gz PQLPBKYHQOSFQS-BBRMVZONSA-N 1 0 282.387 3.824 20 10 CHCDRO CC[C@H]([NH2+][C@H](C1CC1)[C@@H]1CCCOC1)c1ccccc1O ZINC000927069900 1128215733 /nfs/dbraw/zinc/21/57/33/1128215733.db2.gz ODOTZMVWJSCACP-UWWQBHOKSA-N 1 0 289.419 3.638 20 10 CHCDRO CCc1onc(C)c1C[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000927138607 1128221470 /nfs/dbraw/zinc/22/14/70/1128221470.db2.gz GTBJUWSDBCGRJJ-LBPRGKRZSA-N 1 0 288.391 3.719 20 10 CHCDRO C[C@H]([NH2+]C1([C@H]2CCCCO2)CC1)c1ccc(Cl)cc1O ZINC000927156692 1128223317 /nfs/dbraw/zinc/22/33/17/1128223317.db2.gz BETMHRSQWZUDCM-XHDPSFHLSA-N 1 0 295.810 3.798 20 10 CHCDRO C[C@H]1CC2(CCC2)C[N@@H+]1Cc1cc2c(cc1O)CCC2 ZINC000762140527 1128273343 /nfs/dbraw/zinc/27/33/43/1128273343.db2.gz FFTRNNUIWUZICA-ZDUSSCGKSA-N 1 0 271.404 3.645 20 10 CHCDRO CCC[N@H+](Cc1ccccc1O)[C@@H](C)c1ccc(F)nc1 ZINC000929753439 1128285504 /nfs/dbraw/zinc/28/55/04/1128285504.db2.gz QAAHBQVOGLGJCX-ZDUSSCGKSA-N 1 0 288.366 3.900 20 10 CHCDRO CC[C@@H]1CCC[N@H+](Cc2c(O)ccc3ccncc32)C1 ZINC000915208576 1128292071 /nfs/dbraw/zinc/29/20/71/1128292071.db2.gz GOLSUYJPLQIYRC-CYBMUJFWSA-N 1 0 270.376 3.562 20 10 CHCDRO COc1cc(C[N@@H+]2CC[C@H](C)C2)c(O)c(C(C)(C)C)c1 ZINC000754730544 1128299994 /nfs/dbraw/zinc/29/99/94/1128299994.db2.gz QUMXWCJUWLGSNU-LBPRGKRZSA-N 1 0 277.408 3.540 20 10 CHCDRO CCC(F)(F)C(C)(C)C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000699678883 1128314922 /nfs/dbraw/zinc/31/49/22/1128314922.db2.gz ZJJPTGBELHMZDN-UHFFFAOYSA-N 1 0 283.362 3.783 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)Cc2cccc(F)c2)cc1C ZINC000915808077 1128340959 /nfs/dbraw/zinc/34/09/59/1128340959.db2.gz SCFWQHUVEJNIIK-UHFFFAOYSA-N 1 0 273.351 3.780 20 10 CHCDRO Cc1nc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)sc1C ZINC000153863579 1128408356 /nfs/dbraw/zinc/40/83/56/1128408356.db2.gz QXVAUIFQJJXQNM-GFCCVEGCSA-N 1 0 289.448 3.677 20 10 CHCDRO COc1cccc(C[N@H+](C)Cc2cc(C)ccc2C)c1O ZINC000763378852 1128426675 /nfs/dbraw/zinc/42/66/75/1128426675.db2.gz FSYBROOMGWEFPD-UHFFFAOYSA-N 1 0 285.387 3.650 20 10 CHCDRO CCC[C@@H](C)CC[C@@H](C)[NH2+]Cc1ccc(O)cc1O ZINC001257467230 1128456721 /nfs/dbraw/zinc/45/67/21/1128456721.db2.gz HQHTZRYEEZRHAS-CHWSQXEVSA-N 1 0 265.397 3.792 20 10 CHCDRO COc1ccc(C[NH2+]CCO[C@H]2CCCC[C@H]2C)cc1C ZINC000916838467 1128456899 /nfs/dbraw/zinc/45/68/99/1128456899.db2.gz CVDGCXPSCNOZPH-KDOFPFPSSA-N 1 0 291.435 3.689 20 10 CHCDRO CC[N@@H+](Cc1cc(C(C)(C)C)cc(O)c1O)CC(C)C ZINC000917454586 1128501236 /nfs/dbraw/zinc/50/12/36/1128501236.db2.gz UNWPMBRWKGQIKZ-UHFFFAOYSA-N 1 0 279.424 3.873 20 10 CHCDRO COc1ccccc1CC[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000154552241 1128523749 /nfs/dbraw/zinc/52/37/49/1128523749.db2.gz SGQXCPZJARBLRN-OAHLLOKOSA-N 1 0 298.430 3.655 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)C[C@@H]2CCCCO2)cc1C(C)C ZINC000918735201 1128569660 /nfs/dbraw/zinc/56/96/60/1128569660.db2.gz HTMDGJXCRCADFD-INIZCTEOSA-N 1 0 291.435 3.825 20 10 CHCDRO Cc1cccc(OCC[NH2+][C@H](C)c2ccc(C)cc2O)c1 ZINC000042895947 1128588938 /nfs/dbraw/zinc/58/89/38/1128588938.db2.gz ZZUOHQVNPOOOBM-OAHLLOKOSA-N 1 0 285.387 3.739 20 10 CHCDRO CC[C@@H]([NH2+]CCOc1cccc(C)c1)c1ccccc1O ZINC000042896035 1128589266 /nfs/dbraw/zinc/58/92/66/1128589266.db2.gz KVLSSJBKNKOBKK-QGZVFWFLSA-N 1 0 285.387 3.820 20 10 CHCDRO CCCC[C@H](COC)[NH2+][C@@H](CC)c1ccccc1O ZINC000155902348 1128618268 /nfs/dbraw/zinc/61/82/68/1128618268.db2.gz QGRVAMHXXVSULJ-HIFRSBDPSA-N 1 0 265.397 3.638 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C[C@H]2CC=CCC2)cc1 ZINC000044346438 1128628428 /nfs/dbraw/zinc/62/84/28/1128628428.db2.gz TVDNPTXNPMSBAQ-INIZCTEOSA-N 1 0 272.436 3.979 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2cccc(C)c2O)cc1F ZINC000158137935 1128664599 /nfs/dbraw/zinc/66/45/99/1128664599.db2.gz NRGNIHIOAQICLD-CYBMUJFWSA-N 1 0 273.351 3.999 20 10 CHCDRO Oc1ccc(F)cc1C[N@H+](Cc1ccc(F)cc1)C1CC1 ZINC000778984666 1128673731 /nfs/dbraw/zinc/67/37/31/1128673731.db2.gz HLOOAGKWXXAZSX-UHFFFAOYSA-N 1 0 289.325 3.835 20 10 CHCDRO CC[N@H+](Cc1ccc(C)cc1)Cc1ccccc1O ZINC000778995538 1128674889 /nfs/dbraw/zinc/67/48/89/1128674889.db2.gz BISPTMOTSFHFCL-UHFFFAOYSA-N 1 0 255.361 3.723 20 10 CHCDRO Cc1cc(Br)cc([C@H](C)[NH2+]CC2(C)CC2)c1O ZINC000779035726 1128695989 /nfs/dbraw/zinc/69/59/89/1128695989.db2.gz GKTJZZPWAGCQOD-JTQLQIEISA-N 1 0 298.224 3.914 20 10 CHCDRO C[C@H]1CCC[C@H](C)C1[NH2+]Cc1ccc2c(c1)CCO2 ZINC000921066034 1128699821 /nfs/dbraw/zinc/69/98/21/1128699821.db2.gz HLYIJSULDGNYDK-STQMWFEESA-N 1 0 259.393 3.536 20 10 CHCDRO CCCCC[C@@H](C)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000035134000 1117782573 /nfs/dbraw/zinc/78/25/73/1117782573.db2.gz HHFRPBSVWDVTJR-MRXNPFEDSA-N 1 0 290.451 3.582 20 10 CHCDRO C[C@@H]([NH2+][C@@H](CC[NH+](C)C)C(C)(C)C)c1ccc(F)cc1[O-] ZINC000185471822 1117826493 /nfs/dbraw/zinc/82/64/93/1117826493.db2.gz MIRSFLJMVLYVLM-WBMJQRKESA-N 1 0 296.430 3.548 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1C[C@H]2CC[C@@H]1O2)c1ccc2ccccc2c1O ZINC000185460281 1117827464 /nfs/dbraw/zinc/82/74/64/1117827464.db2.gz OJVKKCOUCIWILC-ZPUIDXCVSA-N 1 0 283.371 3.516 20 10 CHCDRO COc1cccc(C[NH2+][C@@H](C)CCCC(F)(F)F)c1O ZINC000755223967 1117842033 /nfs/dbraw/zinc/84/20/33/1117842033.db2.gz WINGVEUWJXQCKM-JTQLQIEISA-N 1 0 291.313 3.612 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C2CC2)C2CCC2)c1 ZINC000325064049 1117842210 /nfs/dbraw/zinc/84/22/10/1117842210.db2.gz UCQRPVVUNFEKPB-SJCJKPOMSA-N 1 0 259.393 3.930 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCCC[C@@H]1OC)c1ccc(C)cc1O ZINC000799729182 1117842309 /nfs/dbraw/zinc/84/23/09/1117842309.db2.gz INVNABVUUOAAHR-ZOBUZTSGSA-N 1 0 277.408 3.699 20 10 CHCDRO CC[C@@H](C)[NH2+]Cc1ccc(N2CCC(C)CC2)cc1 ZINC000075824282 1128738645 /nfs/dbraw/zinc/73/86/45/1128738645.db2.gz SHXIVEYMFYQRKT-OAHLLOKOSA-N 1 0 260.425 3.811 20 10 CHCDRO C[C@H]([NH2+]CCc1cc(F)ccc1F)c1cc(F)ccc1O ZINC000185633931 1117860361 /nfs/dbraw/zinc/86/03/61/1117860361.db2.gz RIRZSVSJHCDEPU-JTQLQIEISA-N 1 0 295.304 3.703 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCCO[C@@H]2C(C)C)c(O)c1 ZINC000186093572 1117991194 /nfs/dbraw/zinc/99/11/94/1117991194.db2.gz PGJLGILSQLLRBW-RLFYNMQTSA-N 1 0 291.435 3.802 20 10 CHCDRO Cc1ccccc1[C@@H]1C[N@H+](Cc2ccccc2O)[C@H](C)CO1 ZINC000179578506 1128748585 /nfs/dbraw/zinc/74/85/85/1128748585.db2.gz XGLFVBJYTAXYJL-BEFAXECRSA-N 1 0 297.398 3.663 20 10 CHCDRO CCCC1(C[NH2+][C@H](C)c2cc(OC)ccc2O)CC1 ZINC000186106006 1117997606 /nfs/dbraw/zinc/99/76/06/1117997606.db2.gz QCPZLRLGBPXCMZ-GFCCVEGCSA-N 1 0 263.381 3.632 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2Cc3ccccc32)c(O)c1 ZINC000037565736 1118031378 /nfs/dbraw/zinc/03/13/78/1118031378.db2.gz QHIHZDGQHPUNMA-HIFRSBDPSA-N 1 0 267.372 3.691 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@@H](C)c2ccc(C)cc2)c1 ZINC000037770902 1118037737 /nfs/dbraw/zinc/03/77/37/1118037737.db2.gz SYQDBPUIPAIHRR-ZDUSSCGKSA-N 1 0 271.360 3.560 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]CCSc1ccccc1 ZINC000037904061 1118047133 /nfs/dbraw/zinc/04/71/33/1118047133.db2.gz QOBLSNUMTZXVFN-UHFFFAOYSA-N 1 0 293.819 3.928 20 10 CHCDRO C[C@H]1CCCCC[N@@H+]1Cc1cc(Br)ccc1O ZINC000211452925 1118050000 /nfs/dbraw/zinc/05/00/00/1118050000.db2.gz DEEOUNRRIQQUCA-NSHDSACASA-N 1 0 298.224 3.919 20 10 CHCDRO CC[C@@H]([NH2+]CCOc1ccccc1)c1ccc(N(C)C)cc1 ZINC000764581810 1118099663 /nfs/dbraw/zinc/09/96/63/1118099663.db2.gz AJTVRKADZFVNKI-LJQANCHMSA-N 1 0 298.430 3.872 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@H](C)C2CC2)cc1 ZINC000765391391 1118147359 /nfs/dbraw/zinc/14/73/59/1118147359.db2.gz DXPADKYABKGDFH-UONOGXRCSA-N 1 0 260.425 3.839 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCS[C@@H]1C)c1ccc(C)cc1O ZINC000842929649 1118170032 /nfs/dbraw/zinc/17/00/32/1118170032.db2.gz PLRZZYMKWXPDDU-XBFCOCLRSA-N 1 0 265.422 3.635 20 10 CHCDRO C[C@H]([NH2+]C1CCc2ccccc2CC1)c1ccccc1O ZINC001203541306 1118176394 /nfs/dbraw/zinc/17/63/94/1118176394.db2.gz ABMJAMSUJBYFKU-AWEZNQCLSA-N 1 0 281.399 3.990 20 10 CHCDRO CC[C@H]1CCC[C@H]([NH2+]Cc2ccc(N(C)C)cc2)C1 ZINC000083639718 1118190192 /nfs/dbraw/zinc/19/01/92/1118190192.db2.gz COTCAJHEBGVDQW-HOCLYGCPSA-N 1 0 260.425 3.811 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@](C)(O)C2CCCCC2)c(O)c1 ZINC000188661178 1128763890 /nfs/dbraw/zinc/76/38/90/1128763890.db2.gz LJRNTZHXSUEXFD-RDTXWAMCSA-N 1 0 291.435 3.683 20 10 CHCDRO COc1cnccc1[C@H](C)[NH2+][C@H](C)c1ccc(C)cc1O ZINC000188797693 1128764781 /nfs/dbraw/zinc/76/47/81/1128764781.db2.gz DWIITAXKAZDMQU-OLZOCXBDSA-N 1 0 286.375 3.516 20 10 CHCDRO Cc1ccc(C)c(C[N@H+](C2CCC2)C2CCOCC2)c1O ZINC001140184672 1118254914 /nfs/dbraw/zinc/25/49/14/1118254914.db2.gz DPTANVKQSYBNDL-UHFFFAOYSA-N 1 0 289.419 3.543 20 10 CHCDRO Oc1ccc2ccccc2c1C[NH+]1C[C@H]2CCC[C@@H]2C1 ZINC000147937509 1118254938 /nfs/dbraw/zinc/25/49/38/1118254938.db2.gz HIKMRWYGWQHMHI-HUUCEWRRSA-N 1 0 267.372 3.777 20 10 CHCDRO C[C@H]1CC(C)(C)C[N@@H+]1Cc1cccc(Cl)c1[O-] ZINC001652674273 1118272593 /nfs/dbraw/zinc/27/25/93/1118272593.db2.gz BGYILUKQMKVIAA-JTQLQIEISA-N 1 0 253.773 3.666 20 10 CHCDRO CC[N@H+](Cc1ccc(OC)cc1)Cc1cc(F)ccc1O ZINC000179933883 1128767215 /nfs/dbraw/zinc/76/72/15/1128767215.db2.gz XOTSQKBIKOYMED-UHFFFAOYSA-N 1 0 289.350 3.562 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1CCOc2ccccc21)c1ccccc1O ZINC000186184067 1118288280 /nfs/dbraw/zinc/28/82/80/1118288280.db2.gz KNHPEAHHUPSMFG-RHSMWYFYSA-N 1 0 297.398 3.999 20 10 CHCDRO Cc1ccc(C[C@@H](C)[NH2+]Cc2ccc3c(c2)CCO3)s1 ZINC000080228315 1118312448 /nfs/dbraw/zinc/31/24/48/1118312448.db2.gz YBIPSHQQMQNIGV-GFCCVEGCSA-N 1 0 287.428 3.712 20 10 CHCDRO COCC[C@H](C)[NH2+]Cc1cc(C)n(-c2ccccc2)c1C ZINC000081705363 1118327031 /nfs/dbraw/zinc/32/70/31/1118327031.db2.gz BMABZVGJOULPJP-AWEZNQCLSA-N 1 0 286.419 3.609 20 10 CHCDRO Cc1ccc(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)cn1 ZINC000062050912 1118347186 /nfs/dbraw/zinc/34/71/86/1118347186.db2.gz YYPGKJZIHFRPHS-DOMZBBRYSA-N 1 0 282.387 3.742 20 10 CHCDRO CCc1ccccc1C[NH2+]Cc1ccc(OC)c(C)c1 ZINC000084200534 1118373225 /nfs/dbraw/zinc/37/32/25/1118373225.db2.gz ZRGHMLCLWKHTEA-UHFFFAOYSA-N 1 0 269.388 3.856 20 10 CHCDRO Cc1ccc(O[C@H]2CCC[N@H+](Cc3ccccc3O)C2)cc1 ZINC001203556915 1118389342 /nfs/dbraw/zinc/38/93/42/1118389342.db2.gz WYIAOMLWQIIESB-SFHVURJKSA-N 1 0 297.398 3.744 20 10 CHCDRO Oc1ccccc1C[NH2+]Cc1cccc(OC(F)(F)F)c1 ZINC000076399160 1128775016 /nfs/dbraw/zinc/77/50/16/1128775016.db2.gz ALQLTMDDKOCPDD-UHFFFAOYSA-N 1 0 297.276 3.581 20 10 CHCDRO Cc1cc(C)cc(C[NH2+][C@H](C)c2cc(F)ccc2O)c1 ZINC000693217515 1118421538 /nfs/dbraw/zinc/42/15/38/1118421538.db2.gz ZXNCCTKLLYMTSS-CYBMUJFWSA-N 1 0 273.351 3.999 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CC[C@](C)(O)c2ccccc2)c1 ZINC000187909936 1118438810 /nfs/dbraw/zinc/43/88/10/1118438810.db2.gz KSEWVJRSUBVAMU-KXBFYZLASA-N 1 0 299.414 3.649 20 10 CHCDRO Cn1cc(Cl)cc1C[N@H+](C)Cc1cc(Cl)ccc1O ZINC000091930843 1118441464 /nfs/dbraw/zinc/44/14/64/1118441464.db2.gz WDMVIIIVASLQRC-UHFFFAOYSA-N 1 0 299.201 3.670 20 10 CHCDRO Cn1cccc1[C@H]1CCCC[N@@H+]1Cc1cc(F)ccc1O ZINC000180245007 1128782620 /nfs/dbraw/zinc/78/26/20/1128782620.db2.gz ZHWXOMFJNGMJJX-MRXNPFEDSA-N 1 0 288.366 3.597 20 10 CHCDRO C[C@@H]([NH2+]CCOCc1ccccc1)c1ccc(N(C)C)cc1 ZINC000156926256 1118549702 /nfs/dbraw/zinc/54/97/02/1118549702.db2.gz BGTXICMOJMCBNQ-MRXNPFEDSA-N 1 0 298.430 3.620 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCOC(C)(C)C1)c1cc(Cl)ccc1O ZINC000834908930 1118627981 /nfs/dbraw/zinc/62/79/81/1118627981.db2.gz ISXCHWTYAFGMNG-RYUDHWBXSA-N 1 0 297.826 3.901 20 10 CHCDRO CC[C@@H]1CC[C@H](C)[N@@H+]1Cc1c(O)cccc1Br ZINC000707138803 1118642894 /nfs/dbraw/zinc/64/28/94/1118642894.db2.gz HODGWVMYVMZYHB-WDEREUQCSA-N 1 0 298.224 3.918 20 10 CHCDRO CC[C@H]1CC[C@@H](C)[N@@H+]1Cc1c(O)cccc1Br ZINC000707138798 1118642901 /nfs/dbraw/zinc/64/29/01/1118642901.db2.gz HODGWVMYVMZYHB-MNOVXSKESA-N 1 0 298.224 3.918 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@@H+]2CC[C@@H](c3ccco3)C2)c1 ZINC000754725996 1118645996 /nfs/dbraw/zinc/64/59/96/1118645996.db2.gz JKNJJWNXEHJQLQ-CQSZACIVSA-N 1 0 271.360 3.592 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CCC3(C2)CCCCC3)c1 ZINC000180449778 1128791997 /nfs/dbraw/zinc/79/19/97/1128791997.db2.gz VDRLZRSLLDEARG-UHFFFAOYSA-N 1 0 275.392 3.557 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCC[C@@H](Nc3ccccc3)C2)c1O ZINC000180488856 1128794401 /nfs/dbraw/zinc/79/44/01/1128794401.db2.gz ARAMZQRRWCLZAR-GOSISDBHSA-N 1 0 296.414 3.777 20 10 CHCDRO Cc1cccc(C[N@@H+](CCc2nccs2)C(C)C)c1O ZINC000180538525 1128796049 /nfs/dbraw/zinc/79/60/49/1128796049.db2.gz MNABZSCGIVSVNI-UHFFFAOYSA-N 1 0 290.432 3.610 20 10 CHCDRO Cc1cnc(C(C)(C)[NH2+]Cc2cc(Cl)ccc2O)s1 ZINC000175982123 1118735781 /nfs/dbraw/zinc/73/57/81/1118735781.db2.gz WUNWVYMRCOMJGB-UHFFFAOYSA-N 1 0 296.823 3.835 20 10 CHCDRO COc1cccc(C[N@@H+]2CCC[C@@H]2c2ccccc2)c1O ZINC000131587469 1118761109 /nfs/dbraw/zinc/76/11/09/1118761109.db2.gz GRJWIQORBRGMBR-MRXNPFEDSA-N 1 0 283.371 3.738 20 10 CHCDRO COc1cccc(C[N@H+](C)[C@H]2CCc3ccccc32)c1O ZINC000131997114 1118786996 /nfs/dbraw/zinc/78/69/96/1118786996.db2.gz DLCXNBXZOKFSJD-INIZCTEOSA-N 1 0 283.371 3.520 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH+]1C[C@H]2CCCC[C@@H]2C1 ZINC000386462297 1118850387 /nfs/dbraw/zinc/85/03/87/1118850387.db2.gz GCKYHFHYFOKYRB-VXGBXAGGSA-N 1 0 265.784 3.668 20 10 CHCDRO C[N@H+](Cc1cc2ccccc2o1)Cc1ccccc1O ZINC000178531928 1119005100 /nfs/dbraw/zinc/00/51/00/1119005100.db2.gz MJSWNMODFQQOLO-UHFFFAOYSA-N 1 0 267.328 3.770 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCc2ccccc2C1)c1ccccc1O ZINC000051630692 1119059698 /nfs/dbraw/zinc/05/96/98/1119059698.db2.gz WSXKUPGFZAHXLX-BBRMVZONSA-N 1 0 267.372 3.600 20 10 CHCDRO CC[C@H](C)[C@@H](C)[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC000152833167 1119128769 /nfs/dbraw/zinc/12/87/69/1119128769.db2.gz PTEWYPZWJWXFSY-LSDHHAIUSA-N 1 0 290.451 3.688 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CCC[C@H]2CCCC[C@@H]21 ZINC000226561833 1119157472 /nfs/dbraw/zinc/15/74/72/1119157472.db2.gz AWPDXFIRAFBXBC-DOMZBBRYSA-N 1 0 263.356 3.686 20 10 CHCDRO CC1CCC([NH2+]Cc2ccc3c(c2)CCCN3C)CC1 ZINC000050285857 1119163060 /nfs/dbraw/zinc/16/30/60/1119163060.db2.gz GOADUCYHDLFPPL-UHFFFAOYSA-N 1 0 272.436 3.737 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]CCC1CCCCC1 ZINC000226583871 1119210510 /nfs/dbraw/zinc/21/05/10/1119210510.db2.gz ICZLNWSGCPDYLW-UHFFFAOYSA-N 1 0 251.345 3.591 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2cnc(C)s2)cc1 ZINC000123660933 1119300352 /nfs/dbraw/zinc/30/03/52/1119300352.db2.gz FSPAUSNBYITNSI-LBPRGKRZSA-N 1 0 289.448 3.758 20 10 CHCDRO CC(C)C1(C[NH2+]Cc2c(O)cccc2Cl)CC1 ZINC000227833174 1119307977 /nfs/dbraw/zinc/30/79/77/1119307977.db2.gz AOKNDXCOUAOKQH-UHFFFAOYSA-N 1 0 253.773 3.571 20 10 CHCDRO CSC(C)(C)C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000132393640 1119447994 /nfs/dbraw/zinc/44/79/94/1119447994.db2.gz KKNQKQGYSALRMY-LBPRGKRZSA-N 1 0 266.454 3.545 20 10 CHCDRO C[C@H]1CCC[C@@H](C[NH2+]Cc2ccc3c(c2)CCO3)C1 ZINC000219471081 1119472061 /nfs/dbraw/zinc/47/20/61/1119472061.db2.gz BJSBRMLGPDMRTL-UONOGXRCSA-N 1 0 259.393 3.537 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@H]1CCOC(C)(C)C1 ZINC000250987089 1119615910 /nfs/dbraw/zinc/61/59/10/1119615910.db2.gz SZLSQCGZKQYAAW-RDBSUJKOSA-N 1 0 289.419 3.796 20 10 CHCDRO CC[C@H]([NH2+]CCc1cccc(C)n1)c1ccc(C)cc1O ZINC000280028778 1119631170 /nfs/dbraw/zinc/63/11/70/1119631170.db2.gz HYZYCUHWCJVMFZ-KRWDZBQOSA-N 1 0 284.403 3.687 20 10 CHCDRO Cc1cccc(CC[NH2+][C@@H](C)c2ccc(C)cc2O)c1 ZINC000051668965 1119641011 /nfs/dbraw/zinc/64/10/11/1119641011.db2.gz CPTRERGVTDNPRD-HNNXBMFYSA-N 1 0 269.388 3.902 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCSC[C@@H]1c1ccccc1 ZINC000179556350 1119751754 /nfs/dbraw/zinc/75/17/54/1119751754.db2.gz DDFJRVWORBRUAO-MRXNPFEDSA-N 1 0 285.412 3.682 20 10 CHCDRO Oc1cccc(Cl)c1C[N@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000310780067 1119950614 /nfs/dbraw/zinc/95/06/14/1119950614.db2.gz FIHOWEZFWVXIMA-TXEJJXNPSA-N 1 0 265.784 3.668 20 10 CHCDRO COC1([C@H](C)[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)CCC1 ZINC000840883493 1119960422 /nfs/dbraw/zinc/96/04/22/1119960422.db2.gz DIZCIWZZYRJFPR-RYUDHWBXSA-N 1 0 297.826 3.962 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2c(O)cccc2Cl)C[C@@H]1C ZINC000162897427 1120003795 /nfs/dbraw/zinc/00/37/95/1120003795.db2.gz AADSSOBQWGMYGS-MNOVXSKESA-N 1 0 253.773 3.524 20 10 CHCDRO CC(C)n1cc2c(n1)[C@@H]([NH2+][C@@H](C)c1ccccc1O)CCC2 ZINC000765817429 1120062672 /nfs/dbraw/zinc/06/26/72/1120062672.db2.gz LIDYMJYNTBQFKJ-BBRMVZONSA-N 1 0 299.418 3.898 20 10 CHCDRO CCSCC[C@H](C)[NH2+][C@H](C)c1ccc(C)cc1O ZINC000168809476 1120097145 /nfs/dbraw/zinc/09/71/45/1120097145.db2.gz HHIWVUYQBJPZNQ-QWHCGFSZSA-N 1 0 267.438 3.883 20 10 CHCDRO CC[C@H]([NH2+]CC(C)(C)SC)c1ccccc1O ZINC000169215296 1120104807 /nfs/dbraw/zinc/10/48/07/1120104807.db2.gz YUZNNUBNEXHZEG-LBPRGKRZSA-N 1 0 253.411 3.575 20 10 CHCDRO CCc1ccc(C[NH2+][C@@H](C)c2cc(OC)ccc2O)cc1 ZINC000182322983 1120117877 /nfs/dbraw/zinc/11/78/77/1120117877.db2.gz XRHOLWYTDYDHAZ-ZDUSSCGKSA-N 1 0 285.387 3.814 20 10 CHCDRO C[C@H]([NH2+]CC=C(Cl)Cl)c1ccc(N(C)C)cc1 ZINC000407400044 1120153847 /nfs/dbraw/zinc/15/38/47/1120153847.db2.gz IPKJXSBSRFPTJL-JTQLQIEISA-N 1 0 273.207 3.722 20 10 CHCDRO CCOc1cccc(C[N@H+](CC)[C@@H](C)C(C)C)c1O ZINC000092590298 1120221626 /nfs/dbraw/zinc/22/16/26/1120221626.db2.gz WDQKQEFKBCHAEK-ZDUSSCGKSA-N 1 0 265.397 3.657 20 10 CHCDRO C[C@H]([NH2+]CCc1ccccc1)c1cc(Cl)ccc1O ZINC000756354419 1120236232 /nfs/dbraw/zinc/23/62/32/1120236232.db2.gz BEWBGKXMPVDPGT-LBPRGKRZSA-N 1 0 275.779 3.939 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1)c1cn[nH]c1 ZINC000271460997 1120253491 /nfs/dbraw/zinc/25/34/91/1120253491.db2.gz HJKONTUCBAHXAP-GJZGRUSLSA-N 1 0 298.434 3.812 20 10 CHCDRO COc1ccc(C[NH2+]Cc2ccc3c(c2)CCCO3)c(C)c1 ZINC000921858203 1120254074 /nfs/dbraw/zinc/25/40/74/1120254074.db2.gz YHBSHYAOPFLHCW-UHFFFAOYSA-N 1 0 297.398 3.618 20 10 CHCDRO CC[N@H+](Cc1cccs1)Cc1cc(F)ccc1O ZINC000179888521 1120257064 /nfs/dbraw/zinc/25/70/64/1120257064.db2.gz HBGICFGFGFFHRO-UHFFFAOYSA-N 1 0 265.353 3.615 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CCCCOC(C)C)cc1 ZINC000180461210 1120275563 /nfs/dbraw/zinc/27/55/63/1120275563.db2.gz VXTXQTRGUSCRMP-INIZCTEOSA-N 1 0 292.467 3.999 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCS[C@@H]3CCCC[C@@H]32)c1O ZINC000180483226 1120276511 /nfs/dbraw/zinc/27/65/11/1120276511.db2.gz CXDJOSOZUFFGEP-LSDHHAIUSA-N 1 0 277.433 3.561 20 10 CHCDRO CCS[C@H]1CC[C@H]([N@H+](C)Cc2cc(OC)ccc2O)C1 ZINC000180668249 1120279343 /nfs/dbraw/zinc/27/93/43/1120279343.db2.gz ODWQRYCQDXHAOW-ZFWWWQNUSA-N 1 0 295.448 3.507 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cc3ccccc3o2)c1 ZINC000182436960 1120320911 /nfs/dbraw/zinc/32/09/11/1120320911.db2.gz LYMHTXUSRKCQCV-GFCCVEGCSA-N 1 0 297.354 3.998 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2[C@H]3CCCO[C@@H]3C2(C)C)c1 ZINC000363849319 1120337721 /nfs/dbraw/zinc/33/77/21/1120337721.db2.gz GOQFMZOESMMNEM-IXKJSCDLSA-N 1 0 289.419 3.555 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1ccccc1O)c1c(C)noc1C ZINC000183630556 1120343551 /nfs/dbraw/zinc/34/35/51/1120343551.db2.gz JGYHBSRHWXKGNM-IINYFYTJSA-N 1 0 274.364 3.799 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)c2cc(F)ccc2O)cc1F ZINC000184910194 1120364892 /nfs/dbraw/zinc/36/48/92/1120364892.db2.gz OHXRRJNHLYPWAZ-NSHDSACASA-N 1 0 277.314 3.830 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]Cc2cccnc2C)cc1 ZINC000728775048 1120447710 /nfs/dbraw/zinc/44/77/10/1120447710.db2.gz BLOJATXNSCTBSS-UHFFFAOYSA-N 1 0 283.419 3.526 20 10 CHCDRO C[C@@H]([NH2+]Cc1cn(C)nc1C1CCCC1)c1ccccc1O ZINC000922329192 1120513903 /nfs/dbraw/zinc/51/39/03/1120513903.db2.gz LOXNHNLUDZFOKU-CYBMUJFWSA-N 1 0 299.418 3.634 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2ccccc2)c1 ZINC000019878467 1120542964 /nfs/dbraw/zinc/54/29/64/1120542964.db2.gz UWIMAOKJYMYHKY-QWHCGFSZSA-N 1 0 271.360 3.813 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]C[C@@H]2C[C@H]2C(F)(F)F)cc1 ZINC000922728339 1120589642 /nfs/dbraw/zinc/58/96/42/1120589642.db2.gz IJYFZXABXYKQNV-REJHYOMKSA-N 1 0 298.352 3.554 20 10 CHCDRO C[C@@H]([NH2+]C1(Cc2ccccc2)CC1)c1cc(F)ccc1O ZINC000186579654 1120598804 /nfs/dbraw/zinc/59/88/04/1120598804.db2.gz DFIUYIXNTQMQPN-CYBMUJFWSA-N 1 0 285.362 3.957 20 10 CHCDRO Cc1csc([C@H](C)C[NH2+][C@@H](C)c2cc(F)ccc2O)n1 ZINC000186579490 1120598831 /nfs/dbraw/zinc/59/88/31/1120598831.db2.gz NCKILWYJWLSNHJ-KOLCDFICSA-N 1 0 294.395 3.751 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+]C/C=C/c2ccc(N(C)C)cc2)CCS1 ZINC000922837241 1120607787 /nfs/dbraw/zinc/60/77/87/1120607787.db2.gz GNPVDTCRZDIJMF-ATQQARJTSA-N 1 0 290.476 3.640 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C(C2CCC2)C2CCC2)c1 ZINC000324894540 1128928042 /nfs/dbraw/zinc/92/80/42/1128928042.db2.gz GRUHRJAYZHLBLT-UHFFFAOYSA-N 1 0 259.393 3.759 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+][C@H]1CCSC2(CCC2)C1 ZINC000922844995 1120612538 /nfs/dbraw/zinc/61/25/38/1120612538.db2.gz JJGNTBWNJGMJGM-NSHDSACASA-N 1 0 297.851 3.954 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCCC23CCOCC3)c1 ZINC000282433097 1120661179 /nfs/dbraw/zinc/66/11/79/1120661179.db2.gz DIFXBECJSGXGDL-WMLDXEAASA-N 1 0 289.419 3.701 20 10 CHCDRO C[C@@H]([NH2+][C@H]1COCC1(C)C)c1ccc2ccccc2c1O ZINC000313016799 1120672877 /nfs/dbraw/zinc/67/28/77/1120672877.db2.gz GZFGIPRPQVLJSI-WBMJQRKESA-N 1 0 285.387 3.621 20 10 CHCDRO CC(C)C[C@@H]1OCCC[C@H]1[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000186828034 1120674860 /nfs/dbraw/zinc/67/48/60/1120674860.db2.gz KKMPOWITWFIEHI-MJEQTWJJSA-N 1 0 295.398 3.776 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCOCC2CCCC2)c1 ZINC000313312617 1120705861 /nfs/dbraw/zinc/70/58/61/1120705861.db2.gz YMAIBXBFDHFVLY-AWEZNQCLSA-N 1 0 277.408 3.558 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CCc3cccc(C)c3C2)c1 ZINC000763505681 1128942016 /nfs/dbraw/zinc/94/20/16/1128942016.db2.gz NLYFWNFYYNSSEC-UHFFFAOYSA-N 1 0 297.398 3.658 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](C)[C@@H](C)CCSCC)c1 ZINC000093871048 1120892906 /nfs/dbraw/zinc/89/29/06/1120892906.db2.gz LSAOYPWQOBUHIX-ZDUSSCGKSA-N 1 0 297.464 3.754 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CCOc2ccccc2)cc1 ZINC000314847481 1120977929 /nfs/dbraw/zinc/97/79/29/1120977929.db2.gz TURGGWHDXSFIDZ-UHFFFAOYSA-N 1 0 298.430 3.701 20 10 CHCDRO CS[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000312062994 1120988154 /nfs/dbraw/zinc/98/81/54/1120988154.db2.gz DHHUFARMNSSSSU-UMVBOHGHSA-N 1 0 277.433 3.643 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2CCCC2(C)C)c1 ZINC000094321597 1121000285 /nfs/dbraw/zinc/00/02/85/1121000285.db2.gz BBHUUZUMGPHOJU-NHYWBVRUSA-N 1 0 263.381 3.630 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCCc2nn(C)cc21)c1ccc(C)cc1O ZINC000282516660 1121063581 /nfs/dbraw/zinc/06/35/81/1121063581.db2.gz UEANOCGTRONQQL-JKSUJKDBSA-N 1 0 299.418 3.552 20 10 CHCDRO C[C@@H]([NH2+]CC1(N(C)C)CCC1)c1ccc2ccccc2c1O ZINC000317975885 1121068076 /nfs/dbraw/zinc/06/80/76/1121068076.db2.gz HGEQFSADYRYOSO-CQSZACIVSA-N 1 0 298.430 3.680 20 10 CHCDRO CCCC[C@H]1CCC[C@H]1[NH2+]Cc1cccc(OC)c1O ZINC000236886863 1121372575 /nfs/dbraw/zinc/37/25/75/1121372575.db2.gz RQJLNXRDKZSTFI-DZGCQCFKSA-N 1 0 277.408 3.849 20 10 CHCDRO CCC[C@H](C[NH2+][C@@H](CC)c1ccccc1O)OCC ZINC000705317182 1121396384 /nfs/dbraw/zinc/39/63/84/1121396384.db2.gz OZANMPOICANNHA-HIFRSBDPSA-N 1 0 265.397 3.638 20 10 CHCDRO Cc1ncoc1C[N@@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000893863597 1121432795 /nfs/dbraw/zinc/43/27/95/1121432795.db2.gz JRSYGLVCHBZFFK-UHFFFAOYSA-N 1 0 299.418 3.605 20 10 CHCDRO Cc1ccc([C@@H]2CCC[N@@H+]2Cc2c([O-])cccc2F)cn1 ZINC001137840057 1121441723 /nfs/dbraw/zinc/44/17/23/1121441723.db2.gz QGSNTCYFXCNWIS-INIZCTEOSA-N 1 0 286.350 3.572 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]C[C@H]1CCCC13CC3)CC2 ZINC000707057390 1121448400 /nfs/dbraw/zinc/44/84/00/1121448400.db2.gz KCNFUJJVFZPTNR-KGLIPLIRSA-N 1 0 257.377 3.549 20 10 CHCDRO C[C@H](c1cccc(O)c1)[N@H+](C)Cc1cc(F)cc(F)c1[O-] ZINC000894017970 1121454248 /nfs/dbraw/zinc/45/42/48/1121454248.db2.gz UWSKTKIJVMWRHB-SNVBAGLBSA-N 1 0 293.313 3.569 20 10 CHCDRO C[C@@H](CC1CCC1)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000710217784 1121474475 /nfs/dbraw/zinc/47/44/75/1121474475.db2.gz VMACEKBDYGWJLB-HNNXBMFYSA-N 1 0 272.436 3.955 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CC[C@@H]2CCC3(CCC3)O2)cc1C ZINC000922966875 1121499160 /nfs/dbraw/zinc/49/91/60/1121499160.db2.gz AATGAXYGYALCFP-INIZCTEOSA-N 1 0 289.419 3.590 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1CCC2(CCC2)O1)c1ccccc1O ZINC000711458535 1121537122 /nfs/dbraw/zinc/53/71/22/1121537122.db2.gz XNCNFHDMQAIDLC-UKRRQHHQSA-N 1 0 275.392 3.535 20 10 CHCDRO Oc1ccc(Br)cc1C[NH2+]C1CC2(CCC2)C1 ZINC000697737247 1121559611 /nfs/dbraw/zinc/55/96/11/1121559611.db2.gz QGJHIDHNVPYCLQ-UHFFFAOYSA-N 1 0 296.208 3.577 20 10 CHCDRO CSC[C@H](C)[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC000168786342 1121610586 /nfs/dbraw/zinc/61/05/86/1121610586.db2.gz SGLZTHPCGXCBMI-GRYCIOLGSA-N 1 0 265.422 3.590 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]C1CCC(F)(F)CC1)CC2 ZINC000688491831 1129003100 /nfs/dbraw/zinc/00/31/00/1129003100.db2.gz VWXBCGNAESOBTN-GFCCVEGCSA-N 1 0 267.319 3.547 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]CC2CCCC2)cc1 ZINC001177240783 1121719753 /nfs/dbraw/zinc/71/97/53/1121719753.db2.gz VJUXBWCDIGFKRZ-VMPITWQZSA-N 1 0 258.409 3.546 20 10 CHCDRO CCc1ccc(C[NH2+]Cc2cc(C)cc(OC)c2O)s1 ZINC000894176508 1121722920 /nfs/dbraw/zinc/72/29/20/1121722920.db2.gz SWLNJMSYLVEIHA-UHFFFAOYSA-N 1 0 291.416 3.623 20 10 CHCDRO CCOc1ccc(C[NH2+]C2(C)CCCCC2)c(O)c1 ZINC000728063674 1121760196 /nfs/dbraw/zinc/76/01/96/1121760196.db2.gz XMBPQLCLINJTEX-UHFFFAOYSA-N 1 0 263.381 3.603 20 10 CHCDRO CCOCc1cc(C[NH2+][C@H](C)C2CCC2)ccc1OC ZINC001178425569 1121787691 /nfs/dbraw/zinc/78/76/91/1121787691.db2.gz CMAXMGYAIQPASO-CYBMUJFWSA-N 1 0 277.408 3.510 20 10 CHCDRO CCN(C)c1ccc(C[N@H+](CC)Cc2ccoc2)cc1 ZINC000773746583 1121790384 /nfs/dbraw/zinc/79/03/84/1121790384.db2.gz AELJJYOFYJQZED-UHFFFAOYSA-N 1 0 272.392 3.758 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CCC[C@H]2c2ccccn2)cc1 ZINC000773757504 1121799844 /nfs/dbraw/zinc/79/98/44/1121799844.db2.gz ZQVWXZJHJCCZHR-IBGZPJMESA-N 1 0 295.430 3.875 20 10 CHCDRO Cc1ccc(F)c(CC[NH2+]Cc2ccc3c(c2)CCCO3)c1 ZINC001178731822 1121808828 /nfs/dbraw/zinc/80/88/28/1121808828.db2.gz WJZHMGFVBFUAKL-UHFFFAOYSA-N 1 0 299.389 3.791 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H]2C[C@@H]3CC[C@@H](C3)C2)c1 ZINC001179054226 1121842942 /nfs/dbraw/zinc/84/29/42/1121842942.db2.gz SGWLJJBQWGWVTL-MQYQWHSLSA-N 1 0 275.392 3.630 20 10 CHCDRO c1cc2c(cc1C[NH2+]C[C@@H]1CC[C@H]3C[C@H]3C1)CCCO2 ZINC001179228017 1121861843 /nfs/dbraw/zinc/86/18/43/1121861843.db2.gz BKGKQGKBFDIMLG-UKPHBRMFSA-N 1 0 271.404 3.537 20 10 CHCDRO CCN(C)c1ccc(C[N@H+](Cc2cccnc2)C2CC2)cc1 ZINC000773808704 1121863392 /nfs/dbraw/zinc/86/33/92/1121863392.db2.gz LZKVDIHKXJOWFZ-UHFFFAOYSA-N 1 0 295.430 3.702 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C[C@@H]2CCCC23CC3)cc1F ZINC001179304598 1121868518 /nfs/dbraw/zinc/86/85/18/1121868518.db2.gz ONVCSDYWYOAOIM-AWEZNQCLSA-N 1 0 276.399 3.562 20 10 CHCDRO COc1ccc(C[NH2+]CCCc2cccc(F)c2)cc1C ZINC000731678504 1121880612 /nfs/dbraw/zinc/88/06/12/1121880612.db2.gz FUBLNYKYXDTDFZ-UHFFFAOYSA-N 1 0 287.378 3.865 20 10 CHCDRO Oc1ccccc1C[N@H+](C[C@@H]1CCCCO1)C1CCCC1 ZINC000732204359 1121911648 /nfs/dbraw/zinc/91/16/48/1121911648.db2.gz JONYHHJRJJKHDX-KRWDZBQOSA-N 1 0 289.419 3.706 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C[C@@H]2CCc3ccccc32)cc1 ZINC000732229863 1121911957 /nfs/dbraw/zinc/91/19/57/1121911957.db2.gz MCXSTAQPMLVJIN-KRWDZBQOSA-N 1 0 280.415 3.572 20 10 CHCDRO CCCN(CCC)c1ccc(C[NH2+]C[C@](C)(O)CC)cc1 ZINC000732229207 1121912838 /nfs/dbraw/zinc/91/28/38/1121912838.db2.gz IJJQCKKQCZTLEX-GOSISDBHSA-N 1 0 292.467 3.564 20 10 CHCDRO CC(C)c1ccc(O)c(C[N@@H+]2CCC[C@H](c3ncc[nH]3)C2)c1 ZINC001179850589 1121917069 /nfs/dbraw/zinc/91/70/69/1121917069.db2.gz YQTWEIQTMFWVNM-HNNXBMFYSA-N 1 0 299.418 3.618 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2C[C@H](C)C[C@@H]2C)c(Cl)c1 ZINC001179898775 1121918494 /nfs/dbraw/zinc/91/84/94/1121918494.db2.gz UIQUZOGPDXCUSL-MNOVXSKESA-N 1 0 253.773 3.584 20 10 CHCDRO CC[C@H]1CCC[N@@H+]1C/C=C/c1ccc(N(C)C)cc1 ZINC001179863580 1121921782 /nfs/dbraw/zinc/92/17/82/1121921782.db2.gz PMPSOVFHVQGDGL-YERXGYGTSA-N 1 0 258.409 3.640 20 10 CHCDRO CC[C@H](C)[C@H](O)C[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000732820617 1121940928 /nfs/dbraw/zinc/94/09/28/1121940928.db2.gz NDLZZIIQMBQPGJ-IFXJQAMLSA-N 1 0 299.414 3.556 20 10 CHCDRO CC1(C)CCC[N@H+](Cc2c(O)ccc3ccncc32)C1 ZINC000732980359 1121948253 /nfs/dbraw/zinc/94/82/53/1121948253.db2.gz IOTQHLGXDGBGPR-UHFFFAOYSA-N 1 0 270.376 3.562 20 10 CHCDRO CC[C@H](C)C[N@H+](C)Cc1c([O-])ccc(Cl)c1F ZINC001180262003 1121969161 /nfs/dbraw/zinc/96/91/61/1121969161.db2.gz HCTJODSXRJZLOH-VIFPVBQESA-N 1 0 259.752 3.663 20 10 CHCDRO Cc1ccc(OCC[NH2+]Cc2c(O)cccc2Cl)cc1 ZINC000733322904 1121975577 /nfs/dbraw/zinc/97/55/77/1121975577.db2.gz GCSQMALBBXLBKU-UHFFFAOYSA-N 1 0 291.778 3.523 20 10 CHCDRO C[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000733322123 1121976010 /nfs/dbraw/zinc/97/60/10/1121976010.db2.gz MYEITAKOGLJVQL-WFASDCNBSA-N 1 0 264.388 3.560 20 10 CHCDRO CN(C)c1ccc(C[NH2+]CC2CCCCC2)cc1F ZINC000733323403 1121976571 /nfs/dbraw/zinc/97/65/71/1121976571.db2.gz YZYFUELWHMNZFT-UHFFFAOYSA-N 1 0 264.388 3.562 20 10 CHCDRO COc1ccc(C[NH2+]C2CC(C)(c3ccccc3)C2)c(O)c1 ZINC000733326561 1121977544 /nfs/dbraw/zinc/97/75/44/1121977544.db2.gz LPZNYUQIQZPGNX-UHFFFAOYSA-N 1 0 297.398 3.611 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]C/C=C\c1ccccc1 ZINC000733326568 1121978144 /nfs/dbraw/zinc/97/81/44/1121978144.db2.gz LWCNWCPMSSKTDQ-YVMONPNESA-N 1 0 273.763 3.849 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2CC[C@@H]2C(C)C)cc1Cl ZINC001180326200 1121980225 /nfs/dbraw/zinc/98/02/25/1121980225.db2.gz ITISWLKGNZYMGV-CYBMUJFWSA-N 1 0 253.773 3.584 20 10 CHCDRO CC(C)OCCC[N@H+](Cc1ccccc1O)C1CCCC1 ZINC000733613550 1122000394 /nfs/dbraw/zinc/00/03/94/1122000394.db2.gz BBQYFDXZLUMVKJ-UHFFFAOYSA-N 1 0 291.435 3.952 20 10 CHCDRO CC(C)c1ccc(O)c(C[NH2+][C@H]2CCO[C@@H](C3CC3)C2)c1 ZINC001180592363 1122003298 /nfs/dbraw/zinc/00/32/98/1122003298.db2.gz FIXVLEGWYDKNDQ-FUHWJXTLSA-N 1 0 289.419 3.563 20 10 CHCDRO Cc1ccc(C[N@@H+]2CC[C@@H](C(F)(F)F)C2(C)C)c(O)c1 ZINC001180907534 1122022092 /nfs/dbraw/zinc/02/20/92/1122022092.db2.gz QGORDNOYBPEOOC-CYBMUJFWSA-N 1 0 287.325 3.863 20 10 CHCDRO CCCC[C@](C)(CO)[NH2+]Cc1cc(C(C)C)ccc1O ZINC001206440240 1122030418 /nfs/dbraw/zinc/03/04/18/1122030418.db2.gz NFKUVLIOQUYEAV-QGZVFWFLSA-N 1 0 279.424 3.546 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CC[C@H]3CCCC[C@H]3C2)c(O)c1 ZINC001181196046 1122041894 /nfs/dbraw/zinc/04/18/94/1122041894.db2.gz HOLQTONBTLUGAH-IJEWVQPXSA-N 1 0 289.419 3.849 20 10 CHCDRO COc1cc(C)c(C[NH2+]C[C@@H]2CCC[C@@H](C)[C@@H]2C)c(O)c1 ZINC001181235336 1122044627 /nfs/dbraw/zinc/04/46/27/1122044627.db2.gz UZFPSOQBGXDIKQ-SNPRPXQTSA-N 1 0 291.435 3.871 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000710681754 1122054929 /nfs/dbraw/zinc/05/49/29/1122054929.db2.gz ZZKUJACODRZETN-VNQPRFMTSA-N 1 0 268.404 3.765 20 10 CHCDRO CCC[C@H]([NH2+]Cc1cccc(OC)c1O)[C@@H]1CC1(C)C ZINC001181487942 1122059166 /nfs/dbraw/zinc/05/91/66/1122059166.db2.gz RFWQXAKBNJBVCW-KBPBESRZSA-N 1 0 277.408 3.705 20 10 CHCDRO CC(C)c1ccc(O)c(C[N@@H+]2CCCC[C@H]2c2cc[nH]n2)c1 ZINC001181696866 1122073263 /nfs/dbraw/zinc/07/32/63/1122073263.db2.gz CGZGADSWAFHUOH-KRWDZBQOSA-N 1 0 299.418 3.966 20 10 CHCDRO Cc1cc(C[NH2+]Cc2cc(C(C)C)ccc2O)ccn1 ZINC001181901398 1122093985 /nfs/dbraw/zinc/09/39/85/1122093985.db2.gz SOHKJDMIFKIIPJ-UHFFFAOYSA-N 1 0 270.376 3.509 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]CC[C@@H]1CCc2ccccc21 ZINC001182109745 1122110436 /nfs/dbraw/zinc/11/04/36/1122110436.db2.gz SJCZNCWEEJVKOH-AWEZNQCLSA-N 1 0 285.362 3.741 20 10 CHCDRO Cc1ccoc1C[NH2+]Cc1cc(C(C)C)ccc1O ZINC001182161970 1122115968 /nfs/dbraw/zinc/11/59/68/1122115968.db2.gz VLLQHIBXPQIZFX-UHFFFAOYSA-N 1 0 259.349 3.707 20 10 CHCDRO CO[C@](C)([C@@H](C)[NH2+]Cc1cc(C(C)C)ccc1O)C1CC1 ZINC001182356441 1122147652 /nfs/dbraw/zinc/14/76/52/1122147652.db2.gz KJCTTXRKHKLLCB-FZKQIMNGSA-N 1 0 291.435 3.809 20 10 CHCDRO CCOC[C@H](C)[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1[O-] ZINC000774359682 1122157050 /nfs/dbraw/zinc/15/70/50/1122157050.db2.gz OGYVXIAHVCEBJO-IUCAKERBSA-N 1 0 292.206 3.775 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCO[C@H](C(C)(C)C)C1)c1ccccc1O ZINC000272803930 1122213584 /nfs/dbraw/zinc/21/35/84/1122213584.db2.gz BVOAYNYNDAAAAI-XEZPLFJOSA-N 1 0 277.408 3.637 20 10 CHCDRO C[C@H]([NH2+]CC(C)(C)Oc1ccccc1)c1ccccc1O ZINC001183364146 1122218586 /nfs/dbraw/zinc/21/85/86/1122218586.db2.gz WRFIIDBMEHOLIA-AWEZNQCLSA-N 1 0 285.387 3.900 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2cccs2)c(O)c1C ZINC000273297577 1122226320 /nfs/dbraw/zinc/22/63/20/1122226320.db2.gz AMYBVVRBAUBBSL-GFCCVEGCSA-N 1 0 261.390 3.921 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC2CCSCC2)c(O)c1C ZINC000273368729 1122229840 /nfs/dbraw/zinc/22/98/40/1122229840.db2.gz BXBWNKQRZGZPAF-CYBMUJFWSA-N 1 0 279.449 3.803 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@@H]3OCC[C@H]32)c(O)c1C ZINC000273363327 1122230623 /nfs/dbraw/zinc/23/06/23/1122230623.db2.gz AVXQQBSSRQZWLT-LLLHUVSDSA-N 1 0 289.419 3.617 20 10 CHCDRO COc1cccc(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)c1 ZINC000273390342 1122231305 /nfs/dbraw/zinc/23/13/05/1122231305.db2.gz KOBGJEBFFCLNPI-AWEZNQCLSA-N 1 0 285.387 3.868 20 10 CHCDRO COCC[C@@H]([NH2+][C@@H](C)c1cc(C)ccc1O)c1ccco1 ZINC000273413960 1122231357 /nfs/dbraw/zinc/23/13/57/1122231357.db2.gz IIGZGODMWFLOON-DZGCQCFKSA-N 1 0 289.375 3.722 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CCC2CCC2)cc1Cl ZINC001183630963 1122233275 /nfs/dbraw/zinc/23/32/75/1122233275.db2.gz NNPRRQPSNVJFRD-UHFFFAOYSA-N 1 0 253.773 3.634 20 10 CHCDRO CCOCCC1(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)CC1 ZINC000273449254 1122233712 /nfs/dbraw/zinc/23/37/12/1122233712.db2.gz FRENWAUBRKHOFL-HNNXBMFYSA-N 1 0 291.435 3.866 20 10 CHCDRO COc1cc(C)c(C[N@H+]2Cc3ccccc3[C@@H](C)C2)c(O)c1 ZINC001183673119 1122234042 /nfs/dbraw/zinc/23/40/42/1122234042.db2.gz PCFCUARBBAASPJ-AWEZNQCLSA-N 1 0 297.398 3.829 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]C2(c3ccccc3)CC2)c1 ZINC000273475300 1122235530 /nfs/dbraw/zinc/23/55/30/1122235530.db2.gz KNCGYBBDZOJNEO-ZDUSSCGKSA-N 1 0 283.371 3.741 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)ccc1O)[C@H]1CCCCO1 ZINC000273505202 1122236219 /nfs/dbraw/zinc/23/62/19/1122236219.db2.gz QXAUBPBFKMCWEL-FIXISWKDSA-N 1 0 283.799 3.654 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccccc2N(C)C)c(O)c1 ZINC000273536911 1122237753 /nfs/dbraw/zinc/23/77/53/1122237753.db2.gz XNISGCYFNZUZCJ-CQSZACIVSA-N 1 0 284.403 3.617 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCO[C@H](C(C)(C)C)C1)c1cc(F)ccc1O ZINC000273530930 1122238086 /nfs/dbraw/zinc/23/80/86/1122238086.db2.gz WHUCKDVBJGVNDK-RBOXIYTFSA-N 1 0 295.398 3.776 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@@H]2C[C@@H]2[C@@H]2C[C@H]2C)cc1Cl ZINC001183822049 1122242461 /nfs/dbraw/zinc/24/24/61/1122242461.db2.gz AUGTUBVTEVLQDS-MWQHPAIMSA-N 1 0 279.811 3.736 20 10 CHCDRO CC[C@@H](C)C[C@H](CC)[NH2+]Cc1c([O-])cccc1F ZINC001183920006 1122248357 /nfs/dbraw/zinc/24/83/57/1122248357.db2.gz SKOPYHSGBAIYLS-NEPJUHHUSA-N 1 0 253.361 3.836 20 10 CHCDRO Cc1cccc(CC[C@H](C)[NH2+]Cc2c([O-])cccc2F)c1 ZINC001183919467 1122248546 /nfs/dbraw/zinc/24/85/46/1122248546.db2.gz LICRZQOFTVCDNL-AWEZNQCLSA-N 1 0 287.378 3.951 20 10 CHCDRO CC[C@@H]([NH2+]CCOc1cccc(F)c1)c1ccccc1O ZINC000183322554 1129044744 /nfs/dbraw/zinc/04/47/44/1129044744.db2.gz KHFSSWGVUMTVOU-MRXNPFEDSA-N 1 0 289.350 3.651 20 10 CHCDRO CCc1nc(C[NH2+][C@H](CC)c2ccccc2O)cs1 ZINC000183322390 1129045087 /nfs/dbraw/zinc/04/50/87/1129045087.db2.gz OKXHNVSJSIVYDV-CYBMUJFWSA-N 1 0 276.405 3.652 20 10 CHCDRO CCCN(Cc1ncc(Cl)s1)c1ccc(C[NH3+])cc1 ZINC000775139718 1122439713 /nfs/dbraw/zinc/43/97/13/1122439713.db2.gz FJPOUTPKROFWQO-UHFFFAOYSA-N 1 0 295.839 3.672 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H]1CS[C@H](C(C)C)C1 ZINC000775141091 1122440632 /nfs/dbraw/zinc/44/06/32/1122440632.db2.gz VZOAMGVNJUBOQV-IRXDYDNUSA-N 1 0 292.492 3.892 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]C1(Cc2ccccc2)CC1 ZINC000775326090 1122515847 /nfs/dbraw/zinc/51/58/47/1122515847.db2.gz PVRLPUVRKDSREZ-UHFFFAOYSA-N 1 0 287.790 3.911 20 10 CHCDRO COc1ccc(C[NH2+]Cc2cccc(C(C)C)c2)c(O)c1 ZINC000775331646 1122517587 /nfs/dbraw/zinc/51/75/87/1122517587.db2.gz ZWVGNXZMECIUAX-UHFFFAOYSA-N 1 0 285.387 3.814 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1c(F)cncc1F)c1ccccc1O ZINC000285826935 1122524000 /nfs/dbraw/zinc/52/40/00/1122524000.db2.gz XLSUEYXHHGOMSL-YGRLFVJLSA-N 1 0 292.329 3.867 20 10 CHCDRO C[C@H]([NH2+]Cc1cccc(F)c1F)c1ccc(N(C)C)cc1 ZINC000775362538 1122528666 /nfs/dbraw/zinc/52/86/66/1122528666.db2.gz HVZFMUOTYQQERN-LBPRGKRZSA-N 1 0 290.357 3.882 20 10 CHCDRO C[C@H](C[NH2+][C@@H](C)c1ccccc1O)Oc1ccc(F)cc1 ZINC000183534800 1129060916 /nfs/dbraw/zinc/06/09/16/1129060916.db2.gz NCXUOPGUMLUTJM-OLZOCXBDSA-N 1 0 289.350 3.649 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]CCCc2ccccc2C)c1 ZINC000775375493 1122533724 /nfs/dbraw/zinc/53/37/24/1122533724.db2.gz LYSNWANWNNXWBH-OAHLLOKOSA-N 1 0 299.414 3.993 20 10 CHCDRO Cc1ccccc1O[C@@H](C)C[NH2+][C@H](C)c1ccccc1O ZINC000183534450 1129061038 /nfs/dbraw/zinc/06/10/38/1129061038.db2.gz QBFCCSWOBVMVHP-LSDHHAIUSA-N 1 0 285.387 3.819 20 10 CHCDRO CCO[C@@H]1C[C@H]([NH2+][C@@H](C)c2ccccc2O)C12CCCC2 ZINC000183537944 1129061249 /nfs/dbraw/zinc/06/12/49/1129061249.db2.gz QKQSUIJRXQZVQO-RRQGHBQHSA-N 1 0 289.419 3.781 20 10 CHCDRO CCOc1ccc([C@@H](C)[NH2+]Cc2cc(C)ccc2O)cc1 ZINC000071407766 1129062128 /nfs/dbraw/zinc/06/21/28/1129062128.db2.gz OMWVJKZIHWEACJ-CQSZACIVSA-N 1 0 285.387 3.950 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H](C)Cc2ccccc2C)c1 ZINC000071408112 1129062517 /nfs/dbraw/zinc/06/25/17/1129062517.db2.gz CCIYDPHUMRFNPJ-HNNXBMFYSA-N 1 0 269.388 3.730 20 10 CHCDRO CC[C@@H](CSC)[NH2+][C@@H](CC)c1ccc(N(C)C)cc1 ZINC000775424707 1122561775 /nfs/dbraw/zinc/56/17/75/1122561775.db2.gz XLJHFXUZIICTRV-HOCLYGCPSA-N 1 0 280.481 3.935 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CCC[C@H]3CCC[C@H]32)cc1 ZINC001191085824 1122576578 /nfs/dbraw/zinc/57/65/78/1122576578.db2.gz TWNJBDKKVAYKSF-SJLPKXTDSA-N 1 0 272.436 3.907 20 10 CHCDRO CC[C@@H]([NH2+]CC1(O)CCCCC1)c1cc(Cl)ccc1O ZINC000775500095 1122627516 /nfs/dbraw/zinc/62/75/16/1122627516.db2.gz OGPCHTSHONKLPY-CQSZACIVSA-N 1 0 297.826 3.782 20 10 CHCDRO CCC[C@@](C)(O)C[NH2+][C@H](CC)c1cc(Cl)ccc1O ZINC000775503245 1122628523 /nfs/dbraw/zinc/62/85/23/1122628523.db2.gz DVLSFPRBHVSDPN-UKRRQHHQSA-N 1 0 285.815 3.637 20 10 CHCDRO CC[C@@H]([NH2+][C@H](COC)C(C)C)c1cc(Cl)ccc1O ZINC000775510286 1122630595 /nfs/dbraw/zinc/63/05/95/1122630595.db2.gz ZQZQDEKWBMMKBS-ZIAGYGMSSA-N 1 0 285.815 3.757 20 10 CHCDRO CC[C@H](COC)[NH2+][C@H](CC)c1cc(Cl)ccc1O ZINC000775510203 1122631089 /nfs/dbraw/zinc/63/10/89/1122631089.db2.gz WQRWWTBPWKCNHE-DGCLKSJQSA-N 1 0 271.788 3.511 20 10 CHCDRO CC[C@@H]([NH2+]C[C@]1(C)CCOC1)c1cc(Cl)ccc1O ZINC000775503166 1122631501 /nfs/dbraw/zinc/63/15/01/1122631501.db2.gz CTMBRQHLBZTILS-HIFRSBDPSA-N 1 0 283.799 3.513 20 10 CHCDRO CCC(CC)[C@H](O)C[NH2+][C@H](CC)c1cc(Cl)ccc1O ZINC000775503157 1122631631 /nfs/dbraw/zinc/63/16/31/1122631631.db2.gz CTLRWNNUFFIVTQ-GDBMZVCRSA-N 1 0 299.842 3.883 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](OC)C(C)C)c1cc(Cl)ccc1O ZINC000775512061 1122633078 /nfs/dbraw/zinc/63/30/78/1122633078.db2.gz JVUDSRXNTLBBPB-ZFWWWQNUSA-N 1 0 285.815 3.757 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCCc3cc(O)c(O)cc3C2)c1 ZINC001203752004 1122634537 /nfs/dbraw/zinc/63/45/37/1122634537.db2.gz OTGFZYYWGUMTPA-UHFFFAOYSA-N 1 0 297.398 3.663 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](COC)Cc1ccccc1)c1ccccc1O ZINC000775514084 1122635050 /nfs/dbraw/zinc/63/50/50/1122635050.db2.gz VOWLLTHNEYUTBV-SJLPKXTDSA-N 1 0 299.414 3.691 20 10 CHCDRO CC[C@H]([NH2+]CC1(CCOC)CC1)c1cc(Cl)ccc1O ZINC000775521952 1122638782 /nfs/dbraw/zinc/63/87/82/1122638782.db2.gz GDRMEKUHSCMOLR-AWEZNQCLSA-N 1 0 297.826 3.903 20 10 CHCDRO CC[C@H]([NH2+]CC1Cc2ccccc2C1)c1ccccc1O ZINC000775523042 1122639624 /nfs/dbraw/zinc/63/96/24/1122639624.db2.gz DWCICNOTRONNIR-SFHVURJKSA-N 1 0 281.399 3.848 20 10 CHCDRO CC[C@@H](O)CCC[NH2+][C@@H](CC)c1cc(Cl)ccc1O ZINC000775524931 1122641915 /nfs/dbraw/zinc/64/19/15/1122641915.db2.gz CTXHIXYCCDHGLL-OCCSQVGLSA-N 1 0 285.815 3.637 20 10 CHCDRO CC[C@@H]([NH2+]CCOC1CCC1)c1cc(Cl)ccc1O ZINC000775534408 1122650597 /nfs/dbraw/zinc/65/05/97/1122650597.db2.gz DWRYXEQPMOYXBO-CQSZACIVSA-N 1 0 283.799 3.655 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1cncc(F)c1)c1ccccc1O ZINC000775547089 1122657597 /nfs/dbraw/zinc/65/75/97/1122657597.db2.gz NTTIXMOWHKPXGB-XHDPSFHLSA-N 1 0 274.339 3.728 20 10 CHCDRO CC[C@@H]([NH2+]CCOCC1CCC1)c1cc(Cl)ccc1O ZINC000775556282 1122660826 /nfs/dbraw/zinc/66/08/26/1122660826.db2.gz VYMUGXBTIWKAGS-OAHLLOKOSA-N 1 0 297.826 3.903 20 10 CHCDRO Cc1ncc([C@H](C)[NH2+][C@@H](C)c2ccc(N(C)C)cc2)s1 ZINC000775582096 1122682239 /nfs/dbraw/zinc/68/22/39/1122682239.db2.gz LMGDGUPCSJMYEZ-RYUDHWBXSA-N 1 0 289.448 3.929 20 10 CHCDRO Cc1nc(C)c(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)s1 ZINC000294642321 1122734072 /nfs/dbraw/zinc/73/40/72/1122734072.db2.gz GICGCCOJARQVIZ-LBPRGKRZSA-N 1 0 290.432 3.933 20 10 CHCDRO CC(C)C(C)(C)C[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000219269190 1122739681 /nfs/dbraw/zinc/73/96/81/1122739681.db2.gz SGPQWXGYGJWEHY-NSHDSACASA-N 1 0 253.361 3.864 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1cnn(CC)c1)c1ccc(C)cc1O ZINC000296118403 1122763646 /nfs/dbraw/zinc/76/36/46/1122763646.db2.gz ZWUGFMTUZQZIAV-CZUORRHYSA-N 1 0 287.407 3.719 20 10 CHCDRO Cc1cccc(C[N@H+](C)CCCc2ccccc2)c1O ZINC000775651666 1122868753 /nfs/dbraw/zinc/86/87/53/1122868753.db2.gz QGSCYCPGYXAGEA-UHFFFAOYSA-N 1 0 269.388 3.765 20 10 CHCDRO CC1(C)CCC[N@@H+]1Cc1cc(Cl)cc(F)c1[O-] ZINC000775669153 1122883199 /nfs/dbraw/zinc/88/31/99/1122883199.db2.gz GOSMNMHWIZZMSD-UHFFFAOYSA-N 1 0 257.736 3.559 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC[C@H](C3CCC3)C2)cc1 ZINC001196253382 1122913599 /nfs/dbraw/zinc/91/35/99/1122913599.db2.gz CWDWRRBRRZMSMT-KRWDZBQOSA-N 1 0 272.436 3.765 20 10 CHCDRO CC(C)[C@@H]1CC[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000775765544 1122949311 /nfs/dbraw/zinc/94/93/11/1122949311.db2.gz PPQKYSIYMVELSH-SFHVURJKSA-N 1 0 272.436 3.907 20 10 CHCDRO Cc1cccc(C[N@H+](Cc2ccc(O)c(O)c2)C2CC2)c1C ZINC001203883060 1122967532 /nfs/dbraw/zinc/96/75/32/1122967532.db2.gz CYJOSVSPFNPVIG-UHFFFAOYSA-N 1 0 297.398 3.879 20 10 CHCDRO Cc1cccc(C[N@H+]2CCC[C@H](C(F)(F)F)[C@H]2C)c1O ZINC000776013187 1123034974 /nfs/dbraw/zinc/03/49/74/1123034974.db2.gz LFDDVBTVWZOCBI-YPMHNXCESA-N 1 0 287.325 3.863 20 10 CHCDRO Cc1cccc(C[NH2+]Cc2ccc([C@H]3C[C@@H]3C)o2)c1O ZINC000776024913 1123041580 /nfs/dbraw/zinc/04/15/80/1123041580.db2.gz ZVDBXACNYQXJJY-WFASDCNBSA-N 1 0 271.360 3.707 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@@H]2CC=CCC2)c(Cl)c1 ZINC001199843488 1123042406 /nfs/dbraw/zinc/04/24/06/1123042406.db2.gz NVPSGOBLVBGGAO-GFCCVEGCSA-N 1 0 265.784 3.800 20 10 CHCDRO Cc1cccc(C[NH2+]CCc2ccc3ccccc3n2)c1O ZINC000776151792 1123083945 /nfs/dbraw/zinc/08/39/45/1123083945.db2.gz VKQVQZVVKZHLCE-UHFFFAOYSA-N 1 0 292.382 3.581 20 10 CHCDRO Cc1cccc(C[NH2+]C2(c3ccc(F)cc3)CC2)c1O ZINC000776173690 1123101672 /nfs/dbraw/zinc/10/16/72/1123101672.db2.gz FYBOCZYDKLYUQO-UHFFFAOYSA-N 1 0 271.335 3.619 20 10 CHCDRO C[C@H](COc1ccccc1)[NH2+]Cc1c(O)cccc1Cl ZINC000776174397 1123101823 /nfs/dbraw/zinc/10/18/23/1123101823.db2.gz KYVCUQIATCOVTC-GFCCVEGCSA-N 1 0 291.778 3.603 20 10 CHCDRO COC1CCC(C[NH2+]Cc2cc(Cl)cc(C)c2O)CC1 ZINC000776231991 1123169015 /nfs/dbraw/zinc/16/90/15/1123169015.db2.gz MRLIXVCAFJFHAU-UHFFFAOYSA-N 1 0 297.826 3.649 20 10 CHCDRO C[C@@H]1CC[C@H](C[NH2+]Cc2cc(F)c(N(C)C)cc2F)C1 ZINC001202251575 1123189918 /nfs/dbraw/zinc/18/99/18/1123189918.db2.gz SINODEPRDJGXRD-NEPJUHHUSA-N 1 0 282.378 3.557 20 10 CHCDRO COc1cccc(C[NH2+]Cc2ccc(C(C)(C)C)cc2)c1O ZINC000237218695 1123202487 /nfs/dbraw/zinc/20/24/87/1123202487.db2.gz MAMWBRYAOVVDLR-UHFFFAOYSA-N 1 0 299.414 3.988 20 10 CHCDRO COc1cc(C[NH2+][C@H]2CC[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC000850296917 1123252042 /nfs/dbraw/zinc/25/20/42/1123252042.db2.gz ZWGHMPKKVZALLG-NHYWBVRUSA-N 1 0 277.408 3.586 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]C[C@@H]2C(C)(C)C2(F)F)cc1 ZINC000850394241 1123262199 /nfs/dbraw/zinc/26/21/99/1123262199.db2.gz NVDLJDMKBDLWDV-IYKSTZQJSA-N 1 0 294.389 3.647 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2[C@@H]3Cc4cc(F)ccc4[C@@H]32)cc1C ZINC000850408725 1123264094 /nfs/dbraw/zinc/26/40/94/1123264094.db2.gz DETXCYFHRNAYFS-NZSAHSFTSA-N 1 0 297.373 3.571 20 10 CHCDRO c1csc(SCCC[NH2+][C@@H]2CCCSCC2)n1 ZINC000850435489 1123266059 /nfs/dbraw/zinc/26/60/59/1123266059.db2.gz AJYNYRHDNPZLSJ-LLVKDONJSA-N 1 0 288.507 3.501 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCN1C(C)(C)C)c1cc(Cl)ccc1O ZINC000850480744 1123273312 /nfs/dbraw/zinc/27/33/12/1123273312.db2.gz DDFARENKMXIHQD-DGCLKSJQSA-N 1 0 296.842 3.569 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCN(C(C)(C)C)C1)c1ccc(Cl)cc1O ZINC000850495288 1123274873 /nfs/dbraw/zinc/27/48/73/1123274873.db2.gz ZLDMRYHPUUYNSQ-AAEUAGOBSA-N 1 0 296.842 3.569 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CCc2cnccc2C)c(O)c1 ZINC000850504760 1123275895 /nfs/dbraw/zinc/27/58/95/1123275895.db2.gz DRDFIKHBSGMJFR-HNNXBMFYSA-N 1 0 284.403 3.606 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1C=CCC1)c1cc(Cl)ccc1O ZINC000850510353 1123278118 /nfs/dbraw/zinc/27/81/18/1123278118.db2.gz SUDWVOKEVOCSAA-WCQYABFASA-N 1 0 251.757 3.805 20 10 CHCDRO COCc1csc(C[NH2+][C@@H](C)c2cc(F)ccc2O)c1 ZINC000850531487 1123284907 /nfs/dbraw/zinc/28/49/07/1123284907.db2.gz FWXCBFLZPOBYNE-JTQLQIEISA-N 1 0 295.379 3.590 20 10 CHCDRO C[C@H]([NH2+][C@H]1C[C@H](Oc2ccccc2)C1)c1ccccc1O ZINC000850532264 1123285996 /nfs/dbraw/zinc/28/59/96/1123285996.db2.gz RUCXMPAOVRHDNM-DZKIICNBSA-N 1 0 283.371 3.653 20 10 CHCDRO CCSC1(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)CC1 ZINC000850553478 1123289892 /nfs/dbraw/zinc/28/98/92/1123289892.db2.gz XBMXNOWVWUWEAT-ZDUSSCGKSA-N 1 0 279.449 3.945 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1C(C)(C)C1(F)F)c1ccc(Cl)cc1O ZINC000850553201 1123290024 /nfs/dbraw/zinc/29/00/24/1123290024.db2.gz TZJMQSLDDJEHIC-QPUJVOFHSA-N 1 0 289.753 3.988 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]C2(CC(C)C)CC2)c1O ZINC000850566582 1123293691 /nfs/dbraw/zinc/29/36/91/1123293691.db2.gz OAWSFKYWXVCTSD-GFCCVEGCSA-N 1 0 263.381 3.630 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCOC1(C)C)c1ccc(C)cc1O ZINC000850570399 1123293994 /nfs/dbraw/zinc/29/39/94/1123293994.db2.gz GWAPYVALFBJQGD-ZFWWWQNUSA-N 1 0 277.408 3.556 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCOC1(C)C)c1ccc(N(C)C)cc1 ZINC000850570329 1123294170 /nfs/dbraw/zinc/29/41/70/1123294170.db2.gz GADXEFLGULFTAY-RDJZCZTQSA-N 1 0 290.451 3.608 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCOC1(C)C)c1cc(Cl)ccc1O ZINC000850570194 1123294483 /nfs/dbraw/zinc/29/44/83/1123294483.db2.gz FPUZJCDLCCNTBQ-QWRGUYRKSA-N 1 0 283.799 3.511 20 10 CHCDRO CC[C@@H](CC(F)F)C[N@H+](C)Cc1ccccc1O ZINC000851841502 1123384511 /nfs/dbraw/zinc/38/45/11/1123384511.db2.gz UIQWTCULSQLNPZ-NSHDSACASA-N 1 0 257.324 3.505 20 10 CHCDRO CCCC[N@H+](Cc1ccccc1O)[C@@H]1CC[C@H](OC)C1 ZINC000852019036 1123393349 /nfs/dbraw/zinc/39/33/49/1123393349.db2.gz TUFNGHSRZSHVSR-CVEARBPZSA-N 1 0 277.408 3.562 20 10 CHCDRO CC[C@H]1C[N@H+](Cc2c(O)ccc3ccccc32)C[C@H](C)O1 ZINC000111168329 1123428356 /nfs/dbraw/zinc/42/83/56/1123428356.db2.gz ACNKTYNDCMHGMV-ZFWWWQNUSA-N 1 0 285.387 3.545 20 10 CHCDRO C[C@@H]([NH2+]CC(C)(C)[C@@H]1CCCCO1)c1ccccc1O ZINC000783520319 1123468595 /nfs/dbraw/zinc/46/85/95/1123468595.db2.gz XKDFXMQBAVCGLE-CJNGLKHVSA-N 1 0 277.408 3.638 20 10 CHCDRO COc1ccc(C2([NH2+][C@H](C)c3ccccc3O)CC2)cc1 ZINC000783522841 1123475611 /nfs/dbraw/zinc/47/56/11/1123475611.db2.gz BEDXEQUGQZHDQH-CYBMUJFWSA-N 1 0 283.371 3.741 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCc3cc(N)ccc32)c(O)c1C ZINC000854226135 1123478130 /nfs/dbraw/zinc/47/81/30/1123478130.db2.gz OMRMZVDFRFTSEU-UGSOOPFHSA-N 1 0 296.414 3.929 20 10 CHCDRO CCc1cccc(C[NH2+]C(C)(C)[C@@H](O)c2ccccc2)c1O ZINC000895661349 1123501927 /nfs/dbraw/zinc/50/19/27/1123501927.db2.gz HDPNTORSRIVZGJ-SFHVURJKSA-N 1 0 299.414 3.556 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(Cl)c(C)cc1O)[C@H]1CCCOC1 ZINC000895664133 1123503704 /nfs/dbraw/zinc/50/37/04/1123503704.db2.gz PWMSNOHNLNHQNW-WFASDCNBSA-N 1 0 297.826 3.649 20 10 CHCDRO Cc1cccc(C[NH2+][C@H]2c3ccccc3CC[C@H]2F)c1O ZINC000895693155 1123505658 /nfs/dbraw/zinc/50/56/58/1123505658.db2.gz YZTRBBDJPMDXRJ-SJORKVTESA-N 1 0 285.362 3.816 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccccc1O)c1ccc2ncsc2c1 ZINC000776807412 1123514435 /nfs/dbraw/zinc/51/44/35/1123514435.db2.gz HQJMIWWWXQTBBG-LLVKDONJSA-N 1 0 284.384 3.853 20 10 CHCDRO CCSC1(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)CC1 ZINC000691823707 1123596862 /nfs/dbraw/zinc/59/68/62/1123596862.db2.gz VTEXTQGTVKVJNN-CYBMUJFWSA-N 1 0 278.465 3.689 20 10 CHCDRO Cc1ccc(C[N@@H+](Cc2ccccn2)CC(C)C)c(O)c1 ZINC000896661559 1123609899 /nfs/dbraw/zinc/60/98/99/1123609899.db2.gz RWNKJGXGYXHVJJ-UHFFFAOYSA-N 1 0 284.403 3.754 20 10 CHCDRO CC(C)c1ccc(O)c(C[NH2+][C@@H]2CC(C)(C)OC2(C)C)c1 ZINC001205007304 1123627845 /nfs/dbraw/zinc/62/78/45/1123627845.db2.gz INLGUAQXRQLYJY-MRXNPFEDSA-N 1 0 291.435 3.951 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2cc(C)c(C)cc2C)c1 ZINC000858236968 1123639423 /nfs/dbraw/zinc/63/94/23/1123639423.db2.gz BVPPIYGXDCBWSK-UHFFFAOYSA-N 1 0 269.388 3.916 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CC[C@H]2CCCOC2)cc1 ZINC000858445274 1123654856 /nfs/dbraw/zinc/65/48/56/1123654856.db2.gz DXBAJDUFJXFUKP-HZPDHXFCSA-N 1 0 290.451 3.610 20 10 CHCDRO CCC[C@H](C[NH2+][C@@H](C)c1ccc(C)c(C)c1O)OCC ZINC000858451228 1123655493 /nfs/dbraw/zinc/65/54/93/1123655493.db2.gz PJFAZLBSYFKVQG-LSDHHAIUSA-N 1 0 279.424 3.865 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2cccnc2C)cc1 ZINC000858518118 1123659453 /nfs/dbraw/zinc/65/94/53/1123659453.db2.gz FMHIQCHFVUMITC-CQSZACIVSA-N 1 0 283.419 3.697 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CO[C@@H](C2CC2)C1)c1ccc2ccccc2c1O ZINC000858548966 1123661577 /nfs/dbraw/zinc/66/15/77/1123661577.db2.gz YCUWOITWIIHLAO-XLWVJDPXSA-N 1 0 297.398 3.764 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCC(F)(F)C1)c1cc(F)ccc1O ZINC000281273125 1123692533 /nfs/dbraw/zinc/69/25/33/1123692533.db2.gz YRHQLFBFJBIFOS-ZJUUUORDSA-N 1 0 273.298 3.617 20 10 CHCDRO COCC(C)(C)CCC[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000287117233 1123745596 /nfs/dbraw/zinc/74/55/96/1123745596.db2.gz QWVQFGPBGOEFSE-AWEZNQCLSA-N 1 0 279.424 3.804 20 10 CHCDRO CCOc1cccc(C[NH+]2CCC(F)(C3CC3)CC2)c1O ZINC000896945777 1123791281 /nfs/dbraw/zinc/79/12/81/1123791281.db2.gz ALHLMLSYIVAISW-UHFFFAOYSA-N 1 0 293.382 3.505 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+]Cc2ccc3ccccc3c2O)CCS1 ZINC000896951649 1123792324 /nfs/dbraw/zinc/79/23/24/1123792324.db2.gz LGPSGVHUXDWRCM-IUODEOHRSA-N 1 0 287.428 3.919 20 10 CHCDRO C[C@H]1C[C@@H]([NH2+]Cc2ccc3ccccc3c2O)CCS1 ZINC000896951652 1123792359 /nfs/dbraw/zinc/79/23/59/1123792359.db2.gz LGPSGVHUXDWRCM-WFASDCNBSA-N 1 0 287.428 3.919 20 10 CHCDRO CC[C@@H](C)[N@H+](CCO)Cc1cc(-c2ccccc2)ccc1O ZINC000862387254 1123806279 /nfs/dbraw/zinc/80/62/79/1123806279.db2.gz JEOLOMRNQHIMOB-OAHLLOKOSA-N 1 0 299.414 3.652 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H]2CS[C@@H](C(C)(C)C)C2)c1 ZINC000862478475 1123812955 /nfs/dbraw/zinc/81/29/55/1123812955.db2.gz HYWJDXHLJJPRMC-DZGCQCFKSA-N 1 0 279.449 3.710 20 10 CHCDRO CCc1cccc(C[NH+]2CC(Cc3cccs3)C2)c1O ZINC000862538660 1123817216 /nfs/dbraw/zinc/81/72/16/1123817216.db2.gz CDNAZSRKVNOSRD-UHFFFAOYSA-N 1 0 287.428 3.691 20 10 CHCDRO Cc1cc(F)c(C[NH2+]Cc2c(C)cccc2O)c(F)c1 ZINC000897212562 1123846440 /nfs/dbraw/zinc/84/64/40/1123846440.db2.gz DIQRCNLEPBYJKJ-UHFFFAOYSA-N 1 0 277.314 3.577 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)[C@](C)(OC)C1CC1)c1ccccc1O ZINC000840860503 1123860338 /nfs/dbraw/zinc/86/03/38/1123860338.db2.gz VHOYJMWIYJVNNU-NUTKFTJISA-N 1 0 277.408 3.637 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCCC[C@H]2F)c(O)c1 ZINC000840875437 1123887821 /nfs/dbraw/zinc/88/78/21/1123887821.db2.gz GXMYZSUXQFUHTE-MRVWCRGKSA-N 1 0 251.345 3.632 20 10 CHCDRO C[N@H+](Cc1c(O)ccc2ccncc21)[C@@H]1CCC(C)(C)C1 ZINC000794686839 1123927838 /nfs/dbraw/zinc/92/78/38/1123927838.db2.gz RYLLLQPBGPOWLJ-CQSZACIVSA-N 1 0 284.403 3.951 20 10 CHCDRO CC[C@H]([NH2+]Cc1cccc(C)n1)c1ccc(C)cc1O ZINC000794795809 1123949338 /nfs/dbraw/zinc/94/93/38/1123949338.db2.gz JEBLKTLXNHEYNU-INIZCTEOSA-N 1 0 270.376 3.645 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc([C@H](C)O)cc1)c1ccc(C)cc1O ZINC000794801679 1123950423 /nfs/dbraw/zinc/95/04/23/1123950423.db2.gz JWTKUVDISCBWOU-KBXCAEBGSA-N 1 0 299.414 3.995 20 10 CHCDRO CC[C@@H]([NH2+]Cc1csc(C)n1)c1ccc(C)cc1O ZINC000794797690 1123950918 /nfs/dbraw/zinc/95/09/18/1123950918.db2.gz PRJRERDZSOHKDW-CQSZACIVSA-N 1 0 276.405 3.706 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[C@@H](C)[C@@H](C)C2)c1 ZINC000085040593 1129155776 /nfs/dbraw/zinc/15/57/76/1129155776.db2.gz UALMBNTYYISJFD-ZOBORPQBSA-N 1 0 277.408 3.876 20 10 CHCDRO CC[C@H]([NH2+]CCNc1cccc(C)n1)c1ccc(C)cc1O ZINC000794813000 1123957329 /nfs/dbraw/zinc/95/73/29/1123957329.db2.gz AKSJBWQMTHOTMA-INIZCTEOSA-N 1 0 299.418 3.557 20 10 CHCDRO CCOC[C@@H]([NH2+][C@@H](CC)c1ccc(C)cc1O)C(C)C ZINC000794812482 1123959227 /nfs/dbraw/zinc/95/92/27/1123959227.db2.gz DQKSPTYWGONIBA-JKSUJKDBSA-N 1 0 279.424 3.802 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](O)c1cccc(C)c1)c1ccc(C)cc1O ZINC000794817032 1123959489 /nfs/dbraw/zinc/95/94/89/1123959489.db2.gz OHRLIJIPGMQYFX-MJGOQNOKSA-N 1 0 299.414 3.783 20 10 CHCDRO CC[C@@H]([NH2+]C1Cc2ccccc2C1)c1ccc(C)cc1O ZINC000794818652 1123961647 /nfs/dbraw/zinc/96/16/47/1123961647.db2.gz XUGYOQBMKJTUPX-GOSISDBHSA-N 1 0 281.399 3.909 20 10 CHCDRO C[C@@H]1C[C@@H]([NH2+]CCC2(C)CC2)c2c1c(F)ccc2O ZINC000794828436 1123962344 /nfs/dbraw/zinc/96/23/44/1123962344.db2.gz OVYWKURKSBESLO-ZYHUDNBSSA-N 1 0 263.356 3.859 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CCc2cccc(C)n2)cc1 ZINC000794828000 1123962469 /nfs/dbraw/zinc/96/24/69/1123962469.db2.gz NUPOMARBJBXRSF-INIZCTEOSA-N 1 0 297.446 3.739 20 10 CHCDRO COC1(C[NH2+][C@@H](C)c2ccccc2O)CCC(C)CC1 ZINC000794837666 1123982355 /nfs/dbraw/zinc/98/23/55/1123982355.db2.gz YPZGUKFWZVBXGB-UUCFBXCCSA-N 1 0 277.408 3.638 20 10 CHCDRO COCC1CCC([NH2+][C@H](C)c2cc(Cl)ccc2O)CC1 ZINC000840882343 1123982669 /nfs/dbraw/zinc/98/26/69/1123982669.db2.gz TYTFDMSFRDVTOR-LKSINWNRSA-N 1 0 297.826 3.901 20 10 CHCDRO COC1([C@@H](C)[NH2+][C@@H](C)c2cc(Cl)ccc2O)CCC1 ZINC000840884908 1123996776 /nfs/dbraw/zinc/99/67/76/1123996776.db2.gz ROPBYZVIHFORGJ-WDEREUQCSA-N 1 0 283.799 3.654 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCCc2ncccc21 ZINC000866267744 1124044545 /nfs/dbraw/zinc/04/45/45/1124044545.db2.gz HMMGBOQIWFBSBP-LJQANCHMSA-N 1 0 295.430 3.623 20 10 CHCDRO Cc1ncc([C@@H](C)[NH2+][C@@H](C)c2cc(F)ccc2O)s1 ZINC000866455463 1124067905 /nfs/dbraw/zinc/06/79/05/1124067905.db2.gz LUNYBMCKXYSGAN-DTWKUNHWSA-N 1 0 280.368 3.708 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@@H](C)c2cnc(C)s2)c1O ZINC000866454401 1124068301 /nfs/dbraw/zinc/06/83/01/1124068301.db2.gz BEOMUSVQTAOHMH-ZJUUUORDSA-N 1 0 292.404 3.578 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1CCC12CCOCC2)c1ccccc1O ZINC000866528948 1124078159 /nfs/dbraw/zinc/07/81/59/1124078159.db2.gz KVBGSSJPSRJZDH-GOEBONIOSA-N 1 0 289.419 3.640 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CC(C)(C)C(C)(F)F)c1O ZINC000866546620 1124082221 /nfs/dbraw/zinc/08/22/21/1124082221.db2.gz OULUHYWLQNYACV-SNVBAGLBSA-N 1 0 287.350 3.733 20 10 CHCDRO C[C@@H]([NH2+]C1([C@@H]2CCCCO2)CCC1)c1cc(F)ccc1O ZINC000866622542 1124091025 /nfs/dbraw/zinc/09/10/25/1124091025.db2.gz GEWGYLKUBMUYKH-WBMJQRKESA-N 1 0 293.382 3.674 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)Cc1ccc(O)cc1)c1ccc(N(C)C)cc1 ZINC000122900121 1124543354 /nfs/dbraw/zinc/54/33/54/1124543354.db2.gz YFIBHIFDDLRGKY-LSDHHAIUSA-N 1 0 298.430 3.740 20 10 CHCDRO COCC(C)(C)CC[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000872105049 1124683892 /nfs/dbraw/zinc/68/38/92/1124683892.db2.gz ZPMBQGWOTRWJSW-AWEZNQCLSA-N 1 0 279.424 3.722 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1cc(C)ccc1O)[C@@H](O)c1ccccc1 ZINC000872132213 1124691594 /nfs/dbraw/zinc/69/15/94/1124691594.db2.gz FLSGKQANULUTBT-FNHZYXHNSA-N 1 0 299.414 3.863 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CC[C@H]2CSC[C@@H]2C1 ZINC000872721386 1124727848 /nfs/dbraw/zinc/72/78/48/1124727848.db2.gz FOYCPQFUFMWBLJ-GJZGRUSLSA-N 1 0 299.439 3.730 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC[C@H]2CNc3ccccc32)c(O)c1 ZINC000873236412 1124752932 /nfs/dbraw/zinc/75/29/32/1124752932.db2.gz HBSKRNXTQWRKNL-GJZGRUSLSA-N 1 0 296.414 3.951 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCc2ccccc2)c(O)c1 ZINC000020089852 1124805356 /nfs/dbraw/zinc/80/53/56/1124805356.db2.gz JOPRTGNGIGSEKH-AWEZNQCLSA-N 1 0 255.361 3.594 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccccc1 ZINC000020146034 1124808902 /nfs/dbraw/zinc/80/89/02/1124808902.db2.gz RBZNWQWZGNVTRW-GOSISDBHSA-N 1 0 268.404 3.994 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cccc(C)c1O)c1ccccc1 ZINC000124749263 1124810784 /nfs/dbraw/zinc/81/07/84/1124810784.db2.gz BJXRMVJYECTNIQ-MRXNPFEDSA-N 1 0 255.361 3.942 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCc2cccc(F)c2C1)c1ccccc1O ZINC001170956512 1131313355 /nfs/dbraw/zinc/31/33/55/1131313355.db2.gz XEZQHNPLHODIAC-JSGCOSHPSA-N 1 0 285.362 3.739 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]C[C@@H](C)C(C)(C)C)c1 ZINC000125100751 1124849927 /nfs/dbraw/zinc/84/99/27/1124849927.db2.gz ZRYILRLNAAKVPF-VXGBXAGGSA-N 1 0 265.397 3.734 20 10 CHCDRO CCCCC[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000021019743 1124891521 /nfs/dbraw/zinc/89/15/21/1124891521.db2.gz BNRGPAGSYVIQCY-UHFFFAOYSA-N 1 0 260.425 3.957 20 10 CHCDRO CC[C@@H]([NH2+]CC1(N(C)C)CCCCC1)c1ccccc1O ZINC000021040206 1124893555 /nfs/dbraw/zinc/89/35/55/1124893555.db2.gz QNMFERXWYYCNCG-MRXNPFEDSA-N 1 0 290.451 3.697 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000876684692 1124971508 /nfs/dbraw/zinc/97/15/08/1124971508.db2.gz RDIODIMEKFUUQT-LJQANCHMSA-N 1 0 297.398 3.664 20 10 CHCDRO Cc1ccc(NCc2c(C)cccc2O)c(C[NH+](C)C)c1 ZINC000876863843 1124984941 /nfs/dbraw/zinc/98/49/41/1124984941.db2.gz KUGMKOAGNVNVFH-UHFFFAOYSA-N 1 0 284.403 3.683 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2ccc([C@H]3C[C@@H]3C)o2)c(O)c1 ZINC000876946430 1124991329 /nfs/dbraw/zinc/99/13/29/1124991329.db2.gz QYMUWTZBQIPMTM-WFASDCNBSA-N 1 0 271.360 3.707 20 10 CHCDRO CCCOc1ccc(C[NH2+]Cc2c(C)cccc2O)cc1 ZINC000876942456 1124991551 /nfs/dbraw/zinc/99/15/51/1124991551.db2.gz YRWAAZQFMDYTSV-UHFFFAOYSA-N 1 0 285.387 3.779 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]CCCCOCc1ccccc1 ZINC000876991463 1124994683 /nfs/dbraw/zinc/99/46/83/1124994683.db2.gz ODMZLTYTXKKZMW-UHFFFAOYSA-N 1 0 299.414 3.787 20 10 CHCDRO CCOc1cccc([C@H](C)[NH2+]Cc2ccc(C)cc2O)c1 ZINC000876990712 1124994691 /nfs/dbraw/zinc/99/46/91/1124994691.db2.gz AOMJNNFHFRLHSG-AWEZNQCLSA-N 1 0 285.387 3.950 20 10 CHCDRO Cc1ccc(C[NH2+]CCc2csc(C(C)C)n2)c(O)c1 ZINC000876997363 1124996998 /nfs/dbraw/zinc/99/69/98/1124996998.db2.gz UWPJRPQSFZNMQX-UHFFFAOYSA-N 1 0 290.432 3.613 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H]2CCc3ccc(F)cc32)c(O)c1 ZINC000877015007 1124997941 /nfs/dbraw/zinc/99/79/41/1124997941.db2.gz DFTVLGIZFQYARG-MRXNPFEDSA-N 1 0 271.335 3.617 20 10 CHCDRO CCC(CC)[C@H]1C[C@@H]([NH2+]Cc2ccc(C)cc2O)CCO1 ZINC000877166463 1125016784 /nfs/dbraw/zinc/01/67/84/1125016784.db2.gz AMKCOMKIADTRMF-FUHWJXTLSA-N 1 0 291.435 3.774 20 10 CHCDRO CC[C@@H](CC(F)(F)F)[NH2+]Cc1ccc(C)cc1O ZINC000877353741 1125023794 /nfs/dbraw/zinc/02/37/94/1125023794.db2.gz UUAKXVJXOJXUOE-NSHDSACASA-N 1 0 261.287 3.521 20 10 CHCDRO Cc1ccc(C[N@@H+]2CC(C)(C)[C@H]2c2cccnc2)c(O)c1 ZINC000877547097 1125041892 /nfs/dbraw/zinc/04/18/92/1125041892.db2.gz WQHLXGKGXHXZOH-QGZVFWFLSA-N 1 0 282.387 3.679 20 10 CHCDRO Cc1ccc(C[NH2+]C[C@@H]2CSc3ccccc32)c(O)c1 ZINC000877556901 1125044415 /nfs/dbraw/zinc/04/44/15/1125044415.db2.gz CCMXUOHVSOYMAN-CQSZACIVSA-N 1 0 285.412 3.680 20 10 CHCDRO CCc1cccc(C[NH2+]Cc2ccc(C)cc2O)c1 ZINC000877614016 1125053687 /nfs/dbraw/zinc/05/36/87/1125053687.db2.gz FUIJZBJUAYAVMN-UHFFFAOYSA-N 1 0 255.361 3.553 20 10 CHCDRO CO[C@@H](c1ccccc1)[C@H](C)[NH2+]Cc1cc(C)ccc1O ZINC000877652326 1125057477 /nfs/dbraw/zinc/05/74/77/1125057477.db2.gz GLCMQPHYJMOYFA-KBXCAEBGSA-N 1 0 285.387 3.566 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]CC(C)(C)CC(F)(F)F ZINC000877643331 1125058412 /nfs/dbraw/zinc/05/84/12/1125058412.db2.gz HUHBTEILCMPIAL-UHFFFAOYSA-N 1 0 275.314 3.769 20 10 CHCDRO CSc1ccc(C[N@@H+]2Cc3cccc(O)c3C2)cc1 ZINC000877704027 1125066046 /nfs/dbraw/zinc/06/60/46/1125066046.db2.gz XBBYRLODUXFTGN-UHFFFAOYSA-N 1 0 271.385 3.630 20 10 CHCDRO Oc1cccc2c1C[N@H+](Cc1cccc(OC(F)F)c1)C2 ZINC000877703779 1125066684 /nfs/dbraw/zinc/06/66/84/1125066684.db2.gz UOXDLOYKNVLURH-UHFFFAOYSA-N 1 0 291.297 3.509 20 10 CHCDRO CC(C)(C)c1ccc(C[NH2+]Cc2cc(F)ccc2O)o1 ZINC000877734761 1125071106 /nfs/dbraw/zinc/07/11/06/1125071106.db2.gz FPOPFHYJOYDPAI-UHFFFAOYSA-N 1 0 277.339 3.712 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)c2ccccc2O)cc1C ZINC000877756259 1125071385 /nfs/dbraw/zinc/07/13/85/1125071385.db2.gz CKQRCNISUMZFLE-CYBMUJFWSA-N 1 0 271.360 3.560 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)C1CCSCC1)c1ccccc1O ZINC000877755668 1125071828 /nfs/dbraw/zinc/07/18/28/1125071828.db2.gz KWPAHUYBZNFWQH-NWDGAFQWSA-N 1 0 265.422 3.575 20 10 CHCDRO CCO[P@@](C)(=O)CC[C@@H](C)[NH2+][C@H](C)c1ccccc1O ZINC000877755922 1125072456 /nfs/dbraw/zinc/07/24/56/1125072456.db2.gz SVSVRXSGVQCLMY-VFGMZZLHSA-N 1 0 299.351 3.766 20 10 CHCDRO C[C@@H]([NH2+][C@H]1Cc2[nH]c3ccccc3c2C1)c1ccccc1O ZINC000877755866 1125073058 /nfs/dbraw/zinc/07/30/58/1125073058.db2.gz PMTJIVYFMIKSRV-CHWSQXEVSA-N 1 0 292.382 3.692 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc([C@@H]2C[C@@H]2C)o1)c1ccccc1O ZINC000877756604 1125073880 /nfs/dbraw/zinc/07/38/80/1125073880.db2.gz XJIHRHBKAQPLPK-YWPYICTPSA-N 1 0 271.360 3.959 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)CSC(C)(C)C)c1ccccc1O ZINC000877756628 1125075054 /nfs/dbraw/zinc/07/50/54/1125075054.db2.gz ZWHUSXBOVCQUOV-NWDGAFQWSA-N 1 0 267.438 3.963 20 10 CHCDRO C[C@H]([NH2+]Cc1cnc(C2CCC2)s1)c1ccccc1O ZINC000877757037 1125074671 /nfs/dbraw/zinc/07/46/71/1125074671.db2.gz BNBQYUOKFVBRBH-NSHDSACASA-N 1 0 288.416 3.967 20 10 CHCDRO CO[C@H](c1ccccc1)[C@@H](C)[NH2+][C@H](C)c1ccccc1O ZINC000877757633 1125074879 /nfs/dbraw/zinc/07/48/79/1125074879.db2.gz PBHIDNUGCHXHRW-LBTNJELSSA-N 1 0 285.387 3.819 20 10 CHCDRO CCc1cccc(C[NH2+][C@@H]2CC=CC[C@H]2C(F)(F)F)c1O ZINC000877760998 1125076812 /nfs/dbraw/zinc/07/68/12/1125076812.db2.gz QFGLAOQUUNUQTH-ZIAGYGMSSA-N 1 0 299.336 3.941 20 10 CHCDRO CCCN(Cc1scnc1Cl)Cc1ccccc1O ZINC000878152214 1125123845 /nfs/dbraw/zinc/12/38/45/1125123845.db2.gz WHFVTTHEVWDMQR-UHFFFAOYSA-N 1 0 296.823 3.914 20 10 CHCDRO COc1cccc(C[N@@H+]2C[C@@H](c3ccccc3)C[C@@H]2C)c1O ZINC000127579356 1125202251 /nfs/dbraw/zinc/20/22/51/1125202251.db2.gz LVSXDCKMRQSJHT-YOEHRIQHSA-N 1 0 297.398 3.779 20 10 CHCDRO COc1cncc(/C=C/CC[NH2+][C@H](C)c2ccccc2O)c1 ZINC000879648916 1125222474 /nfs/dbraw/zinc/22/24/74/1125222474.db2.gz GBZMMWAWEBULFB-HZRUHFOJSA-N 1 0 298.386 3.550 20 10 CHCDRO COc1ccc(C[NH2+]Cc2ccc(Cl)cc2)cc1C ZINC000035052575 1125232206 /nfs/dbraw/zinc/23/22/06/1125232206.db2.gz MPCPGUWKJOIJJT-UHFFFAOYSA-N 1 0 275.779 3.947 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCCCC[C@@H]2C)c1O ZINC000211390462 1125304745 /nfs/dbraw/zinc/30/47/45/1125304745.db2.gz PMNXCMBEDMHUSO-ZDUSSCGKSA-N 1 0 263.381 3.555 20 10 CHCDRO Cc1cccc(C)c1C[NH2+]Cc1ccc(N(C)C)cc1 ZINC000130395597 1125360290 /nfs/dbraw/zinc/36/02/90/1125360290.db2.gz YCNCHHDAGHQUQL-UHFFFAOYSA-N 1 0 268.404 3.659 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H]2C[C@@H]3CCCC[C@H]23)c1O ZINC000883321884 1125396468 /nfs/dbraw/zinc/39/64/68/1125396468.db2.gz OSSGKZVYXBSDEZ-NZBPQXDJSA-N 1 0 275.392 3.630 20 10 CHCDRO CC[C@@H]([NH2+]CCCSc1nccs1)C(C)C ZINC000132253705 1125417032 /nfs/dbraw/zinc/41/70/32/1125417032.db2.gz QNRXHSFXLXRBRF-LLVKDONJSA-N 1 0 258.456 3.650 20 10 CHCDRO CCOc1cccc(C[NH2+]C2CC(c3ccccc3)C2)c1O ZINC000105492466 1125436373 /nfs/dbraw/zinc/43/63/73/1125436373.db2.gz LFIZERWENODHSR-UHFFFAOYSA-N 1 0 297.398 3.827 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCCC23CCOCC3)c(O)c1 ZINC000282855465 1125445809 /nfs/dbraw/zinc/44/58/09/1125445809.db2.gz UJDROZVKIQLNKS-PBHICJAKSA-N 1 0 289.419 3.701 20 10 CHCDRO COCC[C@H]([NH2+]Cc1cc(Cl)ccc1O)c1ccco1 ZINC000779995371 1129181849 /nfs/dbraw/zinc/18/18/49/1129181849.db2.gz MXMLVZDBHJFCEB-ZDUSSCGKSA-N 1 0 295.766 3.506 20 10 CHCDRO Cc1cncc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCCN3C)c1 ZINC000184329430 1129183299 /nfs/dbraw/zinc/18/32/99/1129183299.db2.gz UWHBUFYDRNGVTL-OAHLLOKOSA-N 1 0 295.430 3.623 20 10 CHCDRO CSC(C)(C)C[C@H](C)[NH2+][C@H](C)c1ccccc1O ZINC001258324812 1129200381 /nfs/dbraw/zinc/20/03/81/1129200381.db2.gz XIUOZJMZJLSEBO-NWDGAFQWSA-N 1 0 267.438 3.963 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccccc1C)c1ccccc1O ZINC000037718899 1129210125 /nfs/dbraw/zinc/21/01/25/1129210125.db2.gz IGXCPNMRRFARHV-MRXNPFEDSA-N 1 0 255.361 3.942 20 10 CHCDRO CSCC1CCC([NH2+][C@H]2CCc3cccc(O)c32)CC1 ZINC000296475486 1129222910 /nfs/dbraw/zinc/22/29/10/1129222910.db2.gz NYTDEGUHLLMVNK-ZALBZXLWSA-N 1 0 291.460 3.891 20 10 CHCDRO C[C@@H](CC(C)(C)O)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000296633515 1129223232 /nfs/dbraw/zinc/22/32/32/1129223232.db2.gz XNOSIUGAVQRCAD-STQMWFEESA-N 1 0 287.403 3.746 20 10 CHCDRO CC(C)C[C@@H]1COCC[N@@H+]1Cc1c(O)ccc2ccccc21 ZINC000733790086 1129270408 /nfs/dbraw/zinc/27/04/08/1129270408.db2.gz FLRLAJUAPONNCW-MRXNPFEDSA-N 1 0 299.414 3.792 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCCC12CCOCC2)c1cc(F)ccc1O ZINC000282671425 1129278402 /nfs/dbraw/zinc/27/84/02/1129278402.db2.gz JESPQTRCTFVDNI-BLLLJJGKSA-N 1 0 293.382 3.531 20 10 CHCDRO Cc1noc(C)c1[C@@H](C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000378918765 1129285184 /nfs/dbraw/zinc/28/51/84/1129285184.db2.gz BTUSCEZRJIEOPF-CYBMUJFWSA-N 1 0 299.418 3.742 20 10 CHCDRO Cc1csc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)c1 ZINC000379256207 1129286338 /nfs/dbraw/zinc/28/63/38/1129286338.db2.gz FJDPCKXGSCAXJT-ZDUSSCGKSA-N 1 0 274.433 3.973 20 10 CHCDRO CCC1CCC(C[NH2+]Cc2cccc(OC)c2O)CC1 ZINC000037905151 1129290250 /nfs/dbraw/zinc/29/02/50/1129290250.db2.gz RZUZICHZVNFLBW-UHFFFAOYSA-N 1 0 277.408 3.707 20 10 CHCDRO COc1ccc(C[NH2+][C@H]2CCc3cccc(F)c3C2)cc1C ZINC001170976714 1131364576 /nfs/dbraw/zinc/36/45/76/1131364576.db2.gz WVLYQRVZOSTCMI-INIZCTEOSA-N 1 0 299.389 3.790 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ncc(Cl)s2)c1 ZINC000719392873 1129332190 /nfs/dbraw/zinc/33/21/90/1129332190.db2.gz DBXVYIVPPFBXOC-SECBINFHSA-N 1 0 282.796 3.661 20 10 CHCDRO C[C@@H]1[C@H](C)SCC[N@@H+]1Cc1c(O)ccc2ccccc21 ZINC000735668129 1129356164 /nfs/dbraw/zinc/35/61/64/1129356164.db2.gz POLZXCWPNSQWGK-OLZOCXBDSA-N 1 0 287.428 3.871 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+](Cc2cccc(O)c2)CC2CC2)c1 ZINC000092670825 1129403184 /nfs/dbraw/zinc/40/31/84/1129403184.db2.gz WYJURJCDGMLYGC-UHFFFAOYSA-N 1 0 297.398 3.818 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H]2CC=CCC2)cc1F ZINC000740006272 1129408638 /nfs/dbraw/zinc/40/86/38/1129408638.db2.gz JJQOEAQIAOKLGS-HNNXBMFYSA-N 1 0 276.399 3.870 20 10 CHCDRO CS[C@@H]1CCC[C@@H]([NH2+][C@H](C)c2cc(F)ccc2O)C1 ZINC000248522199 1129420610 /nfs/dbraw/zinc/42/06/10/1129420610.db2.gz RWLOIORZDBHVMN-RAIGVLPGSA-N 1 0 283.412 3.856 20 10 CHCDRO Oc1ccccc1C[N@H+](Cc1cncs1)C1CCCC1 ZINC000093319226 1129420873 /nfs/dbraw/zinc/42/08/73/1129420873.db2.gz XTQNLRDCFOQJED-UHFFFAOYSA-N 1 0 288.416 3.794 20 10 CHCDRO CC[N@@H+](Cc1cc(C)ccc1O)C[C@H](O)c1ccc(C)cc1 ZINC000093641122 1129426842 /nfs/dbraw/zinc/42/68/42/1129426842.db2.gz FUCNNJFOEYBJNQ-IBGZPJMESA-N 1 0 299.414 3.565 20 10 CHCDRO CCOc1ccc(N(CC)CC2CC(OCC)C2)cc1 ZINC000795946916 1129459513 /nfs/dbraw/zinc/45/95/13/1129459513.db2.gz ZGZQSJVEKWORNP-UHFFFAOYSA-N 1 0 277.408 3.727 20 10 CHCDRO CCCCC[C@H](CCC)[NH2+]CCc1cc(O)c(O)cc1O ZINC001258662240 1129468885 /nfs/dbraw/zinc/46/88/85/1129468885.db2.gz NVLVXEYEAZLAPB-AWEZNQCLSA-N 1 0 295.423 3.685 20 10 CHCDRO CCC1(O)CC[NH+](Cc2cc(C(C)C)c(C)cc2O)CC1 ZINC000742176069 1129469495 /nfs/dbraw/zinc/46/94/95/1129469495.db2.gz ROHLOYCPIGQOGB-UHFFFAOYSA-N 1 0 291.435 3.561 20 10 CHCDRO Cc1cc(O)c(C[NH2+]Cc2ccc3ccccc3n2)cc1C ZINC000742369156 1129472447 /nfs/dbraw/zinc/47/24/47/1129472447.db2.gz NEAKGEBLQLIUFI-UHFFFAOYSA-N 1 0 292.382 3.847 20 10 CHCDRO Cc1ccc(CC[C@@H](C)[NH2+]Cc2cc(C)ccc2O)o1 ZINC000742380955 1129473261 /nfs/dbraw/zinc/47/32/61/1129473261.db2.gz UCFSDUYNAMALIB-CYBMUJFWSA-N 1 0 273.376 3.713 20 10 CHCDRO CCOc1ccc(C[NH2+]Cc2c(C)cccc2F)c(O)c1 ZINC000742381123 1129476693 /nfs/dbraw/zinc/47/66/93/1129476693.db2.gz PGKSESSXSXIQNW-UHFFFAOYSA-N 1 0 289.350 3.528 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ncc(C)cc1C)c1ccccc1O ZINC000828156128 1131378858 /nfs/dbraw/zinc/37/88/58/1131378858.db2.gz WPVASPCUXGWXAQ-MRXNPFEDSA-N 1 0 284.403 3.687 20 10 CHCDRO C[C@H]1C[NH+](Cc2c(O)ccc3ccccc32)C[C@H](C)S1 ZINC000743376956 1129522788 /nfs/dbraw/zinc/52/27/88/1129522788.db2.gz WKDGFBZJVFWRFP-STQMWFEESA-N 1 0 287.428 3.871 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C[C@H](OC)C(C)(C)C)cc1 ZINC000744448471 1129577954 /nfs/dbraw/zinc/57/79/54/1129577954.db2.gz JTOJTLJJPVCVNC-KRWDZBQOSA-N 1 0 292.467 3.684 20 10 CHCDRO CC(C)C[C@H]1CC[N@H+](Cc2cc3c(cc2O)CCC3)C1 ZINC000744437583 1129578313 /nfs/dbraw/zinc/57/83/13/1129578313.db2.gz WRGGANFVWCUDFI-CQSZACIVSA-N 1 0 273.420 3.749 20 10 CHCDRO FC(F)CC1C[NH+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000822521250 1131384645 /nfs/dbraw/zinc/38/46/45/1131384645.db2.gz ZAUXDSNOFXHBFR-UHFFFAOYSA-N 1 0 294.389 3.764 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)Cc1cccc2ncccc12 ZINC001137630957 1131388065 /nfs/dbraw/zinc/38/80/65/1131388065.db2.gz XRXQSMRQYSHHPC-UHFFFAOYSA-N 1 0 292.382 3.963 20 10 CHCDRO Cc1ccc(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)nc1 ZINC000746448582 1129665256 /nfs/dbraw/zinc/66/52/56/1129665256.db2.gz AKULYPCVTKTQIC-UHFFFAOYSA-N 1 0 295.430 3.621 20 10 CHCDRO C[C@H](C[NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1ccncc1 ZINC000766490980 1129669442 /nfs/dbraw/zinc/66/94/42/1129669442.db2.gz XMFNFMVDBYKEKB-CABCVRRESA-N 1 0 283.419 3.602 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H](C)Cc2ccncc2)cc1 ZINC000766488507 1129669721 /nfs/dbraw/zinc/66/97/21/1129669721.db2.gz JPRPKPHATBGPDQ-HZPDHXFCSA-N 1 0 297.446 3.820 20 10 CHCDRO CNc1ccccc1N[C@H]1CC(C)(C)C[C@@](C)(C[NH3+])C1 ZINC001169152409 1129705570 /nfs/dbraw/zinc/70/55/70/1129705570.db2.gz PNTJLNLSYZUNAO-GUYCJALGSA-N 1 0 275.440 3.684 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccc(F)cn2)cc1 ZINC000766609347 1129706374 /nfs/dbraw/zinc/70/63/74/1129706374.db2.gz XMZIGXDUEFUWIK-CYBMUJFWSA-N 1 0 287.382 3.528 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CC2(C)CC(F)(F)C2)c1 ZINC000720899853 1129718481 /nfs/dbraw/zinc/71/84/81/1129718481.db2.gz JUSCDZFIDSHABI-NSHDSACASA-N 1 0 269.335 3.787 20 10 CHCDRO COc1ccc(C[NH2+]CC2(C)CC(F)(F)C2)cc1C ZINC000720901613 1129718877 /nfs/dbraw/zinc/71/88/77/1129718877.db2.gz RUFDBCJGRVCOLN-UHFFFAOYSA-N 1 0 269.335 3.529 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H]2CSC[C@H]2C)cc1F ZINC000796482221 1129742138 /nfs/dbraw/zinc/74/21/38/1129742138.db2.gz LQBFSGYGLNCLCI-DOMZBBRYSA-N 1 0 296.455 3.513 20 10 CHCDRO CC/C=C/CC[N@@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000767325849 1129786123 /nfs/dbraw/zinc/78/61/23/1129786123.db2.gz XYCLZMNLCPGVFO-IDOMTICXSA-N 1 0 289.419 3.730 20 10 CHCDRO CC(C)[C@H](CCO)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000742381253 1129817742 /nfs/dbraw/zinc/81/77/42/1129817742.db2.gz UKVDHQLSVJWOTH-SFHVURJKSA-N 1 0 299.414 3.556 20 10 CHCDRO Cc1cscc1C[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000381000617 1129833858 /nfs/dbraw/zinc/83/38/58/1129833858.db2.gz IAGMHNBEYFPVLP-CYBMUJFWSA-N 1 0 259.374 3.539 20 10 CHCDRO CCOc1ccc(C[N@H+]([C@H](C)C(C)C)C2CC2)c(O)c1 ZINC000768137177 1129834589 /nfs/dbraw/zinc/83/45/89/1129834589.db2.gz HHIQKHSAHHICKV-CYBMUJFWSA-N 1 0 277.408 3.800 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cc(C)ccc1O ZINC000768131939 1129835241 /nfs/dbraw/zinc/83/52/41/1129835241.db2.gz CBAQFVQVIYMPHO-UHFFFAOYSA-N 1 0 298.430 3.789 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+]([C@@H](C)C(C)C)C2CC2)c1 ZINC000768138189 1129835268 /nfs/dbraw/zinc/83/52/68/1129835268.db2.gz PPGHPKKYAXBKDX-ZDUSSCGKSA-N 1 0 277.408 3.800 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2csc(C)c2)c1 ZINC000381298939 1129836262 /nfs/dbraw/zinc/83/62/62/1129836262.db2.gz QHVCCZZRLQAFNQ-LLVKDONJSA-N 1 0 277.389 3.622 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCC(F)(F)C2)c(O)c1 ZINC000381322876 1129837746 /nfs/dbraw/zinc/83/77/46/1129837746.db2.gz GLHXQOAXZUCJOW-WDEREUQCSA-N 1 0 255.308 3.539 20 10 CHCDRO C[N@H+](Cc1ccc(F)cc1)Cc1cc(Cl)ccc1O ZINC000768175468 1129838813 /nfs/dbraw/zinc/83/88/13/1129838813.db2.gz PTYKSALOEWBFRL-UHFFFAOYSA-N 1 0 279.742 3.817 20 10 CHCDRO CCOc1cccc(C[N@H+]2Cc3ccccc3[C@H](C)C2)c1O ZINC000768194593 1129841819 /nfs/dbraw/zinc/84/18/19/1129841819.db2.gz BZVRSNRUVXPWFO-CQSZACIVSA-N 1 0 297.398 3.910 20 10 CHCDRO COc1cccc(C[N@H+](C)[C@H]2CCCc3ccccc32)c1O ZINC000768193329 1129842586 /nfs/dbraw/zinc/84/25/86/1129842586.db2.gz KOUYEPAHYVFSQL-KRWDZBQOSA-N 1 0 297.398 3.910 20 10 CHCDRO COc1cccc(O)c1C[N@H+]1Cc2ccccc2[C@@H](C)C1 ZINC000768197849 1129843363 /nfs/dbraw/zinc/84/33/63/1129843363.db2.gz XYNFUCKHVDLRPG-ZDUSSCGKSA-N 1 0 283.371 3.520 20 10 CHCDRO CCOc1cccc(C[N@H+](C(CC)CC)C2CC2)c1O ZINC000768256917 1129846746 /nfs/dbraw/zinc/84/67/46/1129846746.db2.gz GEJGETHKGGCNAM-UHFFFAOYSA-N 1 0 277.408 3.944 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CCc2cccc(C)n2)c(O)c1 ZINC000285178820 1129848197 /nfs/dbraw/zinc/84/81/97/1129848197.db2.gz NENTYUXPJFZRGO-HNNXBMFYSA-N 1 0 284.403 3.606 20 10 CHCDRO CC(C)[N@H+](Cc1cccn1C)Cc1ccc(N(C)C)cc1 ZINC000768357596 1129853542 /nfs/dbraw/zinc/85/35/42/1129853542.db2.gz OSZHYKHRTHGERN-UHFFFAOYSA-N 1 0 285.435 3.502 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CCC[C@H]2c2ccccn2)c(O)c1 ZINC000768353929 1129853724 /nfs/dbraw/zinc/85/37/24/1129853724.db2.gz CKGDMHJSKWMCHR-KRWDZBQOSA-N 1 0 298.386 3.523 20 10 CHCDRO C[C@@H](Cc1ccsc1)[NH2+][C@H]1CCc2cccc(O)c21 ZINC000382062164 1129854954 /nfs/dbraw/zinc/85/49/54/1129854954.db2.gz YGSKIYYXGBJKMU-FZMZJTMJSA-N 1 0 273.401 3.662 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@@H+]2CCc3cc(F)ccc3C2)c1 ZINC000768482409 1129857597 /nfs/dbraw/zinc/85/75/97/1129857597.db2.gz XKVNSSGEMMGZKR-UHFFFAOYSA-N 1 0 285.362 3.706 20 10 CHCDRO CC(C)N(Cc1cc2c(cc1O)CCCC2)CC(F)F ZINC000768461485 1129858552 /nfs/dbraw/zinc/85/85/52/1129858552.db2.gz DEOKTGOJCBCZFR-UHFFFAOYSA-N 1 0 283.362 3.747 20 10 CHCDRO Cc1cc([C@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)oc1C ZINC000800475222 1129876107 /nfs/dbraw/zinc/87/61/07/1129876107.db2.gz VLMKZKVFMYSZLY-LBPRGKRZSA-N 1 0 290.382 3.952 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2cc(C)cc(Cl)n2)c1 ZINC000800492162 1129879018 /nfs/dbraw/zinc/87/90/18/1129879018.db2.gz CRPQDLNJNWJFLW-GFCCVEGCSA-N 1 0 290.794 3.908 20 10 CHCDRO CC[C@H]([NH2+]CC1(COC)CCC1)c1ccc(C)cc1O ZINC000800493193 1129879331 /nfs/dbraw/zinc/87/93/31/1129879331.db2.gz JGKZCECBYUXASS-HNNXBMFYSA-N 1 0 277.408 3.558 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CC2(COC)CCC2)cc1 ZINC000800494203 1129880753 /nfs/dbraw/zinc/88/07/53/1129880753.db2.gz UTXXLWUMEBYKSU-HNNXBMFYSA-N 1 0 290.451 3.610 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]CC2CCC(F)(F)CC2)c1 ZINC000800500784 1129881435 /nfs/dbraw/zinc/88/14/35/1129881435.db2.gz YNNXYQJMPJRVOA-LLVKDONJSA-N 1 0 299.361 3.877 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCc3cc(F)cc(C)c3C2)c1O ZINC000800537001 1129882539 /nfs/dbraw/zinc/88/25/39/1129882539.db2.gz XGYZFRGYRKGUDD-UHFFFAOYSA-N 1 0 285.362 3.706 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC[C@H]3CCC[C@H]32)cc1C ZINC000769101747 1129890463 /nfs/dbraw/zinc/89/04/63/1129890463.db2.gz GCCQFHJCYLNDME-GDBMZVCRSA-N 1 0 259.393 3.774 20 10 CHCDRO CC(C)(C[NH2+]Cc1cc(Cl)ccc1O)C(F)(F)F ZINC000800889410 1129896267 /nfs/dbraw/zinc/89/62/67/1129896267.db2.gz ULHQWHVSUCGHHC-UHFFFAOYSA-N 1 0 281.705 3.724 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCc3ccccc3OC2)c(O)c1 ZINC000800986218 1129902898 /nfs/dbraw/zinc/90/28/98/1129902898.db2.gz CBIDWXXGRVLDHA-GOEBONIOSA-N 1 0 297.398 3.745 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCc3ccccc3OC2)c(O)c1 ZINC000800986220 1129902987 /nfs/dbraw/zinc/90/29/87/1129902987.db2.gz CBIDWXXGRVLDHA-HOCLYGCPSA-N 1 0 297.398 3.745 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CCCc3ccccc3C2)c1 ZINC000769331321 1129903164 /nfs/dbraw/zinc/90/31/64/1129903164.db2.gz FOZYTVYQRUCWPR-UHFFFAOYSA-N 1 0 297.398 3.739 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCc3c(C)cccc3C2)c1O ZINC000769339594 1129903813 /nfs/dbraw/zinc/90/38/13/1129903813.db2.gz SUAGDCYMCIEQJP-UHFFFAOYSA-N 1 0 297.398 3.658 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CC[C@@H](c3ccccc3F)C2)cc1 ZINC000769380284 1129905154 /nfs/dbraw/zinc/90/51/54/1129905154.db2.gz RCIVFMHUXINGTP-MRXNPFEDSA-N 1 0 298.405 3.881 20 10 CHCDRO CCC[C@@H](CC)[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC001461168431 1129906384 /nfs/dbraw/zinc/90/63/84/1129906384.db2.gz BOSDGJRXXJOAEL-MNDMWVCDSA-N 1 0 260.425 3.934 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCC[C@](C)(CC)C2)c1O ZINC000769445631 1129910205 /nfs/dbraw/zinc/91/02/05/1129910205.db2.gz GXRRZRHBRDQOSV-KRWDZBQOSA-N 1 0 277.408 3.803 20 10 CHCDRO C[C@H]1C[N@H+](Cc2ccc(N3CCCCC3)cc2)C[C@H]1C ZINC000769448502 1129910986 /nfs/dbraw/zinc/91/09/86/1129910986.db2.gz SRPOZHBIVYTDHG-IYBDPMFKSA-N 1 0 272.436 3.765 20 10 CHCDRO CC[C@@H]1CCCCC[N@@H+]1Cc1c(O)cccc1OC ZINC000769456428 1129911607 /nfs/dbraw/zinc/91/16/07/1129911607.db2.gz JUYMAMRIFNPXCQ-CYBMUJFWSA-N 1 0 263.381 3.555 20 10 CHCDRO COc1cccc(O)c1C[N@@H+]1CC[C@H](c2ccccc2)[C@@H]1C ZINC000769498649 1129913656 /nfs/dbraw/zinc/91/36/56/1129913656.db2.gz NTUSHKQWBQQRHK-HOCLYGCPSA-N 1 0 297.398 3.779 20 10 CHCDRO COc1cccc(O)c1C[N@H+](C)Cc1cc2ccccc2o1 ZINC000769499957 1129913926 /nfs/dbraw/zinc/91/39/26/1129913926.db2.gz XZXPFPXMDTXVTB-UHFFFAOYSA-N 1 0 297.354 3.779 20 10 CHCDRO CCC[C@@H](C)[C@H]1CCC[N@@H+]1Cc1c(O)cccc1OC ZINC000769536647 1129916405 /nfs/dbraw/zinc/91/64/05/1129916405.db2.gz CEAKINSKSOFHON-UKRRQHHQSA-N 1 0 277.408 3.801 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCC2(CCCC2)O1)c1ccccc1O ZINC000801527376 1129924518 /nfs/dbraw/zinc/92/45/18/1129924518.db2.gz AFYHNNHDZZRAMS-HOCLYGCPSA-N 1 0 289.419 3.925 20 10 CHCDRO CC[C@H]1CC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000770303442 1129944234 /nfs/dbraw/zinc/94/42/34/1129944234.db2.gz HBMDPVZPQXUKNV-INIZCTEOSA-N 1 0 272.436 3.909 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCc2c(Cl)cccc2C1 ZINC000770511041 1129948649 /nfs/dbraw/zinc/94/86/49/1129948649.db2.gz XEMZYZBWMCMPDJ-UHFFFAOYSA-N 1 0 273.763 3.604 20 10 CHCDRO CCc1cccc(C[NH2+]C[C@@H](C)CC(F)(F)F)c1O ZINC000691483995 1129950435 /nfs/dbraw/zinc/95/04/35/1129950435.db2.gz RVYDIKQWELPPFD-JTQLQIEISA-N 1 0 275.314 3.633 20 10 CHCDRO COc1cc(C[N@@H+]2CC[C@H](C)C3(CCC3)C2)c(O)cc1C ZINC000770671699 1129954927 /nfs/dbraw/zinc/95/49/27/1129954927.db2.gz UNUALMIXFUJHSF-AWEZNQCLSA-N 1 0 289.419 3.721 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)Cc2ccc(Cl)o2)cc1 ZINC000771935475 1129996802 /nfs/dbraw/zinc/99/68/02/1129996802.db2.gz VHQMPOISNGHCQH-UHFFFAOYSA-N 1 0 278.783 3.631 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC[C@@H]2c2ccccc2)c1 ZINC000771939252 1129997243 /nfs/dbraw/zinc/99/72/43/1129997243.db2.gz ORMGQRYMUUBTBY-MRXNPFEDSA-N 1 0 253.345 3.648 20 10 CHCDRO C[C@H](Nc1cc[nH+]c2ccccc12)c1ccc(N(C)C)cc1 ZINC000772294644 1130016082 /nfs/dbraw/zinc/01/60/82/1130016082.db2.gz COXXGWOUHOLLLS-AWEZNQCLSA-N 1 0 291.398 3.896 20 10 CHCDRO Cc1ccncc1[C@H](C)[NH2+]Cc1ccc(N(C)C)cc1C ZINC000772454510 1130022208 /nfs/dbraw/zinc/02/22/08/1130022208.db2.gz IECSZGNXQLBBMD-HNNXBMFYSA-N 1 0 283.419 3.615 20 10 CHCDRO CCS[C@H]1CC[C@@H]([N@H+](C)Cc2ccc(C)cc2O)C1 ZINC001461933505 1130115882 /nfs/dbraw/zinc/11/58/82/1130115882.db2.gz FLXJLURMWDQBRB-CABCVRRESA-N 1 0 279.449 3.807 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)c1ccccc1O)c1ccc2c(c1)CCO2 ZINC000903238761 1130133522 /nfs/dbraw/zinc/13/35/22/1130133522.db2.gz WIVAXSWWDPXOAY-CHWSQXEVSA-N 1 0 283.371 3.739 20 10 CHCDRO C[C@@H]([NH2+]CC(C)(C)C1CCOCC1)c1cc(F)ccc1O ZINC000903243973 1130134677 /nfs/dbraw/zinc/13/46/77/1130134677.db2.gz LORMXXLJVSUWCV-GFCCVEGCSA-N 1 0 295.398 3.635 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCOC12CCCCC2)c1ccccc1O ZINC000903274197 1130142952 /nfs/dbraw/zinc/14/29/52/1130142952.db2.gz JPDFFQUFANDSPR-CZUORRHYSA-N 1 0 275.392 3.535 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C2CC3(C2)CO[C@H](C)C3)c(O)c1C ZINC000903283111 1130146118 /nfs/dbraw/zinc/14/61/18/1130146118.db2.gz OJXSFPZPDMGBLQ-SDHDVMSLSA-N 1 0 289.419 3.617 20 10 CHCDRO CC[C@@H]([NH2+]Cc1c(C)cc(CO)cc1C)c1ccccc1O ZINC000903306904 1130149483 /nfs/dbraw/zinc/14/94/83/1130149483.db2.gz CXSBIDJVDATYRO-GOSISDBHSA-N 1 0 299.414 3.742 20 10 CHCDRO C[C@H]([NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F)c1cncs1 ZINC000903310525 1130150724 /nfs/dbraw/zinc/15/07/24/1130150724.db2.gz KKQCHXIUBLRRBS-YWVKMMECSA-N 1 0 292.379 3.887 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H](c2ncccn2)C2CC2)c(O)c1C ZINC000903327363 1130156398 /nfs/dbraw/zinc/15/63/98/1130156398.db2.gz SDNMTWQPWPRFOV-BBRMVZONSA-N 1 0 297.402 3.601 20 10 CHCDRO C[C@H]([NH2+][C@@H](c1ccncc1)C1CC1)c1ccc(N(C)C)cc1 ZINC000903428997 1130175727 /nfs/dbraw/zinc/17/57/27/1130175727.db2.gz RLJKIOVSNVAQHK-IFXJQAMLSA-N 1 0 295.430 3.950 20 10 CHCDRO C[C@H]([NH2+][C@H]1COC[C@H]1C1CC1)c1ccc2ccccc2c1O ZINC000903438834 1130176992 /nfs/dbraw/zinc/17/69/92/1130176992.db2.gz XPEDSEDGSCOSGK-IGNZVWTISA-N 1 0 297.398 3.621 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](c2ccncc2)C2CC2)c(O)c1 ZINC000903430341 1130177006 /nfs/dbraw/zinc/17/70/06/1130177006.db2.gz YVRZPRCEBZMVLC-SCLBCKFNSA-N 1 0 282.387 3.898 20 10 CHCDRO CCC(O)(CC)CC[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000788264501 1130180181 /nfs/dbraw/zinc/18/01/81/1130180181.db2.gz XYVMVAGNGABYNH-DGCLKSJQSA-N 1 0 295.398 3.610 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CCN(C)C2CCCC2)c(O)c1 ZINC000788592530 1130196594 /nfs/dbraw/zinc/19/65/94/1130196594.db2.gz CXTLSCGCVXZBRP-OAHLLOKOSA-N 1 0 290.451 3.534 20 10 CHCDRO CC(C)[C@@H]([NH2+][C@@H](C)c1ccccc1O)[C@@H](O)c1ccccc1 ZINC000788624887 1130198625 /nfs/dbraw/zinc/19/86/25/1130198625.db2.gz HCUKQVYEZQNOBK-KYNGSXCRSA-N 1 0 299.414 3.801 20 10 CHCDRO C[C@@H]([NH2+]CCC1CC1)c1cccc(C(F)(F)F)c1[O-] ZINC000788667282 1130200825 /nfs/dbraw/zinc/20/08/25/1130200825.db2.gz UKWXKGPJEMUGOS-SECBINFHSA-N 1 0 273.298 3.862 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCC12CCCC2 ZINC000788983063 1130221238 /nfs/dbraw/zinc/22/12/38/1130221238.db2.gz AKGKLSMMIHNYPV-KRWDZBQOSA-N 1 0 272.436 3.873 20 10 CHCDRO CCOC[C@H]([NH2+][C@H](CC)c1ccc(N(C)C)cc1)C(C)C ZINC000788983652 1130221813 /nfs/dbraw/zinc/22/18/13/1130221813.db2.gz FCJYOMHWVNIJEU-MSOLQXFVSA-N 1 0 292.467 3.854 20 10 CHCDRO CCOC[C@H]([NH2+][C@@H](C)c1ccc(N(C)CC)cc1)C(C)C ZINC000788985206 1130221838 /nfs/dbraw/zinc/22/18/38/1130221838.db2.gz OPTPGDXTKHAKFW-YJBOKZPZSA-N 1 0 292.467 3.854 20 10 CHCDRO C[C@H]1CC[C@@H](C[N@H+](Cc2ccccc2O)C2CCCC2)O1 ZINC000789327840 1130243747 /nfs/dbraw/zinc/24/37/47/1130243747.db2.gz XAQJEBUMEVYVEH-YOEHRIQHSA-N 1 0 289.419 3.704 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@@H+]2CCS[C@H](C(C)C)C2)c1 ZINC000754736747 1130326421 /nfs/dbraw/zinc/32/64/21/1130326421.db2.gz KUXUVJDHMSPYNA-HNNXBMFYSA-N 1 0 279.449 3.582 20 10 CHCDRO Cc1ccc2c(c1)CC[N@@H+](Cc1cccc(C)c1O)C2 ZINC000792178440 1130435683 /nfs/dbraw/zinc/43/56/83/1130435683.db2.gz CFBXQHXGLUBHCK-UHFFFAOYSA-N 1 0 267.372 3.567 20 10 CHCDRO CCn1ccc(C[N@H+](C)Cc2cc(Cl)cc(C)c2O)c1 ZINC000792182283 1130437887 /nfs/dbraw/zinc/43/78/87/1130437887.db2.gz AHUKEDDYYRJXTQ-UHFFFAOYSA-N 1 0 292.810 3.807 20 10 CHCDRO Cc1cc(N2CCCCC2)ccc1C=C1CC[NH2+]CC1 ZINC001240879661 1130500347 /nfs/dbraw/zinc/50/03/47/1130500347.db2.gz WFRFTDMLMWHHEL-UHFFFAOYSA-N 1 0 270.420 3.752 20 10 CHCDRO CC1CC([NH2+]Cc2ccc(N(C)C)cc2C(F)(F)F)C1 ZINC000793008948 1130513684 /nfs/dbraw/zinc/51/36/84/1130513684.db2.gz NVHCNLPVGJTGQI-UHFFFAOYSA-N 1 0 286.341 3.660 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2c(O)ccc3ccccc32)C[C@@H](C2CC2)O1 ZINC000793214624 1130530369 /nfs/dbraw/zinc/53/03/69/1130530369.db2.gz PPHDCZPPVDQRFJ-YJYMSZOUSA-N 1 0 297.398 3.545 20 10 CHCDRO C[C@H]1C[C@H](C)[NH+]1Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000793220163 1130530782 /nfs/dbraw/zinc/53/07/82/1130530782.db2.gz KQWJGVZTTRYELJ-QWRGUYRKSA-N 1 0 286.341 3.754 20 10 CHCDRO C[C@@H]1C[C@@H](C)[NH+]1Cc1ccc(N2CCCCC2)cc1 ZINC000793227621 1130531854 /nfs/dbraw/zinc/53/18/54/1130531854.db2.gz FJGXTJVFMSEGNY-HUUCEWRRSA-N 1 0 258.409 3.660 20 10 CHCDRO CCOc1cccc(C[N@H+](C)[C@@H]2CCC(C)(C)C2)c1O ZINC000793353338 1130543095 /nfs/dbraw/zinc/54/30/95/1130543095.db2.gz RZQBYZPAKSTWME-CQSZACIVSA-N 1 0 277.408 3.801 20 10 CHCDRO CCOCc1cc(C[NH2+]C[C@H]2CC[C@@H](C)C2)ccc1OC ZINC000793346144 1130548335 /nfs/dbraw/zinc/54/83/35/1130548335.db2.gz DBGLREMFBFABSP-CABCVRRESA-N 1 0 291.435 3.758 20 10 CHCDRO Oc1ccccc1C[NH2+][C@H]1CC[C@@H](c2cccc(F)c2)C1 ZINC000793351993 1130549473 /nfs/dbraw/zinc/54/94/73/1130549473.db2.gz LMHUPOMPUJOJNL-PBHICJAKSA-N 1 0 285.362 3.957 20 10 CHCDRO COc1ccc(C[NH2+]C/C(C)=C/c2ccccc2)c(O)c1 ZINC000793387331 1130552415 /nfs/dbraw/zinc/55/24/15/1130552415.db2.gz DFOLRMXQKNJGMK-GXDHUFHOSA-N 1 0 283.371 3.594 20 10 CHCDRO CC1(C)[C@H]([NH2+]Cc2ccccc2O)C[C@H]1Oc1ccccc1 ZINC000793530154 1130572134 /nfs/dbraw/zinc/57/21/34/1130572134.db2.gz ZEXUNRJJHULZPE-QZTJIDSGSA-N 1 0 297.398 3.728 20 10 CHCDRO COC1CCC(CC[NH2+]Cc2c(O)cccc2Cl)CC1 ZINC000757984724 1130592058 /nfs/dbraw/zinc/59/20/58/1130592058.db2.gz HUNVQJRCWNBZTK-UHFFFAOYSA-N 1 0 297.826 3.731 20 10 CHCDRO CSC1(C[NH2+]CCCSc2nccs2)CCC1 ZINC000811482208 1130611963 /nfs/dbraw/zinc/61/19/63/1130611963.db2.gz UEUTZLYNFZBCGU-UHFFFAOYSA-N 1 0 288.507 3.501 20 10 CHCDRO COc1ccc(C[NH2+]CC(C)(C)[C@@H]2CCCCO2)cc1C ZINC000758499625 1130614938 /nfs/dbraw/zinc/61/49/38/1130614938.db2.gz RWYHMZTVONFAGF-KRWDZBQOSA-N 1 0 291.435 3.689 20 10 CHCDRO CC(C)(C[NH2+]Cc1cc(Cl)ccc1O)[C@@H]1CCCCO1 ZINC000758500418 1130614988 /nfs/dbraw/zinc/61/49/88/1130614988.db2.gz ZPDVWDSVXIHBJN-HNNXBMFYSA-N 1 0 297.826 3.731 20 10 CHCDRO CC(C)(C[NH2+]Cc1c(O)cccc1Cl)[C@@H]1CCCCO1 ZINC000758498764 1130615330 /nfs/dbraw/zinc/61/53/30/1130615330.db2.gz NDCSKHNKRJXGPL-HNNXBMFYSA-N 1 0 297.826 3.731 20 10 CHCDRO C[C@H]1C[N@H+](Cc2cc(Cl)ccc2O)CCC1(F)F ZINC000811512741 1130619006 /nfs/dbraw/zinc/61/90/06/1130619006.db2.gz RGHCNDRYIZZZCP-VIFPVBQESA-N 1 0 275.726 3.523 20 10 CHCDRO CC[C@@H](Oc1ccc(N2CC[NH+](CC)CC2)cc1)C(C)C ZINC001234660082 1130669089 /nfs/dbraw/zinc/66/90/89/1130669089.db2.gz DBRGVTNJVPRMNL-GOSISDBHSA-N 1 0 290.451 3.642 20 10 CHCDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]C[C@@H]1CCC=CO1 ZINC000780571064 1130684646 /nfs/dbraw/zinc/68/46/46/1130684646.db2.gz VZFKOLHNNVRFAN-SFHVURJKSA-N 1 0 295.382 3.842 20 10 CHCDRO CCOc1ccc(CNc2cc3c(c[nH+]2)CCCC3)c(O)c1 ZINC000812345905 1130685905 /nfs/dbraw/zinc/68/59/05/1130685905.db2.gz VAHBFGJLXRHQCA-UHFFFAOYSA-N 1 0 298.386 3.677 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC[C@H](COc3ccccc3)C2)c1 ZINC000780788829 1130693041 /nfs/dbraw/zinc/69/30/41/1130693041.db2.gz DCDAKUWDDLSIKE-INIZCTEOSA-N 1 0 297.398 3.602 20 10 CHCDRO CC[C@H]([NH2+]CCCCF)c1cc(Cl)ccc1O ZINC000812735374 1130710418 /nfs/dbraw/zinc/71/04/18/1130710418.db2.gz CJMPOGOFJHUEBH-LBPRGKRZSA-N 1 0 259.752 3.836 20 10 CHCDRO C=Cc1ccc(CC[NH2+]Cc2cc(OCC)ccc2O)cc1 ZINC000812773209 1130712917 /nfs/dbraw/zinc/71/29/17/1130712917.db2.gz RUBSTLKGAKJXHP-UHFFFAOYSA-N 1 0 297.398 3.766 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CC[C@@]3(CC[C@H](C)C3)C2)c(O)c1 ZINC000781926888 1130748190 /nfs/dbraw/zinc/74/81/90/1130748190.db2.gz BIURNNFQIMLGLL-KBXCAEBGSA-N 1 0 289.419 3.803 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1cncc(F)c1)c1ccc(N(C)C)cc1 ZINC000781920962 1130748849 /nfs/dbraw/zinc/74/88/49/1130748849.db2.gz CENQSVDCSQERJN-OLZOCXBDSA-N 1 0 287.382 3.699 20 10 CHCDRO C[N@@H+](Cc1ccc(C(C)(C)C)cc1O)CC1CCOCC1 ZINC001235674440 1130766427 /nfs/dbraw/zinc/76/64/27/1130766427.db2.gz GBOFJCZVUVANIH-UHFFFAOYSA-N 1 0 291.435 3.548 20 10 CHCDRO CC[N@H+](Cc1ccc(C(C)(C)C)cc1O)C1CCOCC1 ZINC001235685946 1130768903 /nfs/dbraw/zinc/76/89/03/1130768903.db2.gz VUDXMRMJGAVYFL-UHFFFAOYSA-N 1 0 291.435 3.691 20 10 CHCDRO Cc1ccoc1C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000813882620 1130793607 /nfs/dbraw/zinc/79/36/07/1130793607.db2.gz FILWEPABUYIDMC-ZYHUDNBSSA-N 1 0 275.323 3.771 20 10 CHCDRO Nc1ccc(C[N@@H+]2CCC[C@@H](Cc3ccc(F)cc3)C2)cc1 ZINC001236009848 1130832616 /nfs/dbraw/zinc/83/26/16/1130832616.db2.gz YGRNLSAOLTTZFK-KRWDZBQOSA-N 1 0 298.405 3.863 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC3(CCC3)[C@H]2C(C)C)c1 ZINC000814171246 1130832836 /nfs/dbraw/zinc/83/28/36/1130832836.db2.gz MKYCXXIAPKXIRQ-MRXNPFEDSA-N 1 0 259.393 3.711 20 10 CHCDRO CCC[C@H]([NH2+][C@H](C)c1ccccc1O)c1ccccn1 ZINC000783510414 1130832870 /nfs/dbraw/zinc/83/28/70/1130832870.db2.gz YYVONCVCWBBXCI-CJNGLKHVSA-N 1 0 270.376 3.979 20 10 CHCDRO Oc1cccc(Cl)c1C[NH+]1CCC(C2CC2)CC1 ZINC000814172421 1130833602 /nfs/dbraw/zinc/83/36/02/1130833602.db2.gz MQMKGLGKPPCDKD-UHFFFAOYSA-N 1 0 265.784 3.668 20 10 CHCDRO C[C@H]([NH2+][C@@H]1c2ccccc2C[C@H]1C)c1ccccc1O ZINC000783522544 1130833547 /nfs/dbraw/zinc/83/35/47/1130833547.db2.gz PFRFMCZHAWJXET-VBHSOAQHSA-N 1 0 267.372 3.976 20 10 CHCDRO COc1cc(Cl)cc(C[NH+]2CCC(C3CC3)CC2)c1O ZINC000814172425 1130833771 /nfs/dbraw/zinc/83/37/71/1130833771.db2.gz MXCBDNKXUMHGFS-UHFFFAOYSA-N 1 0 295.810 3.676 20 10 CHCDRO Cc1ccoc1C[N@@H+](C)Cc1cc(Cl)cc(C)c1O ZINC000814175611 1130834364 /nfs/dbraw/zinc/83/43/64/1130834364.db2.gz XDYNYBNUWYBJJQ-UHFFFAOYSA-N 1 0 279.767 3.887 20 10 CHCDRO COc1cc(Cl)cc(C[NH+](C2CCC2)C2CCC2)c1O ZINC000814177498 1130834741 /nfs/dbraw/zinc/83/47/41/1130834741.db2.gz FHHKAKAKRDCPNH-UHFFFAOYSA-N 1 0 295.810 3.961 20 10 CHCDRO C[C@H]([NH2+][C@@H](c1cccnc1)C1CC1)c1ccccc1O ZINC000783526058 1130834794 /nfs/dbraw/zinc/83/47/94/1130834794.db2.gz RGAXDWVQTXPHPC-YVEFUNNKSA-N 1 0 268.360 3.589 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CC3(CCC3)[C@H]2C(C)C)c(O)c1 ZINC000814170857 1130837613 /nfs/dbraw/zinc/83/76/13/1130837613.db2.gz FLZIGDCTOVFDCM-QGZVFWFLSA-N 1 0 289.419 3.801 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CC(C)(C)[C@H]2c2cccnc2)cc1 ZINC000814171117 1130838262 /nfs/dbraw/zinc/83/82/62/1130838262.db2.gz KWDCQZPHDCHQSG-GOSISDBHSA-N 1 0 295.430 3.731 20 10 CHCDRO CCOc1cccc(C[N@@H+]2C[C@H](C)[C@H]3CCCC[C@H]32)c1O ZINC000783593523 1130842555 /nfs/dbraw/zinc/84/25/55/1130842555.db2.gz VMVGAXRORYYONF-NUEKZKHPSA-N 1 0 289.419 3.801 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCS[C@H]2C)cc1F ZINC000783628741 1130843725 /nfs/dbraw/zinc/84/37/25/1130843725.db2.gz LUNLMTYOWGOYJX-SWLSCSKDSA-N 1 0 296.455 3.656 20 10 CHCDRO CC1(C)C[N@H+](Cc2ccc(N)cc2)Cc2ccccc21 ZINC001236084956 1130853133 /nfs/dbraw/zinc/85/31/33/1130853133.db2.gz HQQOCRQDPIFOAX-UHFFFAOYSA-N 1 0 266.388 3.562 20 10 CHCDRO C[N@@H+](Cc1cc2c(cc1O)CCC2)C[C@H]1CC=CCC1 ZINC000784012434 1130869174 /nfs/dbraw/zinc/86/91/74/1130869174.db2.gz CVORUPRHAFCMGT-AWEZNQCLSA-N 1 0 271.404 3.669 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)[C@@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001170760806 1130904004 /nfs/dbraw/zinc/90/40/04/1130904004.db2.gz JHILKWOBWCOGBY-QKDCVEJESA-N 1 0 259.393 3.649 20 10 CHCDRO CCSCC[C@H](C)[NH2+][C@H](C)c1cc(C)ccc1O ZINC000168807210 1130904280 /nfs/dbraw/zinc/90/42/80/1130904280.db2.gz QELWRDOQPAUSOK-QWHCGFSZSA-N 1 0 267.438 3.883 20 10 CHCDRO CCSCC[C@H](C)[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000168809666 1130917867 /nfs/dbraw/zinc/91/78/67/1130917867.db2.gz VEDCKHUTZBMTSN-QWRGUYRKSA-N 1 0 271.401 3.714 20 10 CHCDRO Cc1cc(C[N@H+]2CC=C(C(F)(F)F)CC2)ccc1N(C)C ZINC000815075511 1130955748 /nfs/dbraw/zinc/95/57/48/1130955748.db2.gz FJVPSZNVSJASLL-UHFFFAOYSA-N 1 0 298.352 3.755 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CCC(F)(F)[C@@H](C)C2)cc1 ZINC000815119704 1130958622 /nfs/dbraw/zinc/95/86/22/1130958622.db2.gz FJDRTWMCFXEIPJ-ZDUSSCGKSA-N 1 0 282.378 3.620 20 10 CHCDRO CC[C@@H]([NH2+]CC1(C(F)(F)F)CC1)c1ccccc1O ZINC000797070352 1130958926 /nfs/dbraw/zinc/95/89/26/1130958926.db2.gz KYKLRKJRBYQCRJ-LLVKDONJSA-N 1 0 273.298 3.775 20 10 CHCDRO CC[N@H+](Cc1ccc(OC)cc1)Cc1ccc(N(C)C)cc1 ZINC000217391553 1130960731 /nfs/dbraw/zinc/96/07/31/1130960731.db2.gz WSWHTWLVPFMLLB-UHFFFAOYSA-N 1 0 298.430 3.783 20 10 CHCDRO CCCN1CCC[C@H]1C[NH2+][C@H](CC)c1ccc(C)cc1O ZINC000797115428 1130962905 /nfs/dbraw/zinc/96/29/05/1130962905.db2.gz SXEKUJPZISCAEE-DOTOQJQBSA-N 1 0 290.451 3.616 20 10 CHCDRO CCc1ccc(C[N@@H+]2CCC[C@@H]2c2ccncc2)c(O)c1 ZINC001236790369 1131006180 /nfs/dbraw/zinc/00/61/80/1131006180.db2.gz WMVUOJVMEBKSTL-QGZVFWFLSA-N 1 0 282.387 3.687 20 10 CHCDRO CCc1ccc(C[N@@H+]2CCC[C@H]2Cc2ccccn2)c(O)c1 ZINC001236791079 1131006817 /nfs/dbraw/zinc/00/68/17/1131006817.db2.gz CWHLORMSMBBBGW-SFHVURJKSA-N 1 0 296.414 3.557 20 10 CHCDRO CCc1ccc(C[N@@H+]2CCC23CCCCC3)c(O)c1 ZINC001236787494 1131006886 /nfs/dbraw/zinc/00/68/86/1131006886.db2.gz VVGTTWARIZLBFF-UHFFFAOYSA-N 1 0 259.393 3.863 20 10 CHCDRO CCc1ccc(C[N@H+](C)Cc2cccs2)c(O)c1 ZINC001236790377 1131006917 /nfs/dbraw/zinc/00/69/17/1131006917.db2.gz WNLOEYUSSUQPRS-UHFFFAOYSA-N 1 0 261.390 3.648 20 10 CHCDRO CCc1ccc(C[N@@H+]2CC[C@@H]3CCC[C@@H]3C2)c(O)c1 ZINC001236786812 1131007003 /nfs/dbraw/zinc/00/70/03/1131007003.db2.gz PKRPRRZZAJEXSX-LSDHHAIUSA-N 1 0 259.393 3.577 20 10 CHCDRO CCc1ccc(C[NH+]2CCC(c3ccncc3)CC2)c(O)c1 ZINC001236788362 1131007251 /nfs/dbraw/zinc/00/72/51/1131007251.db2.gz JOGSHNCHNAPJBE-UHFFFAOYSA-N 1 0 296.414 3.729 20 10 CHCDRO CCc1ccc(CN2Cc3ccc(F)cc3C2)c(O)c1 ZINC001236794800 1131007950 /nfs/dbraw/zinc/00/79/50/1131007950.db2.gz OUBUICRIUKLDJW-UHFFFAOYSA-N 1 0 271.335 3.610 20 10 CHCDRO CCc1ccc(C[N@@H+]2CCc3ccsc3C2)c(O)c1 ZINC001236794283 1131008445 /nfs/dbraw/zinc/00/84/45/1131008445.db2.gz KOBQMSABNADPIZ-UHFFFAOYSA-N 1 0 273.401 3.574 20 10 CHCDRO COc1cc(O)c(C[NH+]2C[C@H]3CCCC[C@@H]3C2)c(Cl)c1 ZINC001236797549 1131009961 /nfs/dbraw/zinc/00/99/61/1131009961.db2.gz GHCJWYVKYUOHKI-VXGBXAGGSA-N 1 0 295.810 3.676 20 10 CHCDRO COc1cc(O)c(C[NH+]2[C@H](C)CCC[C@H]2C)c(Cl)c1 ZINC001236801203 1131011220 /nfs/dbraw/zinc/01/12/20/1131011220.db2.gz BQEXIUUCZYJYHL-GHMZBOCLSA-N 1 0 283.799 3.817 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CCCC3(CCC3)C2)c(Cl)c1 ZINC001236807445 1131012762 /nfs/dbraw/zinc/01/27/62/1131012762.db2.gz GQQJQOCTDMKQHG-UHFFFAOYSA-N 1 0 295.810 3.820 20 10 CHCDRO CC[N@H+](Cc1c(C)cc(OC)cc1O)C1CCCCC1 ZINC001236817800 1131013337 /nfs/dbraw/zinc/01/33/37/1131013337.db2.gz HUBLTQLYQHSZNK-UHFFFAOYSA-N 1 0 277.408 3.864 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1cc[nH]c(=O)c1)c1cc(Cl)ccc1O ZINC000815642679 1131015463 /nfs/dbraw/zinc/01/54/63/1131015463.db2.gz JNIFLKSUTSFHHO-VHSXEESVSA-N 1 0 292.766 3.558 20 10 CHCDRO Oc1cc2ccccc2cc1C[NH+]1C[C@H]2CCC[C@@H]2C1 ZINC001236827119 1131015750 /nfs/dbraw/zinc/01/57/50/1131015750.db2.gz PLIRYYQXEYIKSC-HZPDHXFCSA-N 1 0 267.372 3.777 20 10 CHCDRO CC(C)c1ccc(C[N@@H+]2CCC[C@H]2c2ncccn2)c(O)c1 ZINC001237051533 1131039553 /nfs/dbraw/zinc/03/95/53/1131039553.db2.gz MUYITKSMFYBNIO-INIZCTEOSA-N 1 0 297.402 3.643 20 10 CHCDRO CC(C)c1ccc(C[N@H+](C)C2CC(F)(F)C2)c(O)c1 ZINC001237047037 1131040625 /nfs/dbraw/zinc/04/06/25/1131040625.db2.gz YTVAKBSFHRASKQ-UHFFFAOYSA-N 1 0 269.335 3.745 20 10 CHCDRO CC[C@@H](C)[N@H+](C)Cc1ccc(OCC(F)(F)F)cc1O ZINC001237052243 1131042090 /nfs/dbraw/zinc/04/20/90/1131042090.db2.gz REPNKUKHFPFPJW-SNVBAGLBSA-N 1 0 291.313 3.564 20 10 CHCDRO Oc1ccc(F)c(Cl)c1C[NH+]1CCCCCC1 ZINC001237119178 1131052514 /nfs/dbraw/zinc/05/25/14/1131052514.db2.gz BPMKKJWSDNFEJE-UHFFFAOYSA-N 1 0 257.736 3.561 20 10 CHCDRO Oc1ccc(F)c(Cl)c1C[NH+]1CC2CCC(CC2)C1 ZINC001237131973 1131056661 /nfs/dbraw/zinc/05/66/61/1131056661.db2.gz ZKUNZCSCAOQBAF-UHFFFAOYSA-N 1 0 283.774 3.807 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C1CCSCC1 ZINC000168831483 1131066647 /nfs/dbraw/zinc/06/66/47/1131066647.db2.gz AUTWYWRTZXJOPR-YPMHNXCESA-N 1 0 277.433 3.734 20 10 CHCDRO CC1(C)[C@@H]2C[N@@H+](Cc3ccc4ccccc4c3O)C[C@@H]21 ZINC000816514619 1131103251 /nfs/dbraw/zinc/10/32/51/1131103251.db2.gz CNVZJUNBFCCZTL-IYBDPMFKSA-N 1 0 267.372 3.633 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]C1CCC(C(F)F)CC1 ZINC000799719236 1131103467 /nfs/dbraw/zinc/10/34/67/1131103467.db2.gz WLKNSMWQNLERGE-UHFFFAOYSA-N 1 0 296.405 3.975 20 10 CHCDRO Cc1cccc(O)c1C[N@H+]1C[C@H](C)OC[C@@H]1c1ccccc1 ZINC001237490808 1131104134 /nfs/dbraw/zinc/10/41/34/1131104134.db2.gz BMFOQDDWCZPUNR-MAUKXSAKSA-N 1 0 297.398 3.663 20 10 CHCDRO CSC[C@H]1CCC[N@@H+]1Cc1ccc2ccccc2c1O ZINC000816516994 1131104289 /nfs/dbraw/zinc/10/42/89/1131104289.db2.gz ZPMFEQNNKBKNMB-OAHLLOKOSA-N 1 0 287.428 3.873 20 10 CHCDRO Oc1c(C[NH2+][C@@H]2CCCSC2)ccc2ccccc21 ZINC000816556142 1131109653 /nfs/dbraw/zinc/10/96/53/1131109653.db2.gz AYVPWWDZWDUQDO-CQSZACIVSA-N 1 0 273.401 3.531 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@H]1CC=C(C)CC1 ZINC000816592490 1131110117 /nfs/dbraw/zinc/11/01/17/1131110117.db2.gz LXEUJVDJVMXSLV-INIZCTEOSA-N 1 0 258.409 3.861 20 10 CHCDRO OCC1(C[NH2+]Cc2ccc3ccccc3c2O)CCCCC1 ZINC000816555826 1131111766 /nfs/dbraw/zinc/11/17/66/1131111766.db2.gz RIXJZUDCPHZGMB-UHFFFAOYSA-N 1 0 299.414 3.578 20 10 CHCDRO Oc1c(C[NH2+]C2Cc3ccccc3C2)ccc2ccccc21 ZINC000816570357 1131112219 /nfs/dbraw/zinc/11/22/19/1131112219.db2.gz RFTZURKZUYJXQR-UHFFFAOYSA-N 1 0 289.378 3.802 20 10 CHCDRO Oc1c(C[NH2+]C[C@@H]2CCCCS2)ccc2ccccc21 ZINC000816567366 1131113202 /nfs/dbraw/zinc/11/32/02/1131113202.db2.gz YSZZVQKMUBGEJM-HNNXBMFYSA-N 1 0 287.428 3.921 20 10 CHCDRO CC[C@]1(CO)CCC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816574648 1131113240 /nfs/dbraw/zinc/11/32/40/1131113240.db2.gz OIKVXAFDPLACIN-IBGZPJMESA-N 1 0 299.414 3.530 20 10 CHCDRO CC[N@H+](Cc1cc(OC)cc(OC)c1O)C1CCCCC1 ZINC001237674985 1131126212 /nfs/dbraw/zinc/12/62/12/1131126212.db2.gz PDMBDTIFVXAHIZ-UHFFFAOYSA-N 1 0 293.407 3.564 20 10 CHCDRO CC[C@@H]1CC[N@H+](Cc2cc(Br)c(C)cc2O)C1 ZINC001237686716 1131126461 /nfs/dbraw/zinc/12/64/61/1131126461.db2.gz XEESNONWDUQEAI-LLVKDONJSA-N 1 0 298.224 3.695 20 10 CHCDRO CC[C@H](C)[N@H+](C)Cc1cc(Br)c(C)cc1O ZINC001237681993 1131126538 /nfs/dbraw/zinc/12/65/38/1131126538.db2.gz VELCZKWJYABAMI-JTQLQIEISA-N 1 0 286.213 3.693 20 10 CHCDRO C[N@H+](CCc1ccccc1)Cc1cc(F)cc(Cl)c1[O-] ZINC001237811424 1131142550 /nfs/dbraw/zinc/14/25/50/1131142550.db2.gz YSZNCUPUPFLFGS-UHFFFAOYSA-N 1 0 293.769 3.859 20 10 CHCDRO C[N@H+](Cc1ccsc1)Cc1cc(F)c(Cl)cc1[O-] ZINC001237937008 1131152586 /nfs/dbraw/zinc/15/25/86/1131152586.db2.gz NCISEJHCYFLERJ-UHFFFAOYSA-N 1 0 285.771 3.878 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@@H]2CC23CCSCC3)cc1C ZINC000817411383 1131160756 /nfs/dbraw/zinc/16/07/56/1131160756.db2.gz QTTABFGJWILWRX-HNNXBMFYSA-N 1 0 291.460 3.632 20 10 CHCDRO Cc1cc(F)cc(C[N@@H+]2CCc3ccccc3[C@H]2C)c1O ZINC001238056365 1131165413 /nfs/dbraw/zinc/16/54/13/1131165413.db2.gz HKOAHNPJGUCBFZ-CYBMUJFWSA-N 1 0 285.362 3.959 20 10 CHCDRO Cc1cc(F)cc(C[N@H+]2CCCCC[C@@H]2C)c1O ZINC001238062143 1131166885 /nfs/dbraw/zinc/16/68/85/1131166885.db2.gz UZKSMYJJPZRVIV-LBPRGKRZSA-N 1 0 251.345 3.604 20 10 CHCDRO Cc1cc(F)cc(C[N@@H+]2CCC[C@@H]2c2ccncc2)c1O ZINC001238062444 1131167024 /nfs/dbraw/zinc/16/70/24/1131167024.db2.gz PWPLTTBQRHCLSY-MRXNPFEDSA-N 1 0 286.350 3.572 20 10 CHCDRO CC[C@@H]1C[C@@H]([NH2+][C@@H](C)c2c(C)cc(C)cc2O)CCO1 ZINC000817584889 1131173004 /nfs/dbraw/zinc/17/30/04/1131173004.db2.gz ABBHNMFZOKGZNL-SOUVJXGZSA-N 1 0 277.408 3.617 20 10 CHCDRO CC[C@@H]1C[C@H]([NH2+][C@@H](C)c2c(C)cc(C)cc2O)CCO1 ZINC000817584888 1131173080 /nfs/dbraw/zinc/17/30/80/1131173080.db2.gz ABBHNMFZOKGZNL-RRFJBIMHSA-N 1 0 277.408 3.617 20 10 CHCDRO CC[C@@H]1C[C@H]([NH2+][C@@H](C)c2ccc(C)c(C)c2O)CCO1 ZINC000817587632 1131173793 /nfs/dbraw/zinc/17/37/93/1131173793.db2.gz ZRKRSYBMMVGTEF-RRFJBIMHSA-N 1 0 277.408 3.617 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(C)nc(C)c1)c1ccc(F)cc1[O-] ZINC000817588724 1131173981 /nfs/dbraw/zinc/17/39/81/1131173981.db2.gz JHPLKQPPDWRHTE-INIZCTEOSA-N 1 0 288.366 3.784 20 10 CHCDRO Cc1cc(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)cc(C)n1 ZINC000817590056 1131175039 /nfs/dbraw/zinc/17/50/39/1131175039.db2.gz SQUAZGXRACWDQZ-LBPRGKRZSA-N 1 0 290.794 3.908 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccc(N)cc1)c1ccc(C)cc1 ZINC000817955421 1131190230 /nfs/dbraw/zinc/19/02/30/1131190230.db2.gz AJOBCNHOBWBMTE-GOSISDBHSA-N 1 0 268.404 3.861 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCc2ccc(N)cc2)cc1C ZINC000817955837 1131190237 /nfs/dbraw/zinc/19/02/37/1131190237.db2.gz JAUGRCBPOLXWNS-HNNXBMFYSA-N 1 0 268.404 3.779 20 10 CHCDRO CC(C)[C@H]1CCCC[C@@H]1[NH2+]CCc1ccc(N)cc1 ZINC000817955991 1131190306 /nfs/dbraw/zinc/19/03/06/1131190306.db2.gz MYZWCXYMBYBJJR-SJORKVTESA-N 1 0 260.425 3.616 20 10 CHCDRO Cc1cc(C)cc([C@@H](C)[NH2+]CCc2ccc(N)cc2)c1 ZINC000817955745 1131190492 /nfs/dbraw/zinc/19/04/92/1131190492.db2.gz GSTOVLMLVHEIGY-OAHLLOKOSA-N 1 0 268.404 3.779 20 10 CHCDRO Cc1ccc2c(c1)OCCC[C@H]2[NH2+]CCc1ccc(N)cc1 ZINC000817955626 1131190596 /nfs/dbraw/zinc/19/05/96/1131190596.db2.gz DCRKTBIJHOEXFG-GOSISDBHSA-N 1 0 296.414 3.623 20 10 CHCDRO Nc1ccc(CC[NH2+][C@@H](c2ccccc2)C2CC2)cc1 ZINC000817955658 1131190632 /nfs/dbraw/zinc/19/06/32/1131190632.db2.gz DSOSSZILFYSTKZ-SFHVURJKSA-N 1 0 266.388 3.552 20 10 CHCDRO Nc1ccc(CC[NH2+][C@H]2CCC[C@H](c3cccnc3)C2)cc1 ZINC000817958762 1131191015 /nfs/dbraw/zinc/19/10/15/1131191015.db2.gz YAFPHZATFPHZES-LPHOPBHVSA-N 1 0 295.430 3.522 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H](CN)C2CCCCC2)c(O)c1C ZINC000817957614 1131191261 /nfs/dbraw/zinc/19/12/61/1131191261.db2.gz DFNINISITYHVCI-RHSMWYFYSA-N 1 0 290.451 3.567 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccc3c(c2)CCCN3)c1 ZINC000817977810 1131193598 /nfs/dbraw/zinc/19/35/98/1131193598.db2.gz PQLAVSRJBAAYAT-AWEZNQCLSA-N 1 0 296.414 3.910 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2cccc3c2CCCN3)c1 ZINC000817976058 1131193722 /nfs/dbraw/zinc/19/37/22/1131193722.db2.gz USHYKWWJKZWJDJ-AWEZNQCLSA-N 1 0 296.414 3.910 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2cc(C)cc(N)c2)cc1 ZINC000817981365 1131195552 /nfs/dbraw/zinc/19/55/52/1131195552.db2.gz RLJYPUHFZXVBOS-OAHLLOKOSA-N 1 0 297.446 3.884 20 10 CHCDRO Oc1ccc(-c2ccccc2)cc1C[NH2+][C@@H]1C[C@H]2C[C@H]2C1 ZINC000818238558 1131206765 /nfs/dbraw/zinc/20/67/65/1131206765.db2.gz KYLWWFLROTXSGC-ALXJQNPVSA-N 1 0 279.383 3.947 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@H]2CCC[C@H](F)C2)c(O)c1 ZINC001118177624 1131214407 /nfs/dbraw/zinc/21/44/07/1131214407.db2.gz VFQFPQKWGQIURP-IHRRRGAJSA-N 1 0 265.372 3.940 20 10 CHCDRO Cc1cc(C[N@@H+](C)C(C)C)c(C)n1-c1ccccc1 ZINC001137854212 1131424515 /nfs/dbraw/zinc/42/45/15/1131424515.db2.gz NAIPWKUPFSHTNO-UHFFFAOYSA-N 1 0 256.393 3.934 20 10 CHCDRO CC[C@@H]1C[C@H]([NH2+]Cc2ccc(N(CC)CC)cc2)CCO1 ZINC000823671941 1131437094 /nfs/dbraw/zinc/43/70/94/1131437094.db2.gz YGZAHGIYLQQDNZ-SJLPKXTDSA-N 1 0 290.451 3.580 20 10 CHCDRO CS[C@H]1CC[N@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000824683231 1131479616 /nfs/dbraw/zinc/47/96/16/1131479616.db2.gz ANOWTNCDGUGOPK-KRWDZBQOSA-N 1 0 299.439 3.997 20 10 CHCDRO Cc1c(C[N@@H+]2CCCC2(C)C)c2ccccc2n1C ZINC001138252742 1131482260 /nfs/dbraw/zinc/48/22/60/1131482260.db2.gz SMIUMCFHXPONQG-UHFFFAOYSA-N 1 0 256.393 3.861 20 10 CHCDRO CO[C@@](C)(C[NH2+]Cc1cc(C)c(C)cc1O)c1ccccc1 ZINC000824780336 1131483785 /nfs/dbraw/zinc/48/37/85/1131483785.db2.gz KUWMGGQJOPYJLT-IBGZPJMESA-N 1 0 299.414 3.660 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]CC[C@]2(C)CC2(Cl)Cl)c1 ZINC000824971670 1131492366 /nfs/dbraw/zinc/49/23/66/1131492366.db2.gz WOMFFWMCTCAMSU-CYBMUJFWSA-N 1 0 288.218 3.764 20 10 CHCDRO CN1CCCc2cc(CN3Cc4ccc(F)cc4C3)ccc21 ZINC001138356102 1131493951 /nfs/dbraw/zinc/49/39/51/1131493951.db2.gz HNVZVJXWJYBCRF-UHFFFAOYSA-N 1 0 296.389 3.724 20 10 CHCDRO COc1cc(O)c(C[NH+]2CCCCCCCC2)cc1OC ZINC000824983182 1131494173 /nfs/dbraw/zinc/49/41/73/1131494173.db2.gz SGXWIKWJCZPYLE-UHFFFAOYSA-N 1 0 293.407 3.566 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2cc(Cl)c(C)cc2O)cc1 ZINC000825049942 1131495903 /nfs/dbraw/zinc/49/59/03/1131495903.db2.gz NGORUMOXTOCVFB-UHFFFAOYSA-N 1 0 275.779 3.952 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCCC23CC3)c(OC)c1 ZINC001138387352 1131497176 /nfs/dbraw/zinc/49/71/76/1131497176.db2.gz CLZPHUNTZJOVQR-UHFFFAOYSA-N 1 0 288.435 3.670 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H](C)C2)c(OC)c1 ZINC001138387307 1131497231 /nfs/dbraw/zinc/49/72/31/1131497231.db2.gz APKTVBJREYOHRC-OAHLLOKOSA-N 1 0 290.451 3.773 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCC(C)(C)C2)c(OC)c1 ZINC001138388843 1131497538 /nfs/dbraw/zinc/49/75/38/1131497538.db2.gz GWZKMMAKDBXBIC-UHFFFAOYSA-N 1 0 290.451 3.773 20 10 CHCDRO Cc1ccc2[nH]c(C[N@@H+]3CCc4cccc(O)c4C3)cc2c1 ZINC001138418446 1131501485 /nfs/dbraw/zinc/50/14/85/1131501485.db2.gz UJHIBBYMBLRKLF-UHFFFAOYSA-N 1 0 292.382 3.740 20 10 CHCDRO CCO[C@@H]1CCCC[C@H]1[NH2+][C@@H](CC)c1ccccc1O ZINC000825299829 1131505350 /nfs/dbraw/zinc/50/53/50/1131505350.db2.gz PKZMSZQEYQCCBI-ZMSDIMECSA-N 1 0 277.408 3.781 20 10 CHCDRO CSCCCC[NH2+]Cc1cc(Cl)c(C)cc1O ZINC000825292508 1131505503 /nfs/dbraw/zinc/50/55/03/1131505503.db2.gz WWOTYKQQMGSIIL-UHFFFAOYSA-N 1 0 273.829 3.587 20 10 CHCDRO Cc1noc(C)c1[C@H](C)[NH2+]Cc1cc(Cl)c(C)cc1O ZINC000825291487 1131505887 /nfs/dbraw/zinc/50/58/87/1131505887.db2.gz LWFDDXXDRNFFJI-VIFPVBQESA-N 1 0 294.782 3.810 20 10 CHCDRO CCc1cnc(C[NH2+]Cc2cc(Cl)c(C)cc2O)s1 ZINC000825320573 1131506244 /nfs/dbraw/zinc/50/62/44/1131506244.db2.gz MBBQORMAXVUXAA-UHFFFAOYSA-N 1 0 296.823 3.663 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CC[C@@H]2CCO[C@H](C)C2)cc1Cl ZINC000825497231 1131513037 /nfs/dbraw/zinc/51/30/37/1131513037.db2.gz DWGOMZGQGUYSCP-CHWSQXEVSA-N 1 0 297.826 3.649 20 10 CHCDRO C[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000035275586 1131559419 /nfs/dbraw/zinc/55/94/19/1131559419.db2.gz AYDXSPPKCJYZIC-CRAIPNDOSA-N 1 0 272.436 3.955 20 10 CHCDRO Cc1cccc2[nH]cc(C[N@@H+](C)Cc3ccccc3O)c21 ZINC001139200547 1131595354 /nfs/dbraw/zinc/59/53/54/1131595354.db2.gz ZYJDXMNYUYTAEF-UHFFFAOYSA-N 1 0 280.371 3.814 20 10 CHCDRO Cc1cc(C[N@@H+]2C[C@H]3[C@@H](C2)C3(F)F)c(O)c(C(C)(C)C)c1 ZINC000844752471 1131596077 /nfs/dbraw/zinc/59/60/77/1131596077.db2.gz MUVXPHLJDWCLBE-OKILXGFUSA-N 1 0 295.373 3.695 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]CCc1ccco1 ZINC000035661581 1131608758 /nfs/dbraw/zinc/60/87/58/1131608758.db2.gz BJXVTXCKXGPNIA-OCCSQVGLSA-N 1 0 271.360 3.674 20 10 CHCDRO CCC1CC[NH+](Cc2ccc(N(C)C)c(C)c2)CC1 ZINC001139669984 1131627011 /nfs/dbraw/zinc/62/70/11/1131627011.db2.gz SWSROUGSSYPXCQ-UHFFFAOYSA-N 1 0 260.425 3.683 20 10 CHCDRO Cc1cc(C[N@H+](C)CC2CC(F)(F)C2)ccc1N(C)C ZINC001139672704 1131627097 /nfs/dbraw/zinc/62/70/97/1131627097.db2.gz CEEQUAUKLRZVPO-UHFFFAOYSA-N 1 0 282.378 3.538 20 10 CHCDRO COc1cccc2c1CN(Cc1ccc(N(C)C)c(C)c1)C2 ZINC001139674432 1131627574 /nfs/dbraw/zinc/62/75/74/1131627574.db2.gz ZOIXVUOGBQELTK-UHFFFAOYSA-N 1 0 296.414 3.585 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)Cc1c(C)cc(O)cc1C ZINC001139715448 1131632037 /nfs/dbraw/zinc/63/20/37/1131632037.db2.gz JOVGZPCPGXYHDB-UHFFFAOYSA-N 1 0 285.387 3.737 20 10 CHCDRO Oc1cc(O)c(C[N@@H+]2CCCC[C@H]2c2ccccc2)c(O)c1 ZINC001144499154 1131647238 /nfs/dbraw/zinc/64/72/38/1131647238.db2.gz CGMOMXTWAIWRJO-INIZCTEOSA-N 1 0 299.370 3.531 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2cc(F)ccc2O)cc1C ZINC001140060288 1131660290 /nfs/dbraw/zinc/66/02/90/1131660290.db2.gz UFYWPXLAMAFFFD-UHFFFAOYSA-N 1 0 273.351 3.780 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CC[C@@H](c3ccccc3)C2)c1O ZINC001140178541 1131673122 /nfs/dbraw/zinc/67/31/22/1131673122.db2.gz NVGQWAILFHXNHQ-QGZVFWFLSA-N 1 0 281.399 3.999 20 10 CHCDRO CC[C@H](OCC[NH2+]Cc1ccccc1O)c1ccccc1 ZINC000846017247 1131677972 /nfs/dbraw/zinc/67/79/72/1131677972.db2.gz BQHGKHXKSVCBHW-SFHVURJKSA-N 1 0 285.387 3.650 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]CC1(c3ccc(F)cc3)CC1)CC2 ZINC000834513105 1131680945 /nfs/dbraw/zinc/68/09/45/1131680945.db2.gz GATCVHKKGACBGV-INIZCTEOSA-N 1 0 297.373 3.840 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]CC1(c3ccc(F)cc3)CC1)CC2 ZINC000834513106 1131681200 /nfs/dbraw/zinc/68/12/00/1131681200.db2.gz GATCVHKKGACBGV-MRXNPFEDSA-N 1 0 297.373 3.840 20 10 CHCDRO CCC[C@@H]([NH2+][C@H]1CCc2cccc(O)c21)c1ccccn1 ZINC000834566958 1131684342 /nfs/dbraw/zinc/68/43/42/1131684342.db2.gz WBHNYAPSQBTTAK-CVEARBPZSA-N 1 0 282.387 3.906 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@@H]1CSc3ccccc31)CC2 ZINC000834594658 1131686902 /nfs/dbraw/zinc/68/69/02/1131686902.db2.gz SACNCIQUGBFEEP-ZIAGYGMSSA-N 1 0 283.396 3.816 20 10 CHCDRO COc1cc(CC[NH2+][C@H]2CCc3cccc(O)c32)ccc1C ZINC000834598065 1131686939 /nfs/dbraw/zinc/68/69/39/1131686939.db2.gz MNUQNBKZKPAITC-INIZCTEOSA-N 1 0 297.398 3.529 20 10 CHCDRO C[C@@H]1Cc2ccccc2[C@H]1[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000834645504 1131689903 /nfs/dbraw/zinc/68/99/03/1131689903.db2.gz FTRHKNCZKVAFKU-FXHACXQTSA-N 1 0 279.383 3.903 20 10 CHCDRO Cc1cccc2c1CC[C@@H]2[NH2+][C@H]1CCc2cccc(O)c21 ZINC000834641054 1131690048 /nfs/dbraw/zinc/69/00/48/1131690048.db2.gz VSUJHMFLYRQOIP-IRXDYDNUSA-N 1 0 279.383 3.965 20 10 CHCDRO Cc1ccc2c(c1)[C@@H]([NH2+][C@H]1CCc3cccc(O)c31)CC2 ZINC000834639753 1131690125 /nfs/dbraw/zinc/69/01/25/1131690125.db2.gz ASQRMYFGIKFAKU-IRXDYDNUSA-N 1 0 279.383 3.965 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@@H]1C[C@H]1Cc1ccccc1)CC2 ZINC000834668721 1131692460 /nfs/dbraw/zinc/69/24/60/1131692460.db2.gz NPXIEZDEVQWONS-BRWVUGGUSA-N 1 0 279.383 3.600 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@H]1C[C@H]1Cc1ccccc1)CC2 ZINC000834668726 1131692632 /nfs/dbraw/zinc/69/26/32/1131692632.db2.gz NPXIEZDEVQWONS-ZACQAIPSSA-N 1 0 279.383 3.600 20 10 CHCDRO CC[C@@H](CC(F)(F)F)[NH2+][C@@H](C)c1cccc(OC)c1O ZINC000846161698 1131693003 /nfs/dbraw/zinc/69/30/03/1131693003.db2.gz BBGINCUXKLHNCM-UWVGGRQHSA-N 1 0 291.313 3.782 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]C[C@@H]2CCC[C@@H]2C2CC2)c1O ZINC000846168658 1131693011 /nfs/dbraw/zinc/69/30/11/1131693011.db2.gz LKIQERSVBCLMHD-DUVNUKRYSA-N 1 0 289.419 3.878 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@H](C)CC(C)(C)C)c1O ZINC000846167805 1131693200 /nfs/dbraw/zinc/69/32/00/1131693200.db2.gz DWUCVZMSVUTYCT-VXGBXAGGSA-N 1 0 265.397 3.876 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H]2CCCC[C@H]2C)c1O ZINC000846135195 1131693603 /nfs/dbraw/zinc/69/36/03/1131693603.db2.gz BANNFDAISPZTIO-MBNYWOFBSA-N 1 0 263.381 3.630 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@H]2CCc3ccccc3C2)c1O ZINC000846135371 1131693899 /nfs/dbraw/zinc/69/38/99/1131693899.db2.gz CUCDQLPDSOVNNM-CJNGLKHVSA-N 1 0 297.398 3.609 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H](C)CCc2ccco2)c1O ZINC000846138962 1131694111 /nfs/dbraw/zinc/69/41/11/1131694111.db2.gz YRVPKXHBJSKXSX-STQMWFEESA-N 1 0 289.375 3.666 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H](C)c2nc(C)cs2)c1O ZINC000846146678 1131694541 /nfs/dbraw/zinc/69/45/41/1131694541.db2.gz SDXJXSJKJDBORR-WDEREUQCSA-N 1 0 292.404 3.578 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@H](C)Cc2ccsc2)c1O ZINC000846143134 1131694652 /nfs/dbraw/zinc/69/46/52/1131694652.db2.gz HWQQTFXHSFEITH-VXGBXAGGSA-N 1 0 291.416 3.744 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H](C)c2nc(C)cs2)c1O ZINC000846146677 1131694823 /nfs/dbraw/zinc/69/48/23/1131694823.db2.gz SDXJXSJKJDBORR-QWRGUYRKSA-N 1 0 292.404 3.578 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]Cc2ccc(C)cc2C)c1O ZINC000846140848 1131694839 /nfs/dbraw/zinc/69/48/39/1131694839.db2.gz GTSLLTKDJNNKDE-AWEZNQCLSA-N 1 0 285.387 3.868 20 10 CHCDRO CCc1cccc(C[NH2+][C@@H](C)c2cccc(OC)c2O)c1 ZINC000846208942 1131695642 /nfs/dbraw/zinc/69/56/42/1131695642.db2.gz MVHBBEVVDCSROJ-ZDUSSCGKSA-N 1 0 285.387 3.814 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCCC2CCOCC2)c1 ZINC000834818503 1131707632 /nfs/dbraw/zinc/70/76/32/1131707632.db2.gz MKKIRJCLGSOFJK-AWEZNQCLSA-N 1 0 277.408 3.558 20 10 CHCDRO COC1(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)CCCC1 ZINC000834814519 1131707657 /nfs/dbraw/zinc/70/76/57/1131707657.db2.gz LIJDXVRGCWGNBQ-WCQYABFASA-N 1 0 293.382 3.628 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCCC2CCOCC2)c1 ZINC000834818504 1131707774 /nfs/dbraw/zinc/70/77/74/1131707774.db2.gz MKKIRJCLGSOFJK-CQSZACIVSA-N 1 0 277.408 3.558 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CSc2ccccc21)c1ccccc1O ZINC000834817874 1131707900 /nfs/dbraw/zinc/70/79/00/1131707900.db2.gz DTAHJKBGBIAZFN-OLZOCXBDSA-N 1 0 285.412 3.932 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CCOC1(C)C)c1cc(Cl)ccc1O ZINC000834875800 1131715894 /nfs/dbraw/zinc/71/58/94/1131715894.db2.gz UMCLNSXXVCXAQJ-TZMCWYRMSA-N 1 0 283.799 3.654 20 10 CHCDRO CC[C@@](C)(C[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O)OC ZINC000834882550 1131716591 /nfs/dbraw/zinc/71/65/91/1131716591.db2.gz ROUOEGHWQHFCSU-NHYWBVRUSA-N 1 0 285.815 3.820 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCC[C@H]1OC)c1cc(Cl)ccc1O ZINC000834886440 1131718666 /nfs/dbraw/zinc/71/86/66/1131718666.db2.gz LDYIXWWCCLWTPY-GZBFAFLISA-N 1 0 283.799 3.654 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2C[C@@H](C)n3ccnc32)c(O)c1C ZINC000834896492 1131721830 /nfs/dbraw/zinc/72/18/30/1131721830.db2.gz WRWXYOVYEQFNDR-OSAQELSMSA-N 1 0 285.391 3.562 20 10 CHCDRO CCCc1ncc(C[NH2+][C@H](C)c2cc(Cl)ccc2O)o1 ZINC000834898272 1131723596 /nfs/dbraw/zinc/72/35/96/1131723596.db2.gz BCQJJIXHVJQMGR-SNVBAGLBSA-N 1 0 294.782 3.837 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]C1CCC(OC(F)F)CC1)CC2 ZINC000834906622 1131728145 /nfs/dbraw/zinc/72/81/45/1131728145.db2.gz YPYFTJDSLZOORY-BPCQOVAHSA-N 1 0 297.345 3.520 20 10 CHCDRO C[C@@H]([NH2+]CCC[C@@H]1CCOC1)c1cc(Cl)ccc1O ZINC000834906466 1131729200 /nfs/dbraw/zinc/72/92/00/1131729200.db2.gz WVTHKGQTZYJSEH-VXGBXAGGSA-N 1 0 283.799 3.513 20 10 CHCDRO CO[C@@H]([C@@H](C)[NH2+][C@H](C)c1cc(Cl)cc(C)c1O)C1CC1 ZINC000834904974 1131729297 /nfs/dbraw/zinc/72/92/97/1131729297.db2.gz RKBAECRNCFAORY-UVWXRNBGSA-N 1 0 297.826 3.818 20 10 CHCDRO Cc1ccc(CC[NH2+][C@H](C)c2ccc(C)c(C)c2O)nc1 ZINC000834909473 1131730129 /nfs/dbraw/zinc/73/01/29/1131730129.db2.gz ODWNAXLVJAIJLZ-OAHLLOKOSA-N 1 0 284.403 3.606 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCOC(C)(C)C1)c1ccc(C)cc1O ZINC000834909131 1131730865 /nfs/dbraw/zinc/73/08/65/1131730865.db2.gz JHSCJEXSVLFWJI-HOCLYGCPSA-N 1 0 291.435 3.947 20 10 CHCDRO CCC(C)(C)OCC[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000834915592 1131733403 /nfs/dbraw/zinc/73/34/03/1131733403.db2.gz RYODOXIOUQFSIP-AWEZNQCLSA-N 1 0 279.424 3.865 20 10 CHCDRO Oc1cc(Cl)ccc1C[N@@H+]1CCOC2(CCCCC2)C1 ZINC001140465397 1131751002 /nfs/dbraw/zinc/75/10/02/1131751002.db2.gz LVGKQCLDOATYQL-UHFFFAOYSA-N 1 0 295.810 3.581 20 10 CHCDRO C[N@H+](CCc1ccc(F)cc1)Cc1ccc(Cl)cc1O ZINC001140467605 1131752042 /nfs/dbraw/zinc/75/20/42/1131752042.db2.gz ZGHPENKBQIEQCV-UHFFFAOYSA-N 1 0 293.769 3.859 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH+]2CCC(C(F)F)CC2)cc1 ZINC000835028155 1131758998 /nfs/dbraw/zinc/75/89/98/1131758998.db2.gz KDQDKADONYJMJN-ARJAWSKDSA-N 1 0 294.389 3.743 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]CCc2cccs2)cc1 ZINC000835033661 1131761105 /nfs/dbraw/zinc/76/11/05/1131761105.db2.gz ILVYLRXFFQEOMD-HYXAFXHYSA-N 1 0 286.444 3.660 20 10 CHCDRO C[C@H](c1ccccn1)[N@H+](C)C/C=C\c1ccc(N(C)C)cc1 ZINC000835043623 1131763066 /nfs/dbraw/zinc/76/30/66/1131763066.db2.gz ADNRAIJETNOKQX-XITLMJRVSA-N 1 0 295.430 3.854 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]C[C@H]2CCCC2(F)F)cc1 ZINC000835055291 1131766904 /nfs/dbraw/zinc/76/69/04/1131766904.db2.gz UKUNFWXOQQRHDC-FOSCPCJNSA-N 1 0 294.389 3.791 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]C[C@H]2CCCC2(F)F)cc1 ZINC000835055292 1131766977 /nfs/dbraw/zinc/76/69/77/1131766977.db2.gz UKUNFWXOQQRHDC-MBVDDHJVSA-N 1 0 294.389 3.791 20 10 CHCDRO C[C@H]1C[N@H+](Cc2c([O-])cc(F)cc2F)Cc2ccccc21 ZINC001140582806 1131807545 /nfs/dbraw/zinc/80/75/45/1131807545.db2.gz NDNAKBVBQIIBFX-NSHDSACASA-N 1 0 289.325 3.790 20 10 CHCDRO Cc1ccc(O)c(C[N@H+]2CC=C(c3ccccc3)CC2)c1 ZINC001140623596 1131833065 /nfs/dbraw/zinc/83/30/65/1131833065.db2.gz XQPJWOSPZAKEIJ-UHFFFAOYSA-N 1 0 279.383 3.990 20 10 CHCDRO C[C@@H](C[NH2+][C@@H](C)c1ccc(N(C)C)cc1)Oc1ccccc1 ZINC000772985524 1131835832 /nfs/dbraw/zinc/83/58/32/1131835832.db2.gz RZQIAHNQLFKERJ-HOTGVXAUSA-N 1 0 298.430 3.871 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)Cc1cccc2ccncc21 ZINC001140644487 1131842668 /nfs/dbraw/zinc/84/26/68/1131842668.db2.gz PTNVSBQZTIFAHI-UHFFFAOYSA-N 1 0 292.382 3.963 20 10 CHCDRO Cc1c(O)ccc(C[N@@H+]2CCC[C@H](c3ccccc3)C2)c1O ZINC001140745367 1131905437 /nfs/dbraw/zinc/90/54/37/1131905437.db2.gz HFVRMXPSFVYZNT-INIZCTEOSA-N 1 0 297.398 3.786 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)c(C)c1 ZINC000773051586 1131930623 /nfs/dbraw/zinc/93/06/23/1131930623.db2.gz KRWDIKFXYWQUGS-HNNXBMFYSA-N 1 0 298.430 3.920 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](CO)CC(C)(C)C)cc1 ZINC000773077550 1131936571 /nfs/dbraw/zinc/93/65/71/1131936571.db2.gz RXHNEDBUFBLJJU-GOEBONIOSA-N 1 0 292.467 3.590 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@H](C)[C@@H]2C)c(O)c1 ZINC001140855226 1131947062 /nfs/dbraw/zinc/94/70/62/1131947062.db2.gz SKADXVOFYZGION-GJZGRUSLSA-N 1 0 290.451 3.859 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H]2C(C)C)c(O)c1 ZINC001140856479 1131948588 /nfs/dbraw/zinc/94/85/88/1131948588.db2.gz CJOONTBWEKJNQI-QGZVFWFLSA-N 1 0 290.451 3.859 20 10 CHCDRO Cc1ccc(C[NH+]2CCC3(CC(F)(F)C3)CC2)c(O)c1 ZINC001140947818 1131970429 /nfs/dbraw/zinc/97/04/29/1131970429.db2.gz GZVWPROMGAJSPD-UHFFFAOYSA-N 1 0 281.346 3.712 20 10 CHCDRO Cc1ccc(C[NH+]2CCC(c3cccc(O)c3)CC2)c(O)c1 ZINC001140954302 1131971415 /nfs/dbraw/zinc/97/14/15/1131971415.db2.gz PFEQKULXYNIEGX-UHFFFAOYSA-N 1 0 297.398 3.786 20 10 CHCDRO CC1(C)CC[N@H+](Cc2cc3c4c(c2)CCCN4CCC3)C1 ZINC001141076689 1132006169 /nfs/dbraw/zinc/00/61/69/1132006169.db2.gz ZNTAGSYDGZMRHG-UHFFFAOYSA-N 1 0 284.447 3.617 20 10 CHCDRO C[C@@H]([NH2+]CC1C[C@H]2CC[C@@H](C1)S2)c1ccccc1O ZINC000716000441 1132007991 /nfs/dbraw/zinc/00/79/91/1132007991.db2.gz JAZDICUNMIIOIJ-RLAWYHOSSA-N 1 0 277.433 3.717 20 10 CHCDRO C[C@@H](Cc1ccco1)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000037291935 1132027232 /nfs/dbraw/zinc/02/72/32/1132027232.db2.gz FUNQDJWVAZLHRU-KBPBESRZSA-N 1 0 272.392 3.627 20 10 CHCDRO CCC[C@@H]1CCCC[N@@H+]1Cc1ccc2c(c1)OCCN2C ZINC001141143420 1132027541 /nfs/dbraw/zinc/02/75/41/1132027541.db2.gz YJMFQVHNKKRTNL-MRXNPFEDSA-N 1 0 288.435 3.670 20 10 CHCDRO Oc1ccc(O)c(C[NH+]2CCC(Cc3ccccc3)CC2)c1 ZINC001141155859 1132029961 /nfs/dbraw/zinc/02/99/61/1132029961.db2.gz MVZIOPSIGKIFQL-UHFFFAOYSA-N 1 0 297.398 3.553 20 10 CHCDRO Cc1cccc2c1CC[C@H]([NH2+][C@H](C)c1ccccc1O)C2 ZINC001171552992 1132053391 /nfs/dbraw/zinc/05/33/91/1132053391.db2.gz JRGUDOADQHCPOP-ZBFHGGJFSA-N 1 0 281.399 3.909 20 10 CHCDRO Cc1cc(Cl)ccc1C[N@@H+]1CCc2cccc(O)c2C1 ZINC001141233972 1132054762 /nfs/dbraw/zinc/05/47/62/1132054762.db2.gz ZMHCPTOCXDIJIA-UHFFFAOYSA-N 1 0 287.790 3.912 20 10 CHCDRO Cc1csc(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)n1 ZINC000038090557 1132112672 /nfs/dbraw/zinc/11/26/72/1132112672.db2.gz OAFMBJHKTPYCLL-ZYHUDNBSSA-N 1 0 288.416 3.804 20 10 CHCDRO CCOc1ccc(C[NH2+]C2CCC(C(F)F)CC2)c(O)c1 ZINC000839179244 1132189000 /nfs/dbraw/zinc/18/90/00/1132189000.db2.gz HOSSUZPMYCKKPH-UHFFFAOYSA-N 1 0 299.361 3.704 20 10 CHCDRO C[C@H](c1ccccc1)[N@H+](CC[C@H](C)O)Cc1ccccc1O ZINC000839530948 1132222080 /nfs/dbraw/zinc/22/20/80/1132222080.db2.gz GLYYFYOYIHLZKV-JKSUJKDBSA-N 1 0 299.414 3.726 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1C[C@@H](OC(C)C)C1)c1ccc(C)cc1O ZINC000840764618 1132283437 /nfs/dbraw/zinc/28/34/37/1132283437.db2.gz QRJSUUIVZPPWNL-IJEWVQPXSA-N 1 0 277.408 3.697 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+][C@H]2C[C@@H](OC(C)C)C2)c(O)c1 ZINC000840765125 1132285301 /nfs/dbraw/zinc/28/53/01/1132285301.db2.gz VJPPNASAZPPEEE-KFWWJZLASA-N 1 0 277.408 3.616 20 10 CHCDRO C[C@@H]([NH2+]C1CC(C)(C)OC(C)(C)C1)c1ccccc1O ZINC001172647935 1132288419 /nfs/dbraw/zinc/28/84/19/1132288419.db2.gz PPRNRHXEHWDUNA-GFCCVEGCSA-N 1 0 277.408 3.779 20 10 CHCDRO CC[C@H]([NH2+][C@H]1C[C@@H](OC)C12CCC2)c1ccc(C)cc1O ZINC000840807185 1132289219 /nfs/dbraw/zinc/28/92/19/1132289219.db2.gz RANLTACDSWUVBU-BHYGNILZSA-N 1 0 289.419 3.699 20 10 CHCDRO CO[C@@H]1C[C@@H]([NH2+][C@H](C)c2c(C)cc(C)cc2O)C12CCC2 ZINC000840805860 1132289494 /nfs/dbraw/zinc/28/94/94/1132289494.db2.gz CCFXKQRYTGMCGY-FVQBIDKESA-N 1 0 289.419 3.617 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]C1(C3CCC3)CCC1)CC2 ZINC000840811455 1132290097 /nfs/dbraw/zinc/29/00/97/1132290097.db2.gz LATAMNDSHQANEX-CQSZACIVSA-N 1 0 257.377 3.692 20 10 CHCDRO COCC[C@@H](C)C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000840834924 1132292381 /nfs/dbraw/zinc/29/23/81/1132292381.db2.gz BXORWWTVASCCNA-KGLIPLIRSA-N 1 0 287.403 3.869 20 10 CHCDRO CO[C@@](C)([C@@H](C)[NH2+][C@@H](C)c1ccc(C)c(C)c1O)C1CC1 ZINC000840860572 1132296654 /nfs/dbraw/zinc/29/66/54/1132296654.db2.gz OHBRPUUEMLWHQU-IYOUNJFTSA-N 1 0 291.435 3.863 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1C[C@@H](C)O[C@@H]1C)c1ccc(N(C)C)cc1 ZINC000840874047 1132299535 /nfs/dbraw/zinc/29/95/35/1132299535.db2.gz WJVMUPNJXWRPHV-DEICHXMPSA-N 1 0 290.451 3.607 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CCCC[C@H]2F)c(O)c1 ZINC000840876342 1132300600 /nfs/dbraw/zinc/30/06/00/1132300600.db2.gz PAOFBKRAELMJMV-BFHYXJOUSA-N 1 0 265.372 3.940 20 10 CHCDRO COCC1CCC([NH2+][C@H](C)c2ccc(C)cc2O)CC1 ZINC000840883490 1132303145 /nfs/dbraw/zinc/30/31/45/1132303145.db2.gz ZVMWNULRJMMFTK-WLYUNCDWSA-N 1 0 277.408 3.556 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CCCc2nccs2)c(Cl)c1 ZINC000840900898 1132305674 /nfs/dbraw/zinc/30/56/74/1132305674.db2.gz YRGLTDJDGRRKIW-UHFFFAOYSA-N 1 0 296.823 3.533 20 10 CHCDRO CO[C@@]1(C)CCC[N@H+](Cc2c(O)cc(C)cc2Cl)CC1 ZINC000840940859 1132310482 /nfs/dbraw/zinc/31/04/82/1132310482.db2.gz IMWISPMLKBGPHA-INIZCTEOSA-N 1 0 297.826 3.745 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]C1(c2ccccc2)CC1 ZINC000840932109 1132310671 /nfs/dbraw/zinc/31/06/71/1132310671.db2.gz NHINFGJNFSFISO-UHFFFAOYSA-N 1 0 280.415 3.840 20 10 CHCDRO Cc1cc(O)c(C[NH+]2CC(CC(F)(F)F)C2)c(Cl)c1 ZINC000840953728 1132313087 /nfs/dbraw/zinc/31/30/87/1132313087.db2.gz XPOONCZZCUCIBP-UHFFFAOYSA-N 1 0 293.716 3.738 20 10 CHCDRO Cc1ncccc1C[N@@H+](C)Cc1c(O)ccc2ccccc21 ZINC001231589784 1132317342 /nfs/dbraw/zinc/31/73/42/1132317342.db2.gz QMUBUJFBCCXJNE-UHFFFAOYSA-N 1 0 292.382 3.881 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CCC(F)(F)[C@@H](F)C1 ZINC001231587363 1132318639 /nfs/dbraw/zinc/31/86/39/1132318639.db2.gz ADUBTGPLRYJTQP-HNNXBMFYSA-N 1 0 295.304 3.725 20 10 CHCDRO CC1CC([N@H+](C)Cc2c(O)ccc3ccccc32)C1 ZINC001231588280 1132319041 /nfs/dbraw/zinc/31/90/41/1132319041.db2.gz OTGCRYCFSLWLRI-UHFFFAOYSA-N 1 0 255.361 3.776 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@H+]1C[C@H]2[C@H](CC2(F)F)C1 ZINC001231587218 1132319764 /nfs/dbraw/zinc/31/97/64/1132319764.db2.gz RDFILYAURBILKA-DOMZBBRYSA-N 1 0 289.325 3.632 20 10 CHCDRO CC[N@H+](Cc1ccc(F)cc1)Cc1cccc(C)c1O ZINC001231594190 1132320820 /nfs/dbraw/zinc/32/08/20/1132320820.db2.gz VWCYCEVTFBYLNU-UHFFFAOYSA-N 1 0 273.351 3.862 20 10 CHCDRO CC(C)c1ccc(C[NH2+]CCc2ccc(N)cc2)cc1 ZINC000841034549 1132322189 /nfs/dbraw/zinc/32/21/89/1132322189.db2.gz CESUEDZOCTYLMF-UHFFFAOYSA-N 1 0 268.404 3.725 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CCc3ccc(C)cc3C2)cc1C ZINC001172829906 1132325182 /nfs/dbraw/zinc/32/51/82/1132325182.db2.gz HDLHAXQNIUPKEH-LJQANCHMSA-N 1 0 295.426 3.959 20 10 CHCDRO Cc1ccc2c(c1)C[C@H]([NH2+]Cc1ccc3c(c1)CCO3)CC2 ZINC001172834724 1132326872 /nfs/dbraw/zinc/32/68/72/1132326872.db2.gz ISXDRSBRGWDMSX-LJQANCHMSA-N 1 0 293.410 3.577 20 10 CHCDRO Cc1ccc2c(c1)C[C@@H]([N@@H+]1CCc3cccc(O)c3C1)CC2 ZINC001172844362 1132336081 /nfs/dbraw/zinc/33/60/81/1132336081.db2.gz RPEZLCJMYFTFSZ-SFHVURJKSA-N 1 0 293.410 3.616 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCOC[C@@H]2c2ccccc2)c(O)c1 ZINC001231841920 1132376292 /nfs/dbraw/zinc/37/62/92/1132376292.db2.gz GZLGKIPEASALQK-GOSISDBHSA-N 1 0 297.398 3.583 20 10 CHCDRO Cc1cc([C@H]2CCC[N@@H+]2Cc2c(C)cc(C)cc2O)no1 ZINC001231841589 1132376401 /nfs/dbraw/zinc/37/64/01/1132376401.db2.gz CAFYPBCZXGFMBM-MRXNPFEDSA-N 1 0 286.375 3.643 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CC[C@H](c3ccccc3)C2)c(O)c1 ZINC001231842126 1132376994 /nfs/dbraw/zinc/37/69/94/1132376994.db2.gz KAKKLQQDGPULJJ-KRWDZBQOSA-N 1 0 281.399 3.999 20 10 CHCDRO Cc1cc(C)c(C[NH+]2CCC(c3ccccn3)CC2)c(O)c1 ZINC001231846023 1132377687 /nfs/dbraw/zinc/37/76/87/1132377687.db2.gz YIPVAFWROHWMOU-UHFFFAOYSA-N 1 0 296.414 3.784 20 10 CHCDRO COc1ccccc1C[N@H+](C)Cc1c(C)cc(C)cc1O ZINC001231845681 1132377831 /nfs/dbraw/zinc/37/78/31/1132377831.db2.gz QASLDGLYZULXLH-UHFFFAOYSA-N 1 0 285.387 3.650 20 10 CHCDRO Cc1cc(C)c(C[NH+]2CC(c3ccccc3)C2)c(O)c1 ZINC001231847083 1132379097 /nfs/dbraw/zinc/37/90/97/1132379097.db2.gz VLGVKEWJDDBXML-UHFFFAOYSA-N 1 0 267.372 3.608 20 10 CHCDRO COc1ccc(C[N@H+](C)Cc2c(C)cc(C)cc2O)cc1 ZINC001231844236 1132379438 /nfs/dbraw/zinc/37/94/38/1132379438.db2.gz JNXBGLLAEKYUQK-UHFFFAOYSA-N 1 0 285.387 3.650 20 10 CHCDRO COc1cc(N(C)C)ccc1C[NH+]1CCC2(CCC2)CC1 ZINC001231852541 1132379538 /nfs/dbraw/zinc/37/95/38/1132379538.db2.gz XQXWGCNYGOYHFU-UHFFFAOYSA-N 1 0 288.435 3.527 20 10 CHCDRO Cc1cc(O)c(C[NH+]2CCC(C)CC2)cc1Cl ZINC001231866342 1132381216 /nfs/dbraw/zinc/38/12/16/1132381216.db2.gz DJNVATZNVTUTMW-UHFFFAOYSA-N 1 0 253.773 3.586 20 10 CHCDRO C[N@H+](Cc1ccc2ccccc2c1O)C1CC(F)(F)C1 ZINC001231877903 1132386368 /nfs/dbraw/zinc/38/63/68/1132386368.db2.gz AEZMNRBZIXWKCC-UHFFFAOYSA-N 1 0 277.314 3.775 20 10 CHCDRO Cc1noc(C)c1C[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841744119 1132387034 /nfs/dbraw/zinc/38/70/34/1132387034.db2.gz FEQZGMCDRKQQSY-MRVPVSSYSA-N 1 0 280.755 3.501 20 10 CHCDRO C[C@H]([NH2+]CCC[NH+]1CCCCC1)c1ccc(Cl)cc1[O-] ZINC000841743484 1132387059 /nfs/dbraw/zinc/38/70/59/1132387059.db2.gz HPQCPFWSOWMJCS-ZDUSSCGKSA-N 1 0 296.842 3.572 20 10 CHCDRO CC(C)SCC[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841752400 1132387330 /nfs/dbraw/zinc/38/73/30/1132387330.db2.gz AJFHQGNQWXBRRC-SNVBAGLBSA-N 1 0 273.829 3.838 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)cc1 ZINC000841745497 1132388039 /nfs/dbraw/zinc/38/80/39/1132388039.db2.gz YYVCPABPQGSEGL-NSHDSACASA-N 1 0 291.778 3.905 20 10 CHCDRO Oc1c(C[N@@H+]2CCC[C@H]3C[C@H]32)ccc2ccccc21 ZINC001231883789 1132389021 /nfs/dbraw/zinc/38/90/21/1132389021.db2.gz UJHJOSCGARIWFN-XJKSGUPXSA-N 1 0 253.345 3.530 20 10 CHCDRO Cc1cncc(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)c1 ZINC000841752445 1132389155 /nfs/dbraw/zinc/38/91/55/1132389155.db2.gz SQAYTKMKODSGSL-NSHDSACASA-N 1 0 276.767 3.600 20 10 CHCDRO Oc1c(C[N@@H+]2CC[C@@H]3OCCC[C@H]3C2)ccc2ccccc21 ZINC001231878803 1132389453 /nfs/dbraw/zinc/38/94/53/1132389453.db2.gz UTRGFOLCMIPYHF-YJBOKZPZSA-N 1 0 297.398 3.546 20 10 CHCDRO COCC[C@H]1CCCC[N@@H+]1Cc1ccc2ccccc2c1O ZINC001231881749 1132390337 /nfs/dbraw/zinc/39/03/37/1132390337.db2.gz HUXAVQQXMOLTRZ-QGZVFWFLSA-N 1 0 299.414 3.936 20 10 CHCDRO Oc1c(C[NH+]2CC(c3cccnc3)C2)ccc2ccccc21 ZINC001231880975 1132390996 /nfs/dbraw/zinc/39/09/96/1132390996.db2.gz PFMKNTOIQSDNSQ-UHFFFAOYSA-N 1 0 290.366 3.540 20 10 CHCDRO C[C@H]1C[C@@H](CF)[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC001231879267 1132391204 /nfs/dbraw/zinc/39/12/04/1132391204.db2.gz BDMJKBPZGMIGRU-WFASDCNBSA-N 1 0 273.351 3.725 20 10 CHCDRO Oc1c(C[N@@H+]2CCC[C@H](CF)C2)ccc2ccccc21 ZINC001231880668 1132391735 /nfs/dbraw/zinc/39/17/35/1132391735.db2.gz BWDUMZNURCKYIM-CYBMUJFWSA-N 1 0 273.351 3.727 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)nc1C ZINC000841756739 1132393328 /nfs/dbraw/zinc/39/33/28/1132393328.db2.gz JROYFMNDANWAAV-LBPRGKRZSA-N 1 0 290.794 3.908 20 10 CHCDRO CC[C@H]([NH2+][C@@H](CO)CC1CCCCC1)c1ccccc1O ZINC000841760457 1132393588 /nfs/dbraw/zinc/39/35/88/1132393588.db2.gz FLDUTHAHSPIJOB-WBVHZDCISA-N 1 0 291.435 3.764 20 10 CHCDRO CC[N@H+](Cc1ccnc(C(F)F)c1)Cc1ccccc1O ZINC001231893045 1132393832 /nfs/dbraw/zinc/39/38/32/1132393832.db2.gz QWBXXZAYGGGVEK-UHFFFAOYSA-N 1 0 292.329 3.747 20 10 CHCDRO CCO[C@@H]1CCC[C@H]1[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841757629 1132394115 /nfs/dbraw/zinc/39/41/15/1132394115.db2.gz NYKROSLFFBJNBR-WDBKCZKBSA-N 1 0 283.799 3.654 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](CO)CC2CCCCC2)c1 ZINC000841762215 1132397023 /nfs/dbraw/zinc/39/70/23/1132397023.db2.gz NWQLRMNWHHMIHA-GDBMZVCRSA-N 1 0 291.435 3.683 20 10 CHCDRO CCCC[C@@H](CC(C)C)[NH2+]CCc1ccc(O)c(O)c1 ZINC001173251197 1132421223 /nfs/dbraw/zinc/42/12/23/1132421223.db2.gz ZGTSWWXUUOADSN-HNNXBMFYSA-N 1 0 279.424 3.835 20 10 CHCDRO CCC[C@H]1CCCC[N@@H+]1Cc1cc(Cl)c(O)cc1O ZINC001232268839 1132446056 /nfs/dbraw/zinc/44/60/56/1132446056.db2.gz TXBNHWANTZDGIE-LBPRGKRZSA-N 1 0 283.799 3.906 20 10 CHCDRO CC[C@@H]1CCC[N@H+](Cc2cc(Cl)c(OC)cc2O)C1 ZINC001232270165 1132446840 /nfs/dbraw/zinc/44/68/40/1132446840.db2.gz WGEUBNKYMJBXPF-LLVKDONJSA-N 1 0 283.799 3.676 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CCC[C@H](C)[C@@H]2C)cc1Cl ZINC001232264948 1132447013 /nfs/dbraw/zinc/44/70/13/1132447013.db2.gz PDNGOFVVJKSUEY-QWRGUYRKSA-N 1 0 283.799 3.675 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CCC[C@H](C)[C@@H](C)C2)cc1Cl ZINC001232267101 1132447108 /nfs/dbraw/zinc/44/71/08/1132447108.db2.gz WIXUZAURVWWOFK-RYUDHWBXSA-N 1 0 297.826 3.922 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CCC[C@@H](C)[C@@H](C)C2)cc1Cl ZINC001232267099 1132447202 /nfs/dbraw/zinc/44/72/02/1132447202.db2.gz WIXUZAURVWWOFK-NEPJUHHUSA-N 1 0 297.826 3.922 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CC[C@@H](C)C[C@@H]2C)cc1Cl ZINC001232270215 1132447365 /nfs/dbraw/zinc/44/73/65/1132447365.db2.gz YQXHUUKFGMTATI-MNOVXSKESA-N 1 0 283.799 3.675 20 10 CHCDRO FC1(F)CCC([NH2+]CCCSc2nccs2)CC1 ZINC000842683527 1132450722 /nfs/dbraw/zinc/45/07/22/1132450722.db2.gz MNWNGSWHVBXTSJ-UHFFFAOYSA-N 1 0 292.420 3.793 20 10 CHCDRO C[C@H](C[NH2+]C/C=C\c1ccc(N(C)C)cc1)CC(F)F ZINC000842730407 1132455506 /nfs/dbraw/zinc/45/55/06/1132455506.db2.gz XWZIHSJOIXXTJZ-ZFDPJTLLSA-N 1 0 282.378 3.647 20 10 CHCDRO CC(C)C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccncc1 ZINC000842836410 1132467493 /nfs/dbraw/zinc/46/74/93/1132467493.db2.gz ANLANWZQXXEMCE-SFHVURJKSA-N 1 0 296.414 3.894 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](C)CC(F)F)c(O)c1C ZINC000842890875 1132475075 /nfs/dbraw/zinc/47/50/75/1132475075.db2.gz VDDCBNNPLSMLIO-CABZTGNLSA-N 1 0 271.351 3.951 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCS[C@H]1C)c1cc(Cl)ccc1O ZINC000842927347 1132476079 /nfs/dbraw/zinc/47/60/79/1132476079.db2.gz CHVPWNPJFPNAIE-XDTLVQLUSA-N 1 0 285.840 3.980 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2CCS[C@@H]2C)c1O ZINC000842928824 1132477456 /nfs/dbraw/zinc/47/74/56/1132477456.db2.gz LTXWLLBKQZJTDO-CWSCBRNRSA-N 1 0 285.840 3.899 20 10 CHCDRO COc1cc(C)c(C[N@@H+]2CCc3cccc(O)c3C2)c(C)c1 ZINC001142941269 1132487364 /nfs/dbraw/zinc/48/73/64/1132487364.db2.gz BWYGDMMPZFBHDO-UHFFFAOYSA-N 1 0 297.398 3.576 20 10 CHCDRO CC(C)(C)c1cccc(C[NH+]2CC3(CCC3)C2)c1O ZINC001143104153 1132502679 /nfs/dbraw/zinc/50/26/79/1132502679.db2.gz PYWHLTYLMYXQKL-UHFFFAOYSA-N 1 0 259.393 3.676 20 10 CHCDRO COc1cccc([C@H](C)N2CCCc3cc(C[NH3+])ccc32)c1 ZINC000843350952 1132523169 /nfs/dbraw/zinc/52/31/69/1132523169.db2.gz YROJRDOFRCDECY-AWEZNQCLSA-N 1 0 296.414 3.668 20 10 CHCDRO Cc1ccccc1C1([NH2+]Cc2cc(F)ccc2O)CC1 ZINC000843419409 1132530095 /nfs/dbraw/zinc/53/00/95/1132530095.db2.gz VUUTYPOBEIQCPC-UHFFFAOYSA-N 1 0 271.335 3.619 20 10 CHCDRO CCCCC[NH+](CCCCC)Cc1cc(O)c(O)c(O)c1 ZINC001233016540 1132563526 /nfs/dbraw/zinc/56/35/26/1132563526.db2.gz GYUMLKUDBHVDLC-UHFFFAOYSA-N 1 0 295.423 3.986 20 10 CHCDRO CC1CC([N@H+](C)Cc2cc(C(C)(C)C)ccc2O)C1 ZINC001233284189 1132594775 /nfs/dbraw/zinc/59/47/75/1132594775.db2.gz LRJWLNOIKQNURV-UHFFFAOYSA-N 1 0 261.409 3.920 20 10 CHCDRO C[N@@H+](Cc1cc(C(C)(C)C)ccc1O)C[C@H]1CCCCO1 ZINC001233286570 1132594889 /nfs/dbraw/zinc/59/48/89/1132594889.db2.gz ZJBIPZXVBPHKSW-MRXNPFEDSA-N 1 0 291.435 3.691 20 10 CHCDRO COC[C@@H]1CCCC[N@@H+]1Cc1cc(C(C)(C)C)ccc1O ZINC001233284365 1132595063 /nfs/dbraw/zinc/59/50/63/1132595063.db2.gz RKVMTPOZBNQMRB-INIZCTEOSA-N 1 0 291.435 3.691 20 10 CHCDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2C[C@@H]3C[C@H]2C[C@@H]3F)c1 ZINC001233286676 1132595294 /nfs/dbraw/zinc/59/52/94/1132595294.db2.gz FHSRFJDMKRUVBC-CQDKDKBSSA-N 1 0 277.383 3.622 20 10 CHCDRO CCC1CC[NH+](Cc2c(O)cccc2Cl)CC1 ZINC000133583536 1132601673 /nfs/dbraw/zinc/60/16/73/1132601673.db2.gz PKRYOCSCGFENNN-UHFFFAOYSA-N 1 0 253.773 3.668 20 10 CHCDRO Oc1cc(C(F)(F)F)ccc1C[N@@H+]1CCC12CCCC2 ZINC001233452221 1132624427 /nfs/dbraw/zinc/62/44/27/1132624427.db2.gz OHIXVGXMHIYFKI-UHFFFAOYSA-N 1 0 285.309 3.930 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2ccc(C(F)(F)F)cc2O)C2(CC2)C1 ZINC001233455190 1132625792 /nfs/dbraw/zinc/62/57/92/1132625792.db2.gz ACUHRMLCZPTYKU-JTQLQIEISA-N 1 0 285.309 3.785 20 10 CHCDRO C[N@H+](Cc1ccc(C(F)(F)F)cc1O)CC(C)(C)C ZINC001233454507 1132625936 /nfs/dbraw/zinc/62/59/36/1132625936.db2.gz WZIWNHOZSKPMOP-UHFFFAOYSA-N 1 0 275.314 3.889 20 10 CHCDRO CCCC[N@H+](C)Cc1cccc(OC(F)(F)F)c1O ZINC001233727864 1132671650 /nfs/dbraw/zinc/67/16/50/1132671650.db2.gz QFIPGSKZGKHCBU-UHFFFAOYSA-N 1 0 277.286 3.523 20 10 CHCDRO Cc1cccc2cc[nH+]c(NCc3ccc(O)c(O)c3)c12 ZINC001159005469 1132803822 /nfs/dbraw/zinc/80/38/22/1132803822.db2.gz LZWXICJZEWFJGY-UHFFFAOYSA-N 1 0 280.327 3.567 20 10 CHCDRO Cc1cc(C)c(CNc2[nH+]c(C)cc3[nH]ccc32)c(O)c1 ZINC001160809921 1132982948 /nfs/dbraw/zinc/98/29/48/1132982948.db2.gz DLCIAXVOGNOCKS-UHFFFAOYSA-N 1 0 281.359 3.806 20 10 CHCDRO CCCOc1ccc(C[NH2+]CC[C@@H]2CCCOC2)cc1C ZINC001203227560 1133305954 /nfs/dbraw/zinc/30/59/54/1133305954.db2.gz AVFGVFOIRDJHDX-INIZCTEOSA-N 1 0 291.435 3.690 20 10 CHCDRO CCOCc1cc(C[NH2+][C@@H](C)CC2CCC2)ccc1OC ZINC001203288849 1133310047 /nfs/dbraw/zinc/31/00/47/1133310047.db2.gz DZRYRIOGDSHXIE-AWEZNQCLSA-N 1 0 291.435 3.900 20 10 CHCDRO CC[N@H+](Cc1ccc(C)c(C)c1)Cc1ccc(O)c(O)c1 ZINC001203879898 1133378633 /nfs/dbraw/zinc/37/86/33/1133378633.db2.gz GTENMQSQFMZEOV-UHFFFAOYSA-N 1 0 285.387 3.737 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC(F)(F)C(C)(C)C2)cc1 ZINC001203930611 1133386512 /nfs/dbraw/zinc/38/65/12/1133386512.db2.gz ARDXLCYLJUTPKP-UHFFFAOYSA-N 1 0 282.378 3.620 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2ccc(N(C)C)c3ccccc23)C[C@@H]1F ZINC001204232589 1133423059 /nfs/dbraw/zinc/42/30/59/1133423059.db2.gz FYAALXDCCYSASP-DYVFJYSZSA-N 1 0 286.394 3.696 20 10 CHCDRO CCCC[NH+](CCCC)Cc1ccc(O)cc1O ZINC001204278813 1133427150 /nfs/dbraw/zinc/42/71/50/1133427150.db2.gz KBEGVQILMRXUCE-UHFFFAOYSA-N 1 0 251.370 3.500 20 10 CHCDRO CCC(CC)[N@H+](CCOC)Cc1ccc(N(C)C)cc1C ZINC001204312059 1133434684 /nfs/dbraw/zinc/43/46/84/1133434684.db2.gz BKHAWVXZQMSASY-UHFFFAOYSA-N 1 0 292.467 3.698 20 10 CHCDRO CC1(F)CC[NH+](Cc2ccc(N3CCCC3)cc2)CC1 ZINC001204323171 1133436759 /nfs/dbraw/zinc/43/67/59/1133436759.db2.gz FMSRWKXLUGGMPL-UHFFFAOYSA-N 1 0 276.399 3.611 20 10 CHCDRO F[C@@H]1CCC[N@H+](Cc2ccc(N3CCCC3)cc2)CC1 ZINC001204323759 1133437041 /nfs/dbraw/zinc/43/70/41/1133437041.db2.gz IXBJDTNJCCJGGN-MRXNPFEDSA-N 1 0 276.399 3.611 20 10 CHCDRO CC[N@H+](CCc1ccccn1)Cc1ccc(Cl)cc1O ZINC001204736436 1133480398 /nfs/dbraw/zinc/48/03/98/1133480398.db2.gz LXMVJFLWNOWDOT-UHFFFAOYSA-N 1 0 290.794 3.505 20 10 CHCDRO Cc1ccc(CC[N@@H+](C)Cc2ccccc2O)cc1C ZINC001204826967 1133490679 /nfs/dbraw/zinc/49/06/79/1133490679.db2.gz PFWFQKPEBHQABD-UHFFFAOYSA-N 1 0 269.388 3.684 20 10 CHCDRO Cc1ccc(C[NH2+]C/C=C/c2ccccc2)c(O)c1 ZINC001204983948 1133512932 /nfs/dbraw/zinc/51/29/32/1133512932.db2.gz DVPHVCWTEBYGEM-VMPITWQZSA-N 1 0 253.345 3.504 20 10 CHCDRO COc1ccc(C[N@H+](Cc2ccc(C)cc2O)C2CC2)cc1 ZINC001205223963 1133547093 /nfs/dbraw/zinc/54/70/93/1133547093.db2.gz FXVMHPZGVQRDOG-UHFFFAOYSA-N 1 0 297.398 3.874 20 10 CHCDRO CC[C@H]1CC[N@H+](Cc2cc(F)c(N(C)C)cc2F)[C@H]1C ZINC001205471622 1133579724 /nfs/dbraw/zinc/57/97/24/1133579724.db2.gz OTMBQXDEVIWDIE-RYUDHWBXSA-N 1 0 282.378 3.651 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)Cc1cc(C)ccc1F ZINC001205655625 1133599859 /nfs/dbraw/zinc/59/98/59/1133599859.db2.gz SEIICWHRSBQIHO-UHFFFAOYSA-N 1 0 273.351 3.862 20 10 CHCDRO CCCN(Cc1ccc(OC)cc1C)c1ccc(C[NH3+])cc1 ZINC001205661020 1133599880 /nfs/dbraw/zinc/59/98/80/1133599880.db2.gz RKBBGOQEBRVLBO-UHFFFAOYSA-N 1 0 298.430 3.879 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CC(C)(C)[C@@H]2C(C)C)c1O ZINC001206040162 1133646355 /nfs/dbraw/zinc/64/63/55/1133646355.db2.gz OORXHPARJOLGLL-HNNXBMFYSA-N 1 0 297.826 3.921 20 10 CHCDRO CC[N@H+](CCSC)Cc1cc(Cl)c(C)cc1O ZINC001206560698 1133718466 /nfs/dbraw/zinc/71/84/66/1133718466.db2.gz ULGFGHCYUOAPLC-UHFFFAOYSA-N 1 0 273.829 3.539 20 10 CHCDRO COc1cc(C)cc(C[N@H+](C)C[C@H](C)C(C)(C)C)c1O ZINC001207476317 1133805754 /nfs/dbraw/zinc/80/57/54/1133805754.db2.gz SRXIXNYSZBGLGZ-ZDUSSCGKSA-N 1 0 279.424 3.823 20 10 CHCDRO CC(C)c1ccc(O)c(C[NH2+]C[C@H]2CC3(CCC3)CO2)c1 ZINC001207576582 1133820406 /nfs/dbraw/zinc/82/04/06/1133820406.db2.gz JMDPHPDXMRVATE-MRXNPFEDSA-N 1 0 289.419 3.564 20 10 CHCDRO C[C@H](C[NH2+]Cc1ccc(Cl)cc1O)C(C)(C)C ZINC001207568700 1133821006 /nfs/dbraw/zinc/82/10/06/1133821006.db2.gz CJALWWQSNPZQDZ-SNVBAGLBSA-N 1 0 255.789 3.817 20 10 CHCDRO C[C@H](C[N@@H+]1CCCc2cc(O)c(O)cc2C1)c1ccccc1 ZINC001207911504 1133862165 /nfs/dbraw/zinc/86/21/65/1133862165.db2.gz CBDHQOZKJMTQCC-CQSZACIVSA-N 1 0 297.398 3.650 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)CCC2CCCC2)cc1 ZINC001208695741 1133928679 /nfs/dbraw/zinc/92/86/79/1133928679.db2.gz FBTBKLOYENTETF-UHFFFAOYSA-N 1 0 260.425 3.765 20 10 CHCDRO Oc1cccc2c1C[N@H+](Cc1c[nH]c3cc(F)ccc13)CC2 ZINC001209694846 1134052155 /nfs/dbraw/zinc/05/21/55/1134052155.db2.gz YOILHESHZHHUMZ-UHFFFAOYSA-N 1 0 296.345 3.571 20 10 CHCDRO Oc1cc(F)ccc1Nc1cc[nH+]cc1Oc1ccccc1 ZINC001210014336 1134122603 /nfs/dbraw/zinc/12/26/03/1134122603.db2.gz IWCCDMSVQAUYOB-UHFFFAOYSA-N 1 0 296.301 3.884 20 10 CHCDRO CC(C)C[NH2+]Cc1ccc(Nc2cccc(O)c2O)cc1 ZINC001215745178 1134671679 /nfs/dbraw/zinc/67/16/79/1134671679.db2.gz JGRWYZJOGKLGOR-UHFFFAOYSA-N 1 0 286.375 3.587 20 10 CHCDRO O=C1C=CC(=NNc2ccc(O[C@H]3CC[NH2+]C3)cc2)C=C1 ZINC001218183589 1135064528 /nfs/dbraw/zinc/06/45/28/1135064528.db2.gz WLPBSTJDSOVWPW-INIZCTEOSA-N 1 0 283.331 3.548 20 10 CHCDRO C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1Oc1ccc(N)cc1 ZINC001218337429 1135089264 /nfs/dbraw/zinc/08/92/64/1135089264.db2.gz YYZFFZJSYLGRKL-KXBFYZLASA-N 1 0 296.414 3.558 20 10 CHCDRO CC[C@@H](C)CC[C@@H](C)Oc1ccc(N2CC[NH2+]CC2)cc1 ZINC001218356278 1135093478 /nfs/dbraw/zinc/09/34/78/1135093478.db2.gz BCXVHWJWJQPBRD-HZPDHXFCSA-N 1 0 290.451 3.690 20 10 CHCDRO CC[C@H](C)CC[C@@H](C)Oc1ccc(N2CC[NH2+]CC2)cc1 ZINC001218356279 1135093600 /nfs/dbraw/zinc/09/36/00/1135093600.db2.gz BCXVHWJWJQPBRD-JKSUJKDBSA-N 1 0 290.451 3.690 20 10 CHCDRO C[C@@H]1[NH2+]C[C@H]1Oc1ccc(/N=N/c2ccccc2)cc1 ZINC001218389376 1135097021 /nfs/dbraw/zinc/09/70/21/1135097021.db2.gz VIFKTUNXHJFNLO-LEBYUOOHSA-N 1 0 267.332 3.841 20 10 CHCDRO C[C@@H]1[NH2+]C[C@@H]1Oc1ccc(NN=C2C=CC(=O)C=C2)cc1 ZINC001218391996 1135098504 /nfs/dbraw/zinc/09/85/04/1135098504.db2.gz NUGPGVLCFVCOCG-ZBEGNZNMSA-N 1 0 283.331 3.547 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCc3ccccc3C2)c1 ZINC000315472609 1135154574 /nfs/dbraw/zinc/15/45/74/1135154574.db2.gz RJVOGXJMEASIHB-CJNGLKHVSA-N 1 0 297.398 3.609 20 10 CHCDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+][C@@H](CO)c1ccccc1 ZINC000318946867 1135181388 /nfs/dbraw/zinc/18/13/88/1135181388.db2.gz HXPGPUQQEXMJIB-IMJJTQAJSA-N 1 0 297.398 3.572 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CCc2sccc2C1 ZINC000124286327 187130824 /nfs/dbraw/zinc/13/08/24/187130824.db2.gz DQTUGTIPLDAVEM-UHFFFAOYSA-N 1 0 279.792 3.665 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccccc2F)c1 ZINC000035628680 260030922 /nfs/dbraw/zinc/03/09/22/260030922.db2.gz PEXGKXWYYNVDCM-LBPRGKRZSA-N 1 0 259.324 3.691 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccccc1O)c1ccccc1Cl ZINC000020124012 171005623 /nfs/dbraw/zinc/00/56/23/171005623.db2.gz BOEHZUFHLVLHNB-LLVKDONJSA-N 1 0 261.752 3.896 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1cccnc1)c1ccccc1O ZINC000020127749 171013640 /nfs/dbraw/zinc/01/36/40/171013640.db2.gz JXOUXQKIEHEHMX-SWLSCSKDSA-N 1 0 256.349 3.589 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCc3ccccc32)c1 ZINC000020129852 171018978 /nfs/dbraw/zinc/01/89/78/171018978.db2.gz MYPSNNIXSKSHCD-YVEFUNNKSA-N 1 0 283.371 3.739 20 10 CHCDRO C[C@@H](C[NH2+][C@@H](C)c1ccccc1O)c1ccccc1 ZINC000020137099 171024615 /nfs/dbraw/zinc/02/46/15/171024615.db2.gz NHTSKVCAGUVVSE-KBPBESRZSA-N 1 0 255.361 3.847 20 10 CHCDRO C[C@@H](CCc1ccco1)[NH2+][C@@H](C)c1ccccc1O ZINC000020144724 171030246 /nfs/dbraw/zinc/03/02/46/171030246.db2.gz XJTOQXRKKKWXJF-STQMWFEESA-N 1 0 259.349 3.657 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2cccc(F)c2)c(O)c1 ZINC000020473294 171216715 /nfs/dbraw/zinc/21/67/15/171216715.db2.gz KXUUEIZCRUVQSA-GFCCVEGCSA-N 1 0 259.324 3.691 20 10 CHCDRO C[C@@H]1CCC[C@@H](C)C1[NH2+]Cc1ccc(N(C)C)cc1 ZINC000021011767 171287099 /nfs/dbraw/zinc/28/70/99/171287099.db2.gz WWPXUFKHIJCUJJ-ZIAGYGMSSA-N 1 0 260.425 3.667 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]Cc1ccco1 ZINC000022146683 171356747 /nfs/dbraw/zinc/35/67/47/171356747.db2.gz MYTCQOLVZRPEPD-YPMHNXCESA-N 1 0 257.333 3.632 20 10 CHCDRO C[C@H]([NH2+]Cc1ccco1)c1ccc2ccccc2c1O ZINC000022174222 171369539 /nfs/dbraw/zinc/36/95/39/171369539.db2.gz IIYVWNHAXMWTMB-LBPRGKRZSA-N 1 0 267.328 3.989 20 10 CHCDRO C[C@H]([NH2+]C1CCC(C)CC1)c1ccc(N(C)C)cc1 ZINC000037201510 173025141 /nfs/dbraw/zinc/02/51/41/173025141.db2.gz APPDCVQIOLIZOV-BBBYJDLNSA-N 1 0 260.425 3.982 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)cc1 ZINC000037199088 260073950 /nfs/dbraw/zinc/07/39/50/260073950.db2.gz PRVFYNJUHLYSEC-CQSZACIVSA-N 1 0 284.403 3.612 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](O)c1ccccc1)c1ccc(N(C)C)cc1 ZINC000153830790 261083454 /nfs/dbraw/zinc/08/34/54/261083454.db2.gz XGQNBEUTKMSXTM-OALUTQOASA-N 1 0 298.430 3.527 20 10 CHCDRO CC[C@H]([NH2+]CCCOC1CCCC1)c1ccccc1O ZINC000155491905 261102794 /nfs/dbraw/zinc/10/27/94/261102794.db2.gz XNEKHMOSQWQZTL-INIZCTEOSA-N 1 0 277.408 3.782 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCCO[C@@H]1C(C)C)c1ccccc1O ZINC000156698441 261130051 /nfs/dbraw/zinc/13/00/51/261130051.db2.gz SPKGIEXBRQVYSD-QILLFSRXSA-N 1 0 291.435 3.884 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CCOC2(CCCC2)C1)c1ccccc1O ZINC000156766573 261131642 /nfs/dbraw/zinc/13/16/42/261131642.db2.gz JAEXAPGNQBSFGC-GOEBONIOSA-N 1 0 289.419 3.925 20 10 CHCDRO CCOCCC1(C[NH2+][C@@H](CC)c2ccccc2O)CC1 ZINC000156860676 261134252 /nfs/dbraw/zinc/13/42/52/261134252.db2.gz HUEHWDYXOZMNRD-HNNXBMFYSA-N 1 0 277.408 3.640 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1ccncc1 ZINC000163666873 261324708 /nfs/dbraw/zinc/32/47/08/261324708.db2.gz WUKVVCXBRNNFMT-KBXCAEBGSA-N 1 0 283.419 3.950 20 10 CHCDRO Oc1cccc(C[N@@H+](Cc2ccccc2O)CC2CC2)c1 ZINC000179565268 261797470 /nfs/dbraw/zinc/79/74/70/261797470.db2.gz BJPDKNSRZVQLPY-UHFFFAOYSA-N 1 0 283.371 3.510 20 10 CHCDRO C[C@H]([NH2+]CC1([C@H](O)c2ccccc2)CC1)c1ccccc1O ZINC000183627036 261982569 /nfs/dbraw/zinc/98/25/69/261982569.db2.gz RAOMHBXYKJKIHI-KBXCAEBGSA-N 1 0 297.398 3.557 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)c2cc(Cl)ccc2O)cc1 ZINC000184836374 262030744 /nfs/dbraw/zinc/03/07/44/262030744.db2.gz LFMARUWZJRDERY-LLVKDONJSA-N 1 0 291.778 3.905 20 10 CHCDRO CO[C@H](C[NH2+][C@@H](C)c1cc(C)ccc1O)c1ccccc1 ZINC000185101727 262041502 /nfs/dbraw/zinc/04/15/02/262041502.db2.gz KHZNLPPSRRRSCI-KBXCAEBGSA-N 1 0 285.387 3.739 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCCCNc2ccccn2)c(O)c1 ZINC000185325750 262050722 /nfs/dbraw/zinc/05/07/22/262050722.db2.gz BDOSLJYMSDUQBW-HNNXBMFYSA-N 1 0 299.418 3.639 20 10 CHCDRO COc1cc(C)ccc1C[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000185715134 262067946 /nfs/dbraw/zinc/06/79/46/262067946.db2.gz YZVXZIOPEFXREC-AWEZNQCLSA-N 1 0 285.387 3.868 20 10 CHCDRO CSCCCCC[NH2+][C@H](C)c1cc(F)ccc1O ZINC000186775362 262109178 /nfs/dbraw/zinc/10/91/78/262109178.db2.gz DOSLVOFCKMMVIV-LLVKDONJSA-N 1 0 271.401 3.715 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](C)c2nccs2)c(O)c1 ZINC000186743657 262322729 /nfs/dbraw/zinc/32/27/29/262322729.db2.gz ASYWDNLUZGAPPW-NEPJUHHUSA-N 1 0 276.405 3.611 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCC(F)(F)C2)c1 ZINC000280750779 263064173 /nfs/dbraw/zinc/06/41/73/263064173.db2.gz BQCZFLGKRNKCAS-RYUDHWBXSA-N 1 0 269.335 3.787 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCC(F)(F)C1)c1ccccc1O ZINC000281226276 263067354 /nfs/dbraw/zinc/06/73/54/263067354.db2.gz VJKPEQXCRUXUHS-YPMHNXCESA-N 1 0 269.335 3.868 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H]2CN(C)Cc3ccccc32)c1 ZINC000370372737 267313530 /nfs/dbraw/zinc/31/35/30/267313530.db2.gz CYTPNGANDHPGCV-KDOFPFPSSA-N 1 0 296.414 3.538 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1ccc(C)cc1O)c1ccncc1 ZINC000185541566 327840339 /nfs/dbraw/zinc/84/03/39/327840339.db2.gz FRVODIXBXOMUFR-CZUORRHYSA-N 1 0 270.376 3.898 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+][C@H]2CCOC3(CCC3)C2)c(O)c1 ZINC000285134372 328247409 /nfs/dbraw/zinc/24/74/09/328247409.db2.gz LOFPBIHZDGZPAZ-CABCVRRESA-N 1 0 289.419 3.761 20 10 CHCDRO COCCC1CC[NH+]([C@@H](C)c2ccc(C)c(C)c2O)CC1 ZINC000527932429 330297524 /nfs/dbraw/zinc/29/75/24/330297524.db2.gz CFXQZUURMUQGGU-HNNXBMFYSA-N 1 0 291.435 3.819 20 10 CHCDRO Cc1ncccc1C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000527989349 330299127 /nfs/dbraw/zinc/29/91/27/330299127.db2.gz YBBAQZIGQAGBHX-QMTHXVAHSA-N 1 0 286.350 3.573 20 10 CHCDRO CC[NH+](CC)CCC[C@H](C)[NH2+]Cc1cccc(Cl)c1[O-] ZINC000159731299 330850776 /nfs/dbraw/zinc/85/07/76/330850776.db2.gz VKCBJVPCCLBIAJ-ZDUSSCGKSA-N 1 0 298.858 3.646 20 10 CHCDRO CCOc1cccc(C[NH2+]Cc2ccc(CC)s2)c1O ZINC000227437598 333282887 /nfs/dbraw/zinc/28/28/87/333282887.db2.gz HLOIAJDDRLYGDO-UHFFFAOYSA-N 1 0 291.416 3.705 20 10 CHCDRO C[C@@H](CO)CCC[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000230669761 333320314 /nfs/dbraw/zinc/32/03/14/333320314.db2.gz PIUWDLMAGWQSDW-ZIAGYGMSSA-N 1 0 287.403 3.605 20 10 CHCDRO CCC1(C[NH2+][C@H](C)c2cc(C)ccc2O)CCOCC1 ZINC000273576864 334767316 /nfs/dbraw/zinc/76/73/16/334767316.db2.gz LYVTVNMXZRYZJU-CQSZACIVSA-N 1 0 277.408 3.558 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H](C)CCCO)c1ccc2ccccc2c1O ZINC000296577965 334912513 /nfs/dbraw/zinc/91/25/13/334912513.db2.gz UBTPESOIDBLCAL-UONOGXRCSA-N 1 0 287.403 3.605 20 10 CHCDRO CC[N@H+](Cc1cccc(C)c1O)[C@H](C)c1cccnc1 ZINC000290519872 521340999 /nfs/dbraw/zinc/34/09/99/521340999.db2.gz PZWCNROIBMBHCC-CQSZACIVSA-N 1 0 270.376 3.679 20 10 CHCDRO CCOC(C)(C)C[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000280154095 521627600 /nfs/dbraw/zinc/62/76/00/521627600.db2.gz QIYGVOZDUHGIAP-AWEZNQCLSA-N 1 0 265.397 3.556 20 10 CHCDRO CCCN(Cc1cnc(CC)s1)c1ccc(C[NH3+])cc1 ZINC000278377473 521691816 /nfs/dbraw/zinc/69/18/16/521691816.db2.gz LIFLLYQMAWRKGK-UHFFFAOYSA-N 1 0 289.448 3.581 20 10 CHCDRO CC[C@H]([NH2+]CC(C)(C)C[C@@H](C)O)c1ccc(C)cc1O ZINC000279999752 522570283 /nfs/dbraw/zinc/57/02/83/522570283.db2.gz FWHCILWAJXAJMX-HIFRSBDPSA-N 1 0 279.424 3.538 20 10 CHCDRO CC[C@H]([NH2+]CC1(SC)CCC1)c1ccccc1O ZINC000193805251 522572846 /nfs/dbraw/zinc/57/28/46/522572846.db2.gz UTQYUQLBQDJKLN-ZDUSSCGKSA-N 1 0 265.422 3.719 20 10 CHCDRO CC[C@H]([NH2+]CC1(CCOC)CCC1)c1ccc(C)cc1O ZINC000280186820 522574020 /nfs/dbraw/zinc/57/40/20/522574020.db2.gz RYKOQAHCZORFAE-INIZCTEOSA-N 1 0 291.435 3.948 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(C)ccc1O)c1ccc(OC)cc1 ZINC000071407647 522638441 /nfs/dbraw/zinc/63/84/41/522638441.db2.gz PUGVBYTZZLDFPR-KRWDZBQOSA-N 1 0 285.387 3.950 20 10 CHCDRO CC[C@H]([NH2+]Cc1cccc(OC)c1O)c1ccccc1 ZINC000051626381 522655785 /nfs/dbraw/zinc/65/57/85/522655785.db2.gz FAZSBRITBQAUNI-HNNXBMFYSA-N 1 0 271.360 3.642 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCO[C@@H](C(C)C)C1)c1ccc(C)cc1O ZINC000279977639 522719171 /nfs/dbraw/zinc/71/91/71/522719171.db2.gz DIQNVQYNVFHRMH-UWWQBHOKSA-N 1 0 291.435 3.945 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCCc2nn(C)cc21)c1ccc(C)cc1O ZINC000282516656 522754181 /nfs/dbraw/zinc/75/41/81/522754181.db2.gz UEANOCGTRONQQL-HOTGVXAUSA-N 1 0 299.418 3.552 20 10 CHCDRO C[N@H+](Cc1ccccc1O)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000291020361 523387412 /nfs/dbraw/zinc/38/74/12/523387412.db2.gz AEULXXRTRFCQAW-OLZOCXBDSA-N 1 0 287.325 3.945 20 10 CHCDRO CCn1ccnc1[C@H]1CCCC[N@@H+]1Cc1cc(C)ccc1O ZINC000281087841 523558554 /nfs/dbraw/zinc/55/85/54/523558554.db2.gz JXNXVMZPIZNUOE-MRXNPFEDSA-N 1 0 299.418 3.644 20 10 CHCDRO CO[C@H](C)[C@@H](C)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000289799635 523890224 /nfs/dbraw/zinc/89/02/24/523890224.db2.gz LYSYHVWGEXLREU-ZIAGYGMSSA-N 1 0 285.387 3.572 20 10 CHCDRO CSC1(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)CC1 ZINC000278594540 525337992 /nfs/dbraw/zinc/33/79/92/525337992.db2.gz AGQGPDNZQAHYJV-GFCCVEGCSA-N 1 0 265.422 3.555 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cc(F)cc(F)c1 ZINC000094826285 525444893 /nfs/dbraw/zinc/44/48/93/525444893.db2.gz VNMJSNGUPPZAMI-LBPRGKRZSA-N 1 0 290.357 3.882 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccccc1N(C)C ZINC000093941542 525446590 /nfs/dbraw/zinc/44/65/90/525446590.db2.gz QNNCDBQDKHXCEL-HNNXBMFYSA-N 1 0 297.446 3.669 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCOC2(CCC2)C1)c1ccc(N(C)C)cc1 ZINC000271565879 525686098 /nfs/dbraw/zinc/68/60/98/525686098.db2.gz XWUVBCYBIGFRPS-ZBFHGGJFSA-N 1 0 288.435 3.505 20 10 CHCDRO Cc1cncc(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)c1 ZINC000275936953 526191973 /nfs/dbraw/zinc/19/19/73/526191973.db2.gz BEQXYZRVTQQCSI-UHFFFAOYSA-N 1 0 295.430 3.621 20 10 CHCDRO FC1(F)CC(C[NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000291810080 526272813 /nfs/dbraw/zinc/27/28/13/526272813.db2.gz YDNZZUXAJQKQIE-UHFFFAOYSA-N 1 0 294.389 3.812 20 10 CHCDRO c1cc2c(s1)CCC[C@H]2[NH2+]Cc1ccc2c(c1)CCO2 ZINC000061360211 526446666 /nfs/dbraw/zinc/44/66/66/526446666.db2.gz PQNHNZVWMMFUFX-OAHLLOKOSA-N 1 0 285.412 3.850 20 10 CHCDRO CCC1CCC([N@H+](C)Cc2cccc(OC)c2O)CC1 ZINC000133534357 1125469437 /nfs/dbraw/zinc/46/94/37/1125469437.db2.gz KXBKRYZPFPIZLM-UHFFFAOYSA-N 1 0 277.408 3.801 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C2CC2)C2CCC2)c(O)c1 ZINC000325009455 1117782609 /nfs/dbraw/zinc/78/26/09/1117782609.db2.gz CEFXDSTWFCIBTE-SJKOYZFVSA-N 1 0 259.393 3.930 20 10 CHCDRO Oc1cccc(Cl)c1C[NH+]1CCC(C(F)F)CC1 ZINC000307883606 1118502305 /nfs/dbraw/zinc/50/23/05/1118502305.db2.gz XXOLAULGHXUPQA-UHFFFAOYSA-N 1 0 275.726 3.523 20 10 CHCDRO C[N@@H+](Cc1ccc(Cl)cc1O)CC1CC(F)(F)C1 ZINC001140464759 1118737753 /nfs/dbraw/zinc/73/77/53/1118737753.db2.gz BXBPKGBNYBYMEI-UHFFFAOYSA-N 1 0 275.726 3.523 20 10 CHCDRO COc1c(Cl)cccc1C[NH2+]Cc1ccc(C)cc1O ZINC000897479634 1125503017 /nfs/dbraw/zinc/50/30/17/1125503017.db2.gz GDMXYHPQFHANJE-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@@H]1CCCC(F)(F)C1)CC2 ZINC000695117518 1120109027 /nfs/dbraw/zinc/10/90/27/1120109027.db2.gz ANERKMCNSUYCJC-NEPJUHHUSA-N 1 0 267.319 3.547 20 10 CHCDRO C[C@H]([NH2+]C1CCC2(CC2)CC1)c1cc(F)ccc1O ZINC000695731140 1120415154 /nfs/dbraw/zinc/41/51/54/1120415154.db2.gz QVBZTRXTXTYGEP-NSHDSACASA-N 1 0 263.356 3.905 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C[C@@H]2CCSC2)cc1F ZINC000785462827 1120430913 /nfs/dbraw/zinc/43/09/13/1120430913.db2.gz WYWLVXYFEAYQES-AWEZNQCLSA-N 1 0 296.455 3.515 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H]2CCSC3(CCC3)C2)c1 ZINC000922844947 1120613134 /nfs/dbraw/zinc/61/31/34/1120613134.db2.gz IYFZWCFYCWRCSA-AWEZNQCLSA-N 1 0 277.433 3.609 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCO[C@H](C)C1)c1cc(Cl)ccc1O ZINC000775525736 1122645807 /nfs/dbraw/zinc/64/58/07/1122645807.db2.gz MWAFNMBVTKQVQQ-QKCSRTOESA-N 1 0 283.799 3.654 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1cc(Cl)ccc1O)C1CC1 ZINC000850539155 1123287699 /nfs/dbraw/zinc/28/76/99/1123287699.db2.gz BEFXVKYZAOTNCQ-ZANVPECISA-N 1 0 253.773 3.885 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@@]2(C)CC2(F)F)c(O)c1 ZINC000850536888 1123287425 /nfs/dbraw/zinc/28/74/25/1123287425.db2.gz OSJOEBGGUAYOEO-BXUZGUMPSA-N 1 0 269.335 3.705 20 10 CHCDRO CC[C@@H]([NH2+]CCCCSC)c1ccc(C)cc1O ZINC000794805567 1123953779 /nfs/dbraw/zinc/95/37/79/1123953779.db2.gz XGCDWUDGPHFLCV-CQSZACIVSA-N 1 0 267.438 3.885 20 10 CHCDRO Cc1ccc(C)c(C[NH2+]Cc2cc(Cl)ccc2O)c1 ZINC000846057810 1131679325 /nfs/dbraw/zinc/67/93/25/1131679325.db2.gz JRHQMWMKHSNPBS-UHFFFAOYSA-N 1 0 275.779 3.952 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]Cc2ccc(C)s2)c1O ZINC000846141597 1131694955 /nfs/dbraw/zinc/69/49/55/1131694955.db2.gz QWZICCULZIWGFB-NSHDSACASA-N 1 0 277.389 3.622 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](C)CC(C)(C)C)cc1Cl ZINC001231870447 1132383149 /nfs/dbraw/zinc/38/31/49/1132383149.db2.gz BMIVGELANBLZTI-UHFFFAOYSA-N 1 0 255.789 3.832 20 10 CHCDRO CCC[C@H](CC)[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC000134106346 1125532714 /nfs/dbraw/zinc/53/27/14/1125532714.db2.gz SQPABHNDGCYBFD-HNNXBMFYSA-N 1 0 290.451 3.832 20 10 CHCDRO Oc1ccccc1C[NH2+]Cc1ccc2ccccc2c1 ZINC000134228626 1125544087 /nfs/dbraw/zinc/54/40/87/1125544087.db2.gz SMRWXGFELDDZGH-UHFFFAOYSA-N 1 0 263.340 3.835 20 10 CHCDRO CC[C@H](C)[NH2+][C@@H](C)c1ccc(Br)cc1O ZINC000134906983 1125569490 /nfs/dbraw/zinc/56/94/90/1125569490.db2.gz LNKNZSJWWUEJPU-IUCAKERBSA-N 1 0 272.186 3.604 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CC[C@@H](C)C2)cc1 ZINC000135152352 1125580152 /nfs/dbraw/zinc/58/01/52/1125580152.db2.gz WTGAYCIZQXMNFF-GDBMZVCRSA-N 1 0 260.425 3.811 20 10 CHCDRO CO[C@](C)(C[NH2+][C@H](C)c1ccc(Cl)cc1O)C1CC1 ZINC000841758566 1125598238 /nfs/dbraw/zinc/59/82/38/1125598238.db2.gz SVJUWWIZTTWIFG-MEBBXXQBSA-N 1 0 283.799 3.511 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]CC[C@@H]2CC[C@@H]3C[C@@H]32)c1O ZINC000717154695 1125615861 /nfs/dbraw/zinc/61/58/61/1125615861.db2.gz MEDABRMSTCUFKT-MISXGVKJSA-N 1 0 295.810 3.580 20 10 CHCDRO CC1(C)CC[C@@H]([NH2+]Cc2cc(Br)ccc2O)C1 ZINC000218963097 1125667519 /nfs/dbraw/zinc/66/75/19/1125667519.db2.gz NRIWCHOCKXYWKZ-GFCCVEGCSA-N 1 0 298.224 3.823 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CC3(CCC3)CO2)c(O)c1C ZINC000886701336 1125710558 /nfs/dbraw/zinc/71/05/58/1125710558.db2.gz NWXLSVGBLBADDP-LSDHHAIUSA-N 1 0 289.419 3.619 20 10 CHCDRO COC[C@H]([NH2+][C@H](C)c1ccc(N(C)C)cc1)c1ccccc1 ZINC000089668353 1125736588 /nfs/dbraw/zinc/73/65/88/1125736588.db2.gz WOCXOGIPIUHUPO-BEFAXECRSA-N 1 0 298.430 3.791 20 10 CHCDRO CCC[N@H+](Cc1ccc(COC)o1)Cc1ccccc1O ZINC000092704951 1125761504 /nfs/dbraw/zinc/76/15/04/1125761504.db2.gz PXETWRXVHSDLRP-UHFFFAOYSA-N 1 0 289.375 3.544 20 10 CHCDRO C[C@@H](NCc1ncc(Cl)s1)c1ccc(N(C)C)cc1 ZINC000719428238 1129333483 /nfs/dbraw/zinc/33/34/83/1129333483.db2.gz BZDKXWKDWJVDSH-SNVBAGLBSA-N 1 0 295.839 3.713 20 10 CHCDRO C[C@H]1CCCCC[C@H]1[NH2+]Cc1ccc2c(c1)CCO2 ZINC000088509482 1129206391 /nfs/dbraw/zinc/20/63/91/1129206391.db2.gz RZOITFGSWPXROZ-XJKSGUPXSA-N 1 0 259.393 3.680 20 10 CHCDRO CC1(C)CCC[C@@H](C[NH2+]Cc2ccc3c(c2)CCO3)C1 ZINC001649004974 1126735056 /nfs/dbraw/zinc/73/50/56/1126735056.db2.gz KSOSSYDWENDDIG-OAHLLOKOSA-N 1 0 273.420 3.928 20 10 CHCDRO CCOCc1ccccc1C[NH2+]Cc1cccc(C)c1O ZINC000158092963 1126746045 /nfs/dbraw/zinc/74/60/45/1126746045.db2.gz MDBZMKXKCQPUDZ-UHFFFAOYSA-N 1 0 285.387 3.527 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H](C)c2c(F)cccc2F)c1O ZINC000158112727 1126746653 /nfs/dbraw/zinc/74/66/53/1126746653.db2.gz PCHBXVQXMWJIBM-NSHDSACASA-N 1 0 277.314 3.830 20 10 CHCDRO Cc1cccc(C[NH+]2CCC(OC3CCCC3)CC2)c1O ZINC000179950359 1126837125 /nfs/dbraw/zinc/83/71/25/1126837125.db2.gz PVXKLBJNBXNSQE-UHFFFAOYSA-N 1 0 289.419 3.624 20 10 CHCDRO Cc1cccc(C[N@@H+](C)[C@@H](C)c2cccc(O)c2)c1O ZINC000180178748 1126840830 /nfs/dbraw/zinc/84/08/30/1126840830.db2.gz TYDCFSCNDDRJBX-ZDUSSCGKSA-N 1 0 271.360 3.599 20 10 CHCDRO CCC[N@H+](Cc1ncc(C)s1)Cc1ccccc1O ZINC000180523718 1126845387 /nfs/dbraw/zinc/84/53/87/1126845387.db2.gz WIWJKHYOTUPHIB-UHFFFAOYSA-N 1 0 276.405 3.569 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(OC)c(F)c1)c1ccccc1O ZINC000183316642 1126884465 /nfs/dbraw/zinc/88/44/65/1126884465.db2.gz RIZXEYJCSLORBM-OAHLLOKOSA-N 1 0 289.350 3.781 20 10 CHCDRO C[C@@H]([NH2+]CCc1c(F)cccc1F)c1ccccc1O ZINC000183430342 1126886880 /nfs/dbraw/zinc/88/68/80/1126886880.db2.gz CDDYFHCRZNCQJQ-LLVKDONJSA-N 1 0 277.314 3.564 20 10 CHCDRO C[C@H]([NH2+]C1CCN(c2ccccc2)CC1)c1ccccc1O ZINC000183439053 1126887172 /nfs/dbraw/zinc/88/71/72/1126887172.db2.gz DKTRWJLJMGWACI-HNNXBMFYSA-N 1 0 296.414 3.712 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCc2cc(F)ccc21)c1ccccc1O ZINC000183466110 1126887315 /nfs/dbraw/zinc/88/73/15/1126887315.db2.gz LDOXOMPBHXQCNG-BZNIZROVSA-N 1 0 271.335 3.869 20 10 CHCDRO C[C@@H](O)C[C@@H](C[NH2+][C@@H](C)c1ccccc1O)c1ccccc1 ZINC000183559128 1126888763 /nfs/dbraw/zinc/88/87/63/1126888763.db2.gz PSNBDUGICUUBDD-VYDXJSESSA-N 1 0 299.414 3.598 20 10 CHCDRO C[C@H](O)C[C@H](C[NH2+][C@@H](C)c1ccccc1O)c1ccccc1 ZINC000183559144 1126888952 /nfs/dbraw/zinc/88/89/52/1126888952.db2.gz PSNBDUGICUUBDD-YQQAZPJKSA-N 1 0 299.414 3.598 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCOC2(CCCC2)C1)c1ccccc1O ZINC000183621182 1126889250 /nfs/dbraw/zinc/88/92/50/1126889250.db2.gz FRKSHEDUNGVQRC-KGLIPLIRSA-N 1 0 275.392 3.535 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)C[C@H](O)c2ccccc2)c1 ZINC000185833484 1126903918 /nfs/dbraw/zinc/90/39/18/1126903918.db2.gz BDCDYPLDPWECJA-DOXZYTNZSA-N 1 0 299.414 3.863 20 10 CHCDRO CCCC[C@H](C)[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000777466674 1126944429 /nfs/dbraw/zinc/94/44/29/1126944429.db2.gz DTKPVHMDMRTOGD-INIZCTEOSA-N 1 0 290.451 3.534 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H](CC(F)(F)F)C(C)C)c1 ZINC000782543070 1130782826 /nfs/dbraw/zinc/78/28/26/1130782826.db2.gz ABZKASMAHJVJLY-GFCCVEGCSA-N 1 0 275.314 3.767 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1C[C@@H]1c1cccc(F)c1)c1ccccc1O ZINC000906594267 1126960855 /nfs/dbraw/zinc/96/08/55/1126960855.db2.gz CTSXMOLYWGBIOE-HFBAOOFYSA-N 1 0 271.335 3.738 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+][C@@H](C)c2cccc(O)c2)c1O ZINC000195024261 1126977724 /nfs/dbraw/zinc/97/77/24/1126977724.db2.gz UCKIJBNJZQJFNQ-NSHDSACASA-N 1 0 291.778 3.910 20 10 CHCDRO C[C@H](CCc1ccco1)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000192945486 1126986328 /nfs/dbraw/zinc/98/63/28/1126986328.db2.gz COPUUKYYQKLSTM-MRXNPFEDSA-N 1 0 298.430 3.991 20 10 CHCDRO CC[C@H]([NH2+]Cc1cn2cc(C)ccc2n1)c1ccccc1O ZINC000271691004 1127097052 /nfs/dbraw/zinc/09/70/52/1127097052.db2.gz KHMNEMDKFIPIAY-INIZCTEOSA-N 1 0 295.386 3.589 20 10 CHCDRO C[C@@H]1CCCC[N@@H+]1Cc1cc(C(F)(F)F)ccc1O ZINC001237137095 1131056906 /nfs/dbraw/zinc/05/69/06/1131056906.db2.gz LPSYGZNMORMICB-SNVBAGLBSA-N 1 0 273.298 3.785 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)cc1 ZINC000283689220 1127151304 /nfs/dbraw/zinc/15/13/04/1127151304.db2.gz AAYTXOZAECWPSW-AWEZNQCLSA-N 1 0 285.387 3.868 20 10 CHCDRO CCOC1CC(CC[NH2+][C@@H](C)c2c(C)cc(C)cc2O)C1 ZINC000284882226 1127210413 /nfs/dbraw/zinc/21/04/13/1127210413.db2.gz BKCUOEMNBRXRJV-FHERZECASA-N 1 0 291.435 3.865 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CCc2ccc(O)cc2)c(O)c1 ZINC000285192479 1127219611 /nfs/dbraw/zinc/21/96/11/1127219611.db2.gz NSNAVKSHTFWSHG-AWEZNQCLSA-N 1 0 285.387 3.608 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]Cc1ccoc1 ZINC000168737387 1127224585 /nfs/dbraw/zinc/22/45/85/1127224585.db2.gz CBWWQHDNBKVUJE-DGCLKSJQSA-N 1 0 257.333 3.632 20 10 CHCDRO Cc1cc2cc(C[NH2+]Cc3ccc(N(C)C)cc3)ccc2[nH]1 ZINC000285435791 1127227757 /nfs/dbraw/zinc/22/77/57/1127227757.db2.gz HSCBRMUSWDKNRC-UHFFFAOYSA-N 1 0 293.414 3.832 20 10 CHCDRO COCC(C)(C)CCC[NH2+][C@@H](C)c1cc(OC)ccc1O ZINC000287148955 1127293388 /nfs/dbraw/zinc/29/33/88/1127293388.db2.gz SPTGCLYXMRNKOF-ZDUSSCGKSA-N 1 0 295.423 3.504 20 10 CHCDRO CC[C@H](CC(F)(F)F)[NH2+][C@@H](C)c1cc(OC)ccc1O ZINC000760905145 1127325308 /nfs/dbraw/zinc/32/53/08/1127325308.db2.gz JEVZFUVSZXSWMK-VHSXEESVSA-N 1 0 291.313 3.782 20 10 CHCDRO C[C@@H]([NH2+]CCC[C@H]1CCCCO1)c1cc(F)cc(F)c1[O-] ZINC000760904261 1127325355 /nfs/dbraw/zinc/32/53/55/1127325355.db2.gz BOTOEXUDUSJQNG-DGCLKSJQSA-N 1 0 299.361 3.670 20 10 CHCDRO C[C@H](CCc1ccccc1)[NH2+]Cc1cc(F)ccc1O ZINC000226582795 1127411516 /nfs/dbraw/zinc/41/15/16/1127411516.db2.gz BMRVSBDBCGWWGL-CYBMUJFWSA-N 1 0 273.351 3.642 20 10 CHCDRO Cc1ccc(C[C@H](C)[NH2+]Cc2cc(F)ccc2O)s1 ZINC000226610768 1127412442 /nfs/dbraw/zinc/41/24/42/1127412442.db2.gz HFVODYCAPLRPRM-JTQLQIEISA-N 1 0 279.380 3.622 20 10 CHCDRO CC(C)c1ccc(C[NH2+]Cc2cc(F)ccc2O)cc1 ZINC000226586418 1127412534 /nfs/dbraw/zinc/41/25/34/1127412534.db2.gz URFSEBSUWUJQMX-UHFFFAOYSA-N 1 0 273.351 3.945 20 10 CHCDRO CCCCOCCC[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000168733269 1127464217 /nfs/dbraw/zinc/46/42/17/1127464217.db2.gz DSCJKVDMJGSRAQ-AWEZNQCLSA-N 1 0 265.397 3.558 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CC2CC(F)(F)C2)cc1 ZINC000293712051 1127514207 /nfs/dbraw/zinc/51/42/07/1127514207.db2.gz OYELGJORKCFDBN-LBPRGKRZSA-N 1 0 282.378 3.839 20 10 CHCDRO COc1cccc(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)c1 ZINC000293765080 1127518890 /nfs/dbraw/zinc/51/88/90/1127518890.db2.gz PGHMHALZCPMSRU-CQSZACIVSA-N 1 0 285.387 3.868 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccccc2F)c(O)c1 ZINC000293859365 1127526703 /nfs/dbraw/zinc/52/67/03/1127526703.db2.gz UMPJJNBHERGQAS-CYBMUJFWSA-N 1 0 273.351 3.999 20 10 CHCDRO Fc1cccc2c1CC[C@H]2[NH2+]Cc1ccc2c(c1)CCO2 ZINC000126927277 1127598752 /nfs/dbraw/zinc/59/87/52/1127598752.db2.gz DNAIQPAAGZXSTI-QGZVFWFLSA-N 1 0 283.346 3.538 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1OCCc2ccccc21)c1ccccc1O ZINC000362488596 1127639123 /nfs/dbraw/zinc/63/91/23/1127639123.db2.gz RVMJOJRSDLWNFO-HKUYNNGSSA-N 1 0 297.398 3.747 20 10 CHCDRO CC(C)Oc1ccc(C[NH2+][C@H]2CCc3cccc(O)c32)cc1 ZINC000296004052 1127660163 /nfs/dbraw/zinc/66/01/63/1127660163.db2.gz OLBCVSGYGDMGMF-KRWDZBQOSA-N 1 0 297.398 3.957 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CCCc2ncccc2C)c(O)c1 ZINC000296486490 1127673162 /nfs/dbraw/zinc/67/31/62/1127673162.db2.gz OMRVHWYDYSXJCX-INIZCTEOSA-N 1 0 298.430 3.996 20 10 CHCDRO Cc1ncsc1CC[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000296636742 1127679206 /nfs/dbraw/zinc/67/92/06/1127679206.db2.gz XUSVCAWQYIGGFC-CYBMUJFWSA-N 1 0 290.432 3.667 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H](C)c2ccsc2)c1O ZINC000061360761 1127685864 /nfs/dbraw/zinc/68/58/64/1127685864.db2.gz OUSCFGNGKLZJSK-NSHDSACASA-N 1 0 277.389 3.703 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]C1(c3ccccc3)CC1)CC2 ZINC000297037384 1127688104 /nfs/dbraw/zinc/68/81/04/1127688104.db2.gz VCCSODSHBLVNAX-OAHLLOKOSA-N 1 0 265.356 3.658 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccccc1O ZINC000297311833 1127693026 /nfs/dbraw/zinc/69/30/26/1127693026.db2.gz MXZNIKJCZRXNCR-NWDGAFQWSA-N 1 0 286.331 3.712 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@@H]1CCc3cc(F)ccc31)CC2 ZINC000297619724 1127701740 /nfs/dbraw/zinc/70/17/40/1127701740.db2.gz IWTMLCBPFSNJGZ-HZPDHXFCSA-N 1 0 283.346 3.796 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@@H]1CCCOc3ccccc31)CC2 ZINC000297728169 1127705627 /nfs/dbraw/zinc/70/56/27/1127705627.db2.gz NMWDDQPQDXLONA-HZPDHXFCSA-N 1 0 295.382 3.883 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CC[C@@H](C)C1)c1cc(F)ccc1O ZINC000230413075 1127752097 /nfs/dbraw/zinc/75/20/97/1127752097.db2.gz WCRLUSGGDHFJDC-GRYCIOLGSA-N 1 0 251.345 3.618 20 10 CHCDRO CCC(CC)(C[NH2+][C@H](C)c1cc(OC)ccc1O)SC ZINC000230664766 1127771575 /nfs/dbraw/zinc/77/15/75/1127771575.db2.gz NHHAMZVJGQKXSI-GFCCVEGCSA-N 1 0 297.464 3.973 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H]2COc3c2cccc3Cl)c1O ZINC000373189930 1127827151 /nfs/dbraw/zinc/82/71/51/1127827151.db2.gz GUSZJLHQXUQEOB-CQSZACIVSA-N 1 0 289.762 3.577 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CCCc2cn[nH]c21)c1ccc(C)cc1O ZINC000373559706 1127848810 /nfs/dbraw/zinc/84/88/10/1127848810.db2.gz CPXRPEVAYCWMQT-HUUCEWRRSA-N 1 0 285.391 3.542 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+][C@H](C2CC2)C2CCC2)c1O ZINC000324994614 1127969625 /nfs/dbraw/zinc/96/96/25/1127969625.db2.gz XOSVKXXAEUJUBH-HNNXBMFYSA-N 1 0 295.810 3.723 20 10 CHCDRO C[C@H]1C[C@H]([NH2+]Cc2ccc3c(c2)CCCN3C)C[C@@H](C)C1 ZINC000252149251 1128110474 /nfs/dbraw/zinc/11/04/74/1128110474.db2.gz OJAVSFSPQRRJHZ-HWWDLCQESA-N 1 0 286.463 3.983 20 10 CHCDRO CCC[C@@H](CCO)C[NH2+][C@@H](C)c1ccc(N(C)CC)cc1 ZINC000152432168 1128124186 /nfs/dbraw/zinc/12/41/86/1128124186.db2.gz JFTFBUACDRMHOC-HOTGVXAUSA-N 1 0 292.467 3.592 20 10 CHCDRO c1cc(N2CCCCC2)ccc1C[N@@H+]1CCC[C@H]2C[C@H]21 ZINC001138220614 1128148049 /nfs/dbraw/zinc/14/80/49/1128148049.db2.gz IWDLKKYJJOYHDH-FUHWJXTLSA-N 1 0 270.420 3.661 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccccc1)c1ccc(N(C)C)cc1 ZINC000152956717 1128158975 /nfs/dbraw/zinc/15/89/75/1128158975.db2.gz YQIYZYLTUMWHFA-GOSISDBHSA-N 1 0 268.404 3.994 20 10 CHCDRO CC(C)[C@@H]1C[C@@H]([NH2+]Cc2ccc(N(C)C)c(F)c2)CS1 ZINC000754120420 1128196880 /nfs/dbraw/zinc/19/68/80/1128196880.db2.gz HVKMZNXGGMGXLV-CJNGLKHVSA-N 1 0 296.455 3.511 20 10 CHCDRO CC(C)[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1O)C1CC1 ZINC000324229947 1128160621 /nfs/dbraw/zinc/16/06/21/1128160621.db2.gz GXWMJOBWRWZBDS-ZUZCIYMTSA-N 1 0 251.345 3.617 20 10 CHCDRO CC(C)[C@H]([NH2+]Cc1cccc(Cl)c1[O-])C1CC1 ZINC000324318910 1128173396 /nfs/dbraw/zinc/17/33/96/1128173396.db2.gz XXULVCOYIALRQH-ZDUSSCGKSA-N 1 0 253.773 3.570 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H](c2ccccc2)C2CC2)cc1 ZINC000035053013 1128254272 /nfs/dbraw/zinc/25/42/72/1128254272.db2.gz JWWALOOTJMVBMQ-IBGZPJMESA-N 1 0 280.415 3.994 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H]2C[C@H]2C(F)(F)F)c(O)c1 ZINC000926948933 1128205119 /nfs/dbraw/zinc/20/51/19/1128205119.db2.gz LKVDUERFKPMKAU-SDDRHHMPSA-N 1 0 287.325 3.858 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCCC2(CCC2)O1)c1cc(F)ccc1O ZINC000927011919 1128207642 /nfs/dbraw/zinc/20/76/42/1128207642.db2.gz SGZDHWSSNYCBMO-JSGCOSHPSA-N 1 0 293.382 3.674 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCCc3cccnc32)c1 ZINC000927060368 1128212277 /nfs/dbraw/zinc/21/22/77/1128212277.db2.gz ASPFPMVBLCABBQ-CZUORRHYSA-N 1 0 282.387 3.824 20 10 CHCDRO Cc1cc(F)c(C[NH2+][C@H](C)c2cc(F)ccc2O)c(F)c1 ZINC000927093953 1128216873 /nfs/dbraw/zinc/21/68/73/1128216873.db2.gz OWKKRNLZVYNHPG-SNVBAGLBSA-N 1 0 295.304 3.969 20 10 CHCDRO Oc1cc2c(cc1C[N@H+](C1CC1)C1CCCC1)CCC2 ZINC000915208915 1128291628 /nfs/dbraw/zinc/29/16/28/1128291628.db2.gz RPDVZNGYTVJSRA-UHFFFAOYSA-N 1 0 271.404 3.788 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CC2(N(C)C)CCCCC2)c1 ZINC000035628738 1128319337 /nfs/dbraw/zinc/31/93/37/1128319337.db2.gz VSQNIJYHJDPLEF-HNNXBMFYSA-N 1 0 290.451 3.616 20 10 CHCDRO Cc1cc(C[NH+]2C[C@H](C)O[C@@H](C)C2)c(O)c(C(C)(C)C)c1 ZINC000915789551 1128339809 /nfs/dbraw/zinc/33/98/09/1128339809.db2.gz QQDCWDIWULHTBT-KBPBESRZSA-N 1 0 291.435 3.607 20 10 CHCDRO C[C@@H]1[N@H+](Cc2c(O)ccc3ccccc32)CCOC1(C)C ZINC000763204488 1128375701 /nfs/dbraw/zinc/37/57/01/1128375701.db2.gz KPOVTLAWKUMORN-ZDUSSCGKSA-N 1 0 285.387 3.545 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]Cc1ccc(F)c(F)c1 ZINC000036387991 1128415721 /nfs/dbraw/zinc/41/57/21/1128415721.db2.gz GBBMQZJZPRBPHH-UHFFFAOYSA-N 1 0 283.705 3.614 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+](C)Cc2cc(F)ccc2O)c1 ZINC000763378321 1128427601 /nfs/dbraw/zinc/42/76/01/1128427601.db2.gz AECWWEVLMKHEFA-UHFFFAOYSA-N 1 0 273.351 3.780 20 10 CHCDRO COc1ccc(O)c(C[N@H+](C)Cc2cc(C)ccc2C)c1 ZINC000763382509 1128430320 /nfs/dbraw/zinc/43/03/20/1128430320.db2.gz WKLYFSVHPNJTKR-UHFFFAOYSA-N 1 0 285.387 3.650 20 10 CHCDRO Cc1cc(C[NH2+][C@@H](c2ccncc2)C2CC2)ccc1N(C)C ZINC000934700340 1128466923 /nfs/dbraw/zinc/46/69/23/1128466923.db2.gz QEEFQSDLDCKYMC-LJQANCHMSA-N 1 0 295.430 3.697 20 10 CHCDRO CC(C)CC[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000917073965 1128473703 /nfs/dbraw/zinc/47/37/03/1128473703.db2.gz KEBHAGPQHJQKEB-UHFFFAOYSA-N 1 0 260.425 3.763 20 10 CHCDRO CCC1CC[NH+](Cc2cc3c(cc2O)CCC3)CC1 ZINC000917483168 1128501250 /nfs/dbraw/zinc/50/12/50/1128501250.db2.gz SFIGNFSBNXFMPB-UHFFFAOYSA-N 1 0 259.393 3.503 20 10 CHCDRO CC[NH2+]Cc1ccc(N(CC)Cc2ccccc2)cc1 ZINC000033440089 1128528063 /nfs/dbraw/zinc/52/80/63/1128528063.db2.gz FMYSYGDEIPQDNK-UHFFFAOYSA-N 1 0 268.404 3.823 20 10 CHCDRO CSCC[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000154744473 1128552690 /nfs/dbraw/zinc/55/26/90/1128552690.db2.gz BUGGVRBNBKGEGH-CYBMUJFWSA-N 1 0 296.455 3.830 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1C[C@@H](C)O[C@@H](C)C1 ZINC000556145732 1128554938 /nfs/dbraw/zinc/55/49/38/1128554938.db2.gz OXWLPSIQIDWMKX-AGGWBTHJSA-N 1 0 286.419 3.532 20 10 CHCDRO CCOc1cccc(C[NH2+]C[C@@H]2CCCC[C@@H]2C)c1O ZINC000042857210 1128587592 /nfs/dbraw/zinc/58/75/92/1128587592.db2.gz PYMOMRGWASGQAJ-KBPBESRZSA-N 1 0 277.408 3.707 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)cc1C ZINC000155397068 1128605626 /nfs/dbraw/zinc/60/56/26/1128605626.db2.gz YPRWRWQAXBLTHD-OAHLLOKOSA-N 1 0 298.430 3.920 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCc2ccco2)cc1 ZINC000155943467 1128620181 /nfs/dbraw/zinc/62/01/81/1128620181.db2.gz INMPURBXRXMNNG-CQSZACIVSA-N 1 0 272.392 3.629 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)CCc2ccc(F)cc2)cc1C ZINC000919948258 1128653313 /nfs/dbraw/zinc/65/33/13/1128653313.db2.gz HNIDDILCKPXAGP-UHFFFAOYSA-N 1 0 287.378 3.823 20 10 CHCDRO Cc1ccc(C[N@H+](Cc2cc(F)ccc2O)C2CC2)o1 ZINC000778995781 1128674873 /nfs/dbraw/zinc/67/48/73/1128674873.db2.gz INVPYWZSFGZMMF-UHFFFAOYSA-N 1 0 275.323 3.597 20 10 CHCDRO Cc1cc(Br)cc([C@H](C)[NH2+]C[C@@H]2C[C@H]2C)c1O ZINC000779008557 1128677192 /nfs/dbraw/zinc/67/71/92/1128677192.db2.gz RIEOPKAHLLHLJL-MIMYLULJSA-N 1 0 298.224 3.770 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@@H]2CCC(C)(C)O2)cc1 ZINC000779080192 1128723922 /nfs/dbraw/zinc/72/39/22/1128723922.db2.gz VBAQVCCTESSJIJ-PBHICJAKSA-N 1 0 290.451 3.751 20 10 CHCDRO CCC[C@@H]1CCCC[N@@H+]1Cc1cc(F)cc(C)c1O ZINC001238063549 1117766459 /nfs/dbraw/zinc/76/64/59/1117766459.db2.gz YKZYKOUJZOEFAS-OAHLLOKOSA-N 1 0 265.372 3.994 20 10 CHCDRO COCCCCC[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000185233208 1117793496 /nfs/dbraw/zinc/79/34/96/1117793496.db2.gz XTCPKDCMYVLZBZ-CQSZACIVSA-N 1 0 291.435 3.738 20 10 CHCDRO Cc1nc(C)c(CC[NH2+][C@H](C)c2cc(C)ccc2O)s1 ZINC000185402620 1117819256 /nfs/dbraw/zinc/81/92/56/1117819256.db2.gz JJKUTIKFGACUQU-LLVKDONJSA-N 1 0 290.432 3.667 20 10 CHCDRO CCO[C@@H]1C[C@@H]([NH2+][C@@H](C)c2cc(C)ccc2O)C12CCC2 ZINC000185551272 1117844102 /nfs/dbraw/zinc/84/41/02/1117844102.db2.gz MEUYGPXPIFYTHH-IAOVAPTHSA-N 1 0 289.419 3.699 20 10 CHCDRO c1ccc(C[NH2+]Cc2ccc(N3CCCCC3)cc2)cc1 ZINC000021510298 1117902464 /nfs/dbraw/zinc/90/24/64/1117902464.db2.gz UMRLLQWYQHBFOZ-UHFFFAOYSA-N 1 0 280.415 3.967 20 10 CHCDRO CO[C@H](C[NH2+][C@H](C)c1ccc(C)cc1O)C1CCCC1 ZINC000692981379 1117958527 /nfs/dbraw/zinc/95/85/27/1117958527.db2.gz UWAGZFCHNLELHQ-CXAGYDPISA-N 1 0 277.408 3.556 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2cccc(C)c2O)cc1 ZINC000179563859 1128748001 /nfs/dbraw/zinc/74/80/01/1128748001.db2.gz HDGPDJUEEXMTQL-UHFFFAOYSA-N 1 0 255.361 3.641 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)c2ccccc2)cc1C ZINC000035052571 1117991945 /nfs/dbraw/zinc/99/19/45/1117991945.db2.gz FLENQNQJJDNCLO-AWEZNQCLSA-N 1 0 255.361 3.854 20 10 CHCDRO Cc1cccc(C[N@@H+](C)[C@H](C)c2ccccc2)c1O ZINC000179596684 1128748764 /nfs/dbraw/zinc/74/87/64/1128748764.db2.gz FSDHSAJBDUMLGY-CQSZACIVSA-N 1 0 255.361 3.894 20 10 CHCDRO Cc1cccc(C[N@H+](Cc2ccc(C#N)cc2)C2CC2)c1O ZINC000179679017 1128753341 /nfs/dbraw/zinc/75/33/41/1128753341.db2.gz DQCZNXKCYLYCEP-UHFFFAOYSA-N 1 0 292.382 3.737 20 10 CHCDRO COc1cccc(C[N@H+](C)[C@@H](C)c2ccccc2)c1O ZINC000179701864 1128754793 /nfs/dbraw/zinc/75/47/93/1128754793.db2.gz NFENIQKITYFOOZ-ZDUSSCGKSA-N 1 0 271.360 3.594 20 10 CHCDRO Oc1cccc(Br)c1C[N@@H+]1CCCCC12CC2 ZINC001140103019 1118118245 /nfs/dbraw/zinc/11/82/45/1118118245.db2.gz DZIDBBBIMDXEGR-UHFFFAOYSA-N 1 0 296.208 3.673 20 10 CHCDRO COc1ccc([C@H](C)C[N@H+](C)Cc2ccccc2O)cc1 ZINC000179770473 1128758260 /nfs/dbraw/zinc/75/82/60/1128758260.db2.gz HWDBFWQDGIXADM-CQSZACIVSA-N 1 0 285.387 3.636 20 10 CHCDRO CC[C@H](C)N(C)CC[NH2+][C@@H](C)c1ccc(N(C)CC)cc1 ZINC000765653568 1118187793 /nfs/dbraw/zinc/18/77/93/1118187793.db2.gz BOCUDLJRWPBEGN-HOTGVXAUSA-N 1 0 291.483 3.524 20 10 CHCDRO COc1ccc(O)c(C[N@H+](C)CC2(c3ccccc3)CC2)c1 ZINC000188714552 1128763957 /nfs/dbraw/zinc/76/39/57/1128763957.db2.gz WKWKDOVSZOHGKW-UHFFFAOYSA-N 1 0 297.398 3.564 20 10 CHCDRO CNc1ccc(C)cc1C[NH2+]Cc1ccc(N(C)C)cc1C ZINC000902245050 1118290428 /nfs/dbraw/zinc/29/04/28/1118290428.db2.gz NQIAXSNRLMGUJI-UHFFFAOYSA-N 1 0 297.446 3.701 20 10 CHCDRO COc1ccc(C[N@H+](C)Cc2cccc(C)c2O)cc1C ZINC000179960122 1128768953 /nfs/dbraw/zinc/76/89/53/1128768953.db2.gz RMIMTTQDVFKVBV-UHFFFAOYSA-N 1 0 285.387 3.650 20 10 CHCDRO Cc1c(F)cccc1C[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC001204514115 1118334305 /nfs/dbraw/zinc/33/43/05/1118334305.db2.gz RKOKBKNQRILGBL-UHFFFAOYSA-N 1 0 286.394 3.832 20 10 CHCDRO Cc1cccc(CC[NH2+]Cc2c(O)cccc2Cl)c1 ZINC000083552328 1118356192 /nfs/dbraw/zinc/35/61/92/1118356192.db2.gz BYJHBVVRHLUKLY-UHFFFAOYSA-N 1 0 275.779 3.686 20 10 CHCDRO CCC(CC)[C@H](C[NH2+]Cc1c(O)cccc1Cl)N(C)C ZINC000083551807 1118356700 /nfs/dbraw/zinc/35/67/00/1118356700.db2.gz CXBKKVDQXSKUEC-HNNXBMFYSA-N 1 0 298.858 3.502 20 10 CHCDRO C[C@H]([NH2+][C@H]1CC(C)(C)OC1(C)C)c1ccc(N(C)C)cc1 ZINC000779175478 1128775191 /nfs/dbraw/zinc/77/51/91/1128775191.db2.gz IDKXZDQFJBWRET-BBRMVZONSA-N 1 0 290.451 3.749 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CC(C)(C)OC1(C)C)c1ccc(N(C)C)cc1 ZINC000779175479 1128774956 /nfs/dbraw/zinc/77/49/56/1128774956.db2.gz IDKXZDQFJBWRET-CJNGLKHVSA-N 1 0 290.451 3.749 20 10 CHCDRO C[N@@H+](Cc1ccc(Br)cc1O)C[C@H]1CC1(C)C ZINC001659739847 1118487625 /nfs/dbraw/zinc/48/76/25/1118487625.db2.gz UXNYDEXEIQOWCE-LLVKDONJSA-N 1 0 298.224 3.633 20 10 CHCDRO CC[C@@H](C)C[N@H+](CC)Cc1c(C)cc(OC)cc1O ZINC001663672565 1118521783 /nfs/dbraw/zinc/52/17/83/1118521783.db2.gz SYKMXEXBGFPZBV-GFCCVEGCSA-N 1 0 265.397 3.577 20 10 CHCDRO CCc1cccc(C[NH2+]CC2CCC(F)(F)CC2)c1O ZINC000693360952 1118561282 /nfs/dbraw/zinc/56/12/82/1118561282.db2.gz RXXWRWUFKLZHIZ-UHFFFAOYSA-N 1 0 283.362 3.870 20 10 CHCDRO C[C@H]1C[C@H]([NH2+]CCC(C)(F)F)c2c1c(F)ccc2O ZINC000834819166 1118572953 /nfs/dbraw/zinc/57/29/53/1118572953.db2.gz SZLJZAOYLOTSIG-WPRPVWTQSA-N 1 0 273.298 3.715 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](C)CC2(O)CCCCCC2)cc1C ZINC000779203715 1128786953 /nfs/dbraw/zinc/78/69/53/1128786953.db2.gz HVVOZMMIUQLWRT-UHFFFAOYSA-N 1 0 291.435 3.526 20 10 CHCDRO CCc1cccc(C[NH2+]C[C@@H]2CCCC23CC3)c1O ZINC000706978890 1118588913 /nfs/dbraw/zinc/58/89/13/1118588913.db2.gz KVZBHSCSBZSJFH-HNNXBMFYSA-N 1 0 259.393 3.625 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)[C@H](OC)C1CC1)c1ccc(N(C)C)cc1 ZINC000834904931 1118623263 /nfs/dbraw/zinc/62/32/63/1118623263.db2.gz QZXXHRZHPKDHIA-KKXDTOCCSA-N 1 0 290.451 3.607 20 10 CHCDRO CC[C@H]([NH2+]CCC[C@@H]1CCOC1)c1ccc(C)cc1O ZINC000834906436 1118623588 /nfs/dbraw/zinc/62/35/88/1118623588.db2.gz WTLASZNENKMOIV-ZBFHGGJFSA-N 1 0 277.408 3.558 20 10 CHCDRO C[C@@H]1[C@@H](C)[C@H](C)C[N@@H+]1Cc1c(O)cccc1Br ZINC000707138840 1118643413 /nfs/dbraw/zinc/64/34/13/1118643413.db2.gz IDDACCIGBWYJTL-OUAUKWLOSA-N 1 0 298.224 3.631 20 10 CHCDRO Oc1cc(Cl)ccc1CN1CCc2ccc(F)cc2C1 ZINC001140465627 1118742968 /nfs/dbraw/zinc/74/29/68/1118742968.db2.gz OLCXHQPOHCIGPZ-UHFFFAOYSA-N 1 0 291.753 3.743 20 10 CHCDRO Oc1cc(Cl)ccc1C[N@H+](Cc1ccco1)C1CC1 ZINC001140466137 1118745195 /nfs/dbraw/zinc/74/51/95/1118745195.db2.gz YLNHTZCFJNOQMR-UHFFFAOYSA-N 1 0 277.751 3.803 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1ccc(C)cc1O)[C@H]1CCCOC1 ZINC000723990759 1118797272 /nfs/dbraw/zinc/79/72/72/1118797272.db2.gz TYMHFOXNBRNMEA-DZKIICNBSA-N 1 0 277.408 3.556 20 10 CHCDRO CSC1(C[NH2+]C/C=C\c2ccc(N(C)C)cc2)CCC1 ZINC000835051057 1118829199 /nfs/dbraw/zinc/82/91/99/1118829199.db2.gz BBPLUSFTHBLHSU-XQRVVYSFSA-N 1 0 290.476 3.641 20 10 CHCDRO CCC(C)(C)OCC[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC000835085516 1118867419 /nfs/dbraw/zinc/86/74/19/1118867419.db2.gz WFXFBSAZJSGXCF-FPLPWBNLSA-N 1 0 290.451 3.561 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc3c(c2)CCO3)s1 ZINC000049161752 1119087150 /nfs/dbraw/zinc/08/71/50/1119087150.db2.gz MIWZJHDHXMBCIW-LBPRGKRZSA-N 1 0 273.401 3.842 20 10 CHCDRO C[C@@H]1CC[C@@H]([NH2+]Cc2cc(Cl)ccc2O)[C@@H](C)C1 ZINC000226160812 1119108135 /nfs/dbraw/zinc/10/81/35/1119108135.db2.gz BUQWTCVHMQURBA-UHIISALHSA-N 1 0 267.800 3.960 20 10 CHCDRO CC[C@H](C)[C@H](C)[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC000152833306 1119128736 /nfs/dbraw/zinc/12/87/36/1119128736.db2.gz PTEWYPZWJWXFSY-GJZGRUSLSA-N 1 0 290.451 3.688 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cnc(C)s1)c1ccc(N(C)C)cc1 ZINC000123704572 1119301421 /nfs/dbraw/zinc/30/14/21/1119301421.db2.gz RDTNNYAZHQVDCR-MRXNPFEDSA-N 1 0 289.448 3.758 20 10 CHCDRO CC[C@H]([NH2+]CCC1SCCS1)c1ccccc1O ZINC000693778087 1119333447 /nfs/dbraw/zinc/33/34/47/1119333447.db2.gz VDWXPGGXPZNMNX-LBPRGKRZSA-N 1 0 283.462 3.629 20 10 CHCDRO Cc1cnc(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)s1 ZINC000230664075 1119413414 /nfs/dbraw/zinc/41/34/14/1119413414.db2.gz VEOXKQXTQDYYJK-JQWIXIFHSA-N 1 0 288.416 3.804 20 10 CHCDRO CC[C@H](C)C[C@@H](C)[NH2+]Cc1cc(F)cc(F)c1[O-] ZINC000708445613 1119466867 /nfs/dbraw/zinc/46/68/67/1119466867.db2.gz VGKSUFSGOKCUEZ-VHSXEESVSA-N 1 0 257.324 3.585 20 10 CHCDRO Cc1ccncc1C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000318079309 1119478231 /nfs/dbraw/zinc/47/82/31/1119478231.db2.gz PSCIXVJKEUTFHY-UHFFFAOYSA-N 1 0 295.430 3.670 20 10 CHCDRO CSC[C@@H](C)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000168786861 1119478334 /nfs/dbraw/zinc/47/83/34/1119478334.db2.gz NRIBYLOGNHYPPK-VXGBXAGGSA-N 1 0 275.417 3.948 20 10 CHCDRO CCSCC[C@H](C)[NH2+][C@@H](C)c1cc(OC)ccc1O ZINC000168808174 1119478870 /nfs/dbraw/zinc/47/88/70/1119478870.db2.gz VPBHBRJHDNBSSD-RYUDHWBXSA-N 1 0 283.437 3.583 20 10 CHCDRO C[C@@H]1CSCC[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000179661643 1119755953 /nfs/dbraw/zinc/75/59/53/1119755953.db2.gz MPKIKNMGENUVIZ-OAHLLOKOSA-N 1 0 290.476 3.614 20 10 CHCDRO CC[C@@H](C)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000725841702 1119766825 /nfs/dbraw/zinc/76/68/25/1119766825.db2.gz WHUBQGXLRGZUGF-CYBMUJFWSA-N 1 0 255.361 3.947 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc2c(cc1O)OCO2)C1CCCCC1 ZINC000052336178 1119814746 /nfs/dbraw/zinc/81/47/46/1119814746.db2.gz BLOHYNZCGIXXNV-CQSZACIVSA-N 1 0 291.391 3.569 20 10 CHCDRO CC[C@H](C[NH2+]Cc1cccc(OC)c1O)c1ccccc1 ZINC000725847944 1119836525 /nfs/dbraw/zinc/83/65/25/1119836525.db2.gz KHORHTGVAYGAQJ-CQSZACIVSA-N 1 0 285.387 3.684 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCC[C@H]2C[C@H]21)c1cc(F)ccc1O ZINC000694376814 1119891244 /nfs/dbraw/zinc/89/12/44/1119891244.db2.gz SGYNBUWCOUCRSC-JUFZMCDQSA-N 1 0 263.356 3.618 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)CCc2ccccn2)cc1 ZINC000177999454 1119897877 /nfs/dbraw/zinc/89/78/77/1119897877.db2.gz XNAAEWKWWRBLRU-UHFFFAOYSA-N 1 0 297.446 3.602 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccnn1C1CCC1 ZINC000924573915 1119908648 /nfs/dbraw/zinc/90/86/48/1119908648.db2.gz LHGDDTOYWBRXDV-AWEZNQCLSA-N 1 0 298.434 3.525 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)c1cscn1 ZINC000850512207 1119964028 /nfs/dbraw/zinc/96/40/28/1119964028.db2.gz YGEJJQOOLYLYMB-DTWKUNHWSA-N 1 0 282.796 3.914 20 10 CHCDRO CC[C@H](C)[NH2+][C@@H](C)c1cc(Br)cc(C)c1O ZINC000309409032 1119993886 /nfs/dbraw/zinc/99/38/86/1119993886.db2.gz BKIJVLIYXKGCHA-UWVGGRQHSA-N 1 0 286.213 3.912 20 10 CHCDRO Cc1cc(Br)cc([C@H](C)[NH2+]C2CCC2)c1O ZINC000309466040 1120062650 /nfs/dbraw/zinc/06/26/50/1120062650.db2.gz PXDFRMIZDGLEKO-VIFPVBQESA-N 1 0 284.197 3.666 20 10 CHCDRO CC(C)n1cc2c(n1)[C@H]([NH2+][C@H](C)c1ccccc1O)CCC2 ZINC000765817431 1120063107 /nfs/dbraw/zinc/06/31/07/1120063107.db2.gz LIDYMJYNTBQFKJ-CZUORRHYSA-N 1 0 299.418 3.898 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C(C)(C)C)c(C(F)(F)F)c1 ZINC000167344532 1120079835 /nfs/dbraw/zinc/07/98/35/1120079835.db2.gz BBTPMVREPZWNIV-UHFFFAOYSA-N 1 0 274.330 3.660 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CC3CCC2CC3)c(O)c1 ZINC000311858330 1120113249 /nfs/dbraw/zinc/11/32/49/1120113249.db2.gz JZWCFEQPSUPJAP-WLIAPVHPSA-N 1 0 259.393 3.930 20 10 CHCDRO C[C@H]1CCCC[N@@H+]1Cc1ccc(N2CCCC2)cc1 ZINC001116438856 1120118851 /nfs/dbraw/zinc/11/88/51/1120118851.db2.gz RPJMEZLRRZWCGW-HNNXBMFYSA-N 1 0 258.409 3.661 20 10 CHCDRO CC(C)OCCC[N@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000728688080 1120140386 /nfs/dbraw/zinc/14/03/86/1120140386.db2.gz DXWJQRNFQUOPQF-UHFFFAOYSA-N 1 0 292.467 3.778 20 10 CHCDRO COc1cc(O)c(C[NH+]2C[C@@H](C)C[C@H](C)C2)c(Cl)c1 ZINC001236804803 1128895817 /nfs/dbraw/zinc/89/58/17/1128895817.db2.gz ZXSNNIKFLKEUKA-QWRGUYRKSA-N 1 0 283.799 3.532 20 10 CHCDRO CCCCOCCC[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000756340250 1120231591 /nfs/dbraw/zinc/23/15/91/1120231591.db2.gz IPHMIDSTKGFPSK-GXTWGEPZSA-N 1 0 295.398 3.876 20 10 CHCDRO CC[C@H](C)[C@](C)(O)C[NH2+][C@@H](C)c1ccc(N(C)CC)cc1 ZINC000765945625 1120239474 /nfs/dbraw/zinc/23/94/74/1120239474.db2.gz LBCATBONRZWXET-RLFYNMQTSA-N 1 0 292.467 3.590 20 10 CHCDRO Oc1ccccc1C[NH+]1CCC(c2ccccc2)CC1 ZINC000179555524 1120249366 /nfs/dbraw/zinc/24/93/66/1120249366.db2.gz ZWDGHTKOZJJLNT-UHFFFAOYSA-N 1 0 267.372 3.772 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CC[C@@H]1C)c1ccc2ccccc2c1O ZINC000312026336 1120254954 /nfs/dbraw/zinc/25/49/54/1120254954.db2.gz XMGBFAVMFDTXIU-MQIPJXDCSA-N 1 0 255.361 3.995 20 10 CHCDRO COc1cccc(CCC[NH2+][C@@H](C)c2ccccc2O)c1 ZINC000179875733 1120256309 /nfs/dbraw/zinc/25/63/09/1120256309.db2.gz GFUHOAWIPYLHTA-AWEZNQCLSA-N 1 0 285.387 3.684 20 10 CHCDRO CCC[C@H](C)C[NH2+]Cc1cc(Br)ccc1O ZINC000309875879 1120273213 /nfs/dbraw/zinc/27/32/13/1120273213.db2.gz SPZJFENVXTXVDM-JTQLQIEISA-N 1 0 286.213 3.681 20 10 CHCDRO CC(C)=CC[NH2+]Cc1cc(Br)cc(C)c1O ZINC000309354585 1120281723 /nfs/dbraw/zinc/28/17/23/1120281723.db2.gz NOCBBWWFVCNJEW-UHFFFAOYSA-N 1 0 284.197 3.519 20 10 CHCDRO CCC[N@H+](Cc1sc(C)nc1C)Cc1ccccc1O ZINC000172772878 1120284626 /nfs/dbraw/zinc/28/46/26/1120284626.db2.gz YVJIDYPLMANGSG-UHFFFAOYSA-N 1 0 290.432 3.878 20 10 CHCDRO CSCCCCCC[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000312099990 1120294880 /nfs/dbraw/zinc/29/48/80/1120294880.db2.gz UBDFUPNESYLWLK-CQSZACIVSA-N 1 0 279.449 3.893 20 10 CHCDRO C[C@H](C[NH2+][C@H](C)c1ccccc1O)N(C)c1ccccc1 ZINC000183419240 1120341218 /nfs/dbraw/zinc/34/12/18/1120341218.db2.gz DOZBMEWVSPJCRK-HUUCEWRRSA-N 1 0 284.403 3.568 20 10 CHCDRO CCCC[N@H+](Cc1cncc(F)c1)Cc1ccccc1O ZINC000282326502 1120353440 /nfs/dbraw/zinc/35/34/40/1120353440.db2.gz ANZZWTSSLJDSIM-UHFFFAOYSA-N 1 0 288.366 3.729 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1c(C)noc1C)c1ccccc1O ZINC000092327882 1120356828 /nfs/dbraw/zinc/35/68/28/1120356828.db2.gz MXXMWIQLBNGNBV-QMTHXVAHSA-N 1 0 274.364 3.799 20 10 CHCDRO CCO[C@H](CC[NH2+][C@H](C)c1cc(F)ccc1O)C(C)C ZINC000185625842 1120380726 /nfs/dbraw/zinc/38/07/26/1120380726.db2.gz VAZNXVKRZLNBOH-MLGOLLRUSA-N 1 0 283.387 3.633 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCc3cccc(C)c3C2)c1 ZINC000763501914 1128913015 /nfs/dbraw/zinc/91/30/15/1128913015.db2.gz GJFGFBBJUKQDAN-UHFFFAOYSA-N 1 0 267.372 3.567 20 10 CHCDRO Cc1csc(C[NH2+]Cc2ccc3c(c2)CCCO3)c1 ZINC000922160650 1120399679 /nfs/dbraw/zinc/39/96/79/1120399679.db2.gz XOFVMBWSVHGVKG-UHFFFAOYSA-N 1 0 273.401 3.671 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H](C)c2ccccn2)c1 ZINC000692689423 1120488500 /nfs/dbraw/zinc/48/85/00/1120488500.db2.gz GAFSRQYFOLSKLJ-KBPBESRZSA-N 1 0 270.376 3.550 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)C[C@@H](C)O2)c1ccccc1O ZINC000922328645 1120514037 /nfs/dbraw/zinc/51/40/37/1120514037.db2.gz GRGJYJXEQIIEHO-CHWSQXEVSA-N 1 0 283.371 3.566 20 10 CHCDRO C[C@H]([NH2+]Cc1cn(C)nc1C1CCCC1)c1ccccc1O ZINC000922329193 1120514407 /nfs/dbraw/zinc/51/44/07/1120514407.db2.gz LOXNHNLUDZFOKU-ZDUSSCGKSA-N 1 0 299.418 3.634 20 10 CHCDRO Cc1cc(C[N@H+]2C[C@@H](C)OC[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC000220294358 1120552330 /nfs/dbraw/zinc/55/23/30/1120552330.db2.gz GUGHSWIFABWSIF-UONOGXRCSA-N 1 0 291.435 3.607 20 10 CHCDRO COc1cccc(C[NH2+][C@H](C)c2ccc(F)cc2C)c1O ZINC000922665871 1120575501 /nfs/dbraw/zinc/57/55/01/1120575501.db2.gz SYEBTFQOXJJCMT-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO CSC1(C[NH2+][C@H](C)c2cc(C)ccc2O)CCC1 ZINC000193812765 1120583513 /nfs/dbraw/zinc/58/35/13/1120583513.db2.gz LMSSGHTYHWHRPD-GFCCVEGCSA-N 1 0 265.422 3.637 20 10 CHCDRO CC(C)OCC[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000186640743 1120630542 /nfs/dbraw/zinc/63/05/42/1120630542.db2.gz RZQKYPXUFMZELA-INIZCTEOSA-N 1 0 290.451 3.753 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@]2(C)CCCC[C@@H]2O)c(O)c1C ZINC000756639427 1120648319 /nfs/dbraw/zinc/64/83/19/1120648319.db2.gz YQNKRTOBSSMZDV-ZVZYQTTQSA-N 1 0 291.435 3.601 20 10 CHCDRO CC[N@H+](Cc1ccccc1)Cc1cc(C)cc(OC)c1O ZINC000125511055 1120790518 /nfs/dbraw/zinc/79/05/18/1120790518.db2.gz UWNCCYSDZKRTNC-UHFFFAOYSA-N 1 0 285.387 3.731 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]Cc2ccc(C)o2)cc1F ZINC000066906397 1120812369 /nfs/dbraw/zinc/81/23/69/1120812369.db2.gz WWOMIHLZWCJVBG-UHFFFAOYSA-N 1 0 290.382 3.863 20 10 CHCDRO COc1cccc(CC[NH2+][C@@H](C)c2cc(C)ccc2O)c1 ZINC000185040325 1120908688 /nfs/dbraw/zinc/90/86/88/1120908688.db2.gz NDQJIYQCXWCAOM-AWEZNQCLSA-N 1 0 285.387 3.603 20 10 CHCDRO CC(C)c1ccc(C[N@@H+]2CC[C@@H](C)[C@H](F)C2)c(O)c1 ZINC001237045316 1128952641 /nfs/dbraw/zinc/95/26/41/1128952641.db2.gz ITHQGSSJNZMEDU-IUODEOHRSA-N 1 0 265.372 3.696 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2C[C@H](c3ccccc3)[C@H]2C)c(O)c1 ZINC000763517891 1128960718 /nfs/dbraw/zinc/96/07/18/1128960718.db2.gz JUBRULBOYPIDJX-JEBQAFNWSA-N 1 0 297.398 3.683 20 10 CHCDRO CC(C)N(C)CC[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000054110884 1121119352 /nfs/dbraw/zinc/11/93/52/1121119352.db2.gz HUXXKNRFSWXDKH-CQSZACIVSA-N 1 0 286.419 3.536 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CCC2(F)CCC2)cc1 ZINC000702440100 1121201977 /nfs/dbraw/zinc/20/19/77/1121201977.db2.gz OJXXHWGHOXSYJE-UHFFFAOYSA-N 1 0 278.415 3.905 20 10 CHCDRO CCCC(O)(CCC)C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000766091495 1121219897 /nfs/dbraw/zinc/21/98/97/1121219897.db2.gz BBYWUYYDHDUGCA-HNNXBMFYSA-N 1 0 292.467 3.735 20 10 CHCDRO Cc1cc(F)ccc1CC[NH2+]Cc1c(O)cccc1Cl ZINC000095015916 1121250583 /nfs/dbraw/zinc/25/05/83/1121250583.db2.gz OGKNUUGOYPOXIT-UHFFFAOYSA-N 1 0 293.769 3.825 20 10 CHCDRO c1cc(N2CCCCC2)ccc1C[NH2+][C@H]1C[C@H]2C[C@H]2C1 ZINC001167897280 1121258734 /nfs/dbraw/zinc/25/87/34/1121258734.db2.gz JWDQFQYNFBNVLN-FVQHAEBGSA-N 1 0 270.420 3.565 20 10 CHCDRO Cc1ccc(CCC[NH2+][C@H](C)c2ccccc2O)cc1 ZINC001175418768 1121317347 /nfs/dbraw/zinc/31/73/47/1121317347.db2.gz NWOVLZDUWSAGAK-OAHLLOKOSA-N 1 0 269.388 3.984 20 10 CHCDRO CC[C@H](C)[NH2+]Cc1ccc(N(CC)CC)c(F)c1 ZINC000237001247 1121370435 /nfs/dbraw/zinc/37/04/35/1121370435.db2.gz MTUCMEOSPZQXPU-LBPRGKRZSA-N 1 0 252.377 3.560 20 10 CHCDRO [O-]c1cccc(F)c1C[N@@H+]1CC[C@H](C2CCCCC2)C1 ZINC001137838877 1121423904 /nfs/dbraw/zinc/42/39/04/1121423904.db2.gz MBPOFSUOMGLFLI-AWEZNQCLSA-N 1 0 277.383 3.934 20 10 CHCDRO Oc1cccc(Br)c1C[NH2+]C1CC2(CCC2)C1 ZINC000706841931 1121443701 /nfs/dbraw/zinc/44/37/01/1121443701.db2.gz FFIDTKJEHHBQAL-UHFFFAOYSA-N 1 0 296.208 3.577 20 10 CHCDRO CCOc1cccc(C[NH2+]Cc2ccc(C)c(F)c2)c1O ZINC000236946059 1121501515 /nfs/dbraw/zinc/50/15/15/1121501515.db2.gz CXVGPLCOAFYDDF-UHFFFAOYSA-N 1 0 289.350 3.528 20 10 CHCDRO CCC[C@H](Cc1ccccc1)[NH2+]Cc1cccc(OC)c1O ZINC000237033220 1121647147 /nfs/dbraw/zinc/64/71/47/1121647147.db2.gz BCUGXEXNVAJELI-QGZVFWFLSA-N 1 0 299.414 3.902 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]Cc2ccc(C)c(F)c2)c1 ZINC000237050111 1121694219 /nfs/dbraw/zinc/69/42/19/1121694219.db2.gz ZXGZSCASZJMZJL-UHFFFAOYSA-N 1 0 289.350 3.528 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C[C@H](C)SC)cc1F ZINC001178276443 1121776497 /nfs/dbraw/zinc/77/64/97/1121776497.db2.gz RQVCPVBLTLZPMC-LBPRGKRZSA-N 1 0 284.444 3.513 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CCOc3ccccc3C2)cc1 ZINC000773746614 1121790326 /nfs/dbraw/zinc/79/03/26/1121790326.db2.gz MPVBIPCLHARETH-UHFFFAOYSA-N 1 0 296.414 3.537 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CCC[C@@H]2c2ccccn2)cc1 ZINC000773757509 1121799880 /nfs/dbraw/zinc/79/98/80/1121799880.db2.gz ZQVWXZJHJCCZHR-LJQANCHMSA-N 1 0 295.430 3.875 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C[C@@H]2C(C)(C)C2(F)F)cc1 ZINC001179228221 1121861829 /nfs/dbraw/zinc/86/18/29/1121861829.db2.gz FMGHDNAAULZMSR-OAHLLOKOSA-N 1 0 296.405 3.914 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C2CCCC2)cc1F ZINC000731360369 1121863966 /nfs/dbraw/zinc/86/39/66/1121863966.db2.gz FDRUNTGYUKCLKO-UHFFFAOYSA-N 1 0 264.388 3.704 20 10 CHCDRO CC[C@@H](CSC)[N@H+](C)Cc1ccc(N(C)CC)cc1 ZINC000773816288 1121883652 /nfs/dbraw/zinc/88/36/52/1121883652.db2.gz FQBJAPUKGIKOSN-HNNXBMFYSA-N 1 0 280.481 3.716 20 10 CHCDRO COc1ccc(C[NH2+]Cc2ccc3c(c2)C[C@@H](C)O3)cc1C ZINC001179536824 1121884650 /nfs/dbraw/zinc/88/46/50/1121884650.db2.gz ACKAVUCHQXMEDT-CQSZACIVSA-N 1 0 297.398 3.617 20 10 CHCDRO C[C@@H]1C[C@@H]1[C@H]1C[C@@H]1C[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001179592860 1121892221 /nfs/dbraw/zinc/89/22/21/1121892221.db2.gz JIJWHYPOCZDEFH-JZGRTCEGSA-N 1 0 284.447 3.669 20 10 CHCDRO Oc1ccccc1C[N@H+](CC1CCCC1)C[C@@H]1CCCO1 ZINC000732203446 1121912130 /nfs/dbraw/zinc/91/21/30/1121912130.db2.gz VANJDGUKSZRQQM-KRWDZBQOSA-N 1 0 289.419 3.563 20 10 CHCDRO COc1cc(C)cc(C[NH2+][C@H]2CCc3ccc(C)cc32)c1O ZINC000894241445 1121912775 /nfs/dbraw/zinc/91/27/75/1121912775.db2.gz ZWMARPPEZZKEMH-KRWDZBQOSA-N 1 0 297.398 3.795 20 10 CHCDRO CNc1ccc(C)cc1C[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001179845867 1121917025 /nfs/dbraw/zinc/91/70/25/1121917025.db2.gz YQNJLSSFUJPWOI-UHFFFAOYSA-N 1 0 297.446 3.735 20 10 CHCDRO CC[C@@H](C)[C@H](O)C[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000732820616 1121940704 /nfs/dbraw/zinc/94/07/04/1121940704.db2.gz NDLZZIIQMBQPGJ-AUUYWEPGSA-N 1 0 299.414 3.556 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)cc1C)[C@@H](C)C(C)C ZINC001180042768 1121941867 /nfs/dbraw/zinc/94/18/67/1121941867.db2.gz JDACAKCUGZWQJN-HNNXBMFYSA-N 1 0 262.441 3.927 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2nccc3ccccc32)c1 ZINC000733325604 1121976071 /nfs/dbraw/zinc/97/60/71/1121976071.db2.gz MRJKBBRBLPNTMQ-UHFFFAOYSA-N 1 0 278.355 3.539 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2ccc([C@@H]3C[C@@H]3C)o2)c1 ZINC000733325033 1121976449 /nfs/dbraw/zinc/97/64/49/1121976449.db2.gz SUDMBULWKYJXMY-SWLSCSKDSA-N 1 0 271.360 3.707 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2cccc(OC(C)C)c2)c1 ZINC000733324912 1121976462 /nfs/dbraw/zinc/97/64/62/1121976462.db2.gz KAFHRMHOTSVRSZ-UHFFFAOYSA-N 1 0 285.387 3.778 20 10 CHCDRO CC[C@H](Cc1ccccc1)[NH2+]Cc1cc(C)ccc1O ZINC000733327010 1121977219 /nfs/dbraw/zinc/97/72/19/1121977219.db2.gz KKKXUHPUKQLSGE-QGZVFWFLSA-N 1 0 269.388 3.812 20 10 CHCDRO CC1(c2ccccc2)CC([NH2+]Cc2ccc3c(c2)CCO3)C1 ZINC000733326576 1121977799 /nfs/dbraw/zinc/97/77/99/1121977799.db2.gz MMAWOONGYUQKMY-UHFFFAOYSA-N 1 0 293.410 3.831 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C2CC(c3ccc(F)cc3)C2)c1 ZINC000733328412 1121978402 /nfs/dbraw/zinc/97/84/02/1121978402.db2.gz UFTIJNWWCFEIDJ-UHFFFAOYSA-N 1 0 285.362 3.876 20 10 CHCDRO CCOc1ccc(C[N@H+](C)Cc2cccc(CC)c2O)cc1 ZINC001180488384 1121991676 /nfs/dbraw/zinc/99/16/76/1121991676.db2.gz LABWCEVCLNVBLI-UHFFFAOYSA-N 1 0 299.414 3.985 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCCC(C)(C)C1 ZINC001180896217 1122023604 /nfs/dbraw/zinc/02/36/04/1122023604.db2.gz CFFCCMLOLDXXMK-UHFFFAOYSA-N 1 0 260.425 3.683 20 10 CHCDRO CC[C@H]1[C@@H](C)CC[N@@H+]1Cc1ccc(Cl)cc1O ZINC001181102182 1122033472 /nfs/dbraw/zinc/03/34/72/1122033472.db2.gz JNAVLPFLUDFZJQ-GWCFXTLKSA-N 1 0 253.773 3.666 20 10 CHCDRO CCCN(Cc1ccc(C)cc1O)c1ccc(C[NH3+])cc1 ZINC001181445571 1122055935 /nfs/dbraw/zinc/05/59/35/1122055935.db2.gz QFDWJHVQOFPBRU-UHFFFAOYSA-N 1 0 284.403 3.576 20 10 CHCDRO CCCC[C@@H]([NH2+]Cc1cc(F)ccc1O)C1CCC1 ZINC001181534273 1122062304 /nfs/dbraw/zinc/06/23/04/1122062304.db2.gz IHGSVLVJBLAZAB-OAHLLOKOSA-N 1 0 265.372 3.980 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CC[C@@H](C)C3(CCC3)C2)c1 ZINC000779604442 1129031823 /nfs/dbraw/zinc/03/18/23/1129031823.db2.gz LQDZIBGXSRYYFZ-CQSZACIVSA-N 1 0 289.419 3.803 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1O)c1ccccc1[N+](=O)[O-] ZINC000271700417 1122171707 /nfs/dbraw/zinc/17/17/07/1122171707.db2.gz TZFIFKJABZNANC-NEPJUHHUSA-N 1 0 286.331 3.712 20 10 CHCDRO COCC[C@H]([NH2+][C@@H](C)c1ccccc1O)c1ccc(C)o1 ZINC000272812080 1122213777 /nfs/dbraw/zinc/21/37/77/1122213777.db2.gz DGYZMDKKFMGFAW-ZFWWWQNUSA-N 1 0 289.375 3.722 20 10 CHCDRO CSCc1ccc(C[N@@H+]2Cc3cccc(O)c3C2)cc1 ZINC001183455228 1122223958 /nfs/dbraw/zinc/22/39/58/1122223958.db2.gz RIGUITSCCVBMMC-UHFFFAOYSA-N 1 0 285.412 3.771 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC2([C@@H](C)CCO)CCC2)c(O)c1 ZINC000273347157 1122228903 /nfs/dbraw/zinc/22/89/03/1122228903.db2.gz AZWJHQLDCYWWAX-GJZGRUSLSA-N 1 0 291.435 3.540 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC2CCSCC2)c(O)c1C ZINC000273368734 1122230329 /nfs/dbraw/zinc/23/03/29/1122230329.db2.gz BXBWNKQRZGZPAF-ZDUSSCGKSA-N 1 0 279.449 3.803 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2cccnc2)c(O)c1C ZINC000273412845 1122231481 /nfs/dbraw/zinc/23/14/81/1122231481.db2.gz QEENPNDNHXCAHI-UONOGXRCSA-N 1 0 270.376 3.816 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC[C@@H]2CCO[C@H](C)C2)c(O)c1C ZINC000273402684 1122231515 /nfs/dbraw/zinc/23/15/15/1122231515.db2.gz GQAHHJTYNIYUKP-VNQPRFMTSA-N 1 0 291.435 3.865 20 10 CHCDRO Cc1cccc([C@H](O)C[NH2+][C@H](C)c2ccc(C)c(C)c2O)c1 ZINC000273455195 1122234159 /nfs/dbraw/zinc/23/41/59/1122234159.db2.gz GXCKKTZAUJJIIO-CRAIPNDOSA-N 1 0 299.414 3.702 20 10 CHCDRO COc1cc(Cl)cc(C[N@H+](C)Cc2cccs2)c1O ZINC000273715847 1122245587 /nfs/dbraw/zinc/24/55/87/1122245587.db2.gz HENNZWFNNHTCBW-UHFFFAOYSA-N 1 0 297.807 3.748 20 10 CHCDRO CCC(CC)(CC)C[NH2+]Cc1c([O-])cccc1F ZINC001183918608 1122248409 /nfs/dbraw/zinc/24/84/09/1122248409.db2.gz ABJWDIMIWVTJKZ-UHFFFAOYSA-N 1 0 253.361 3.837 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(C#N)cc1F)c1ccccc1O ZINC000183322012 1129044939 /nfs/dbraw/zinc/04/49/39/1129044939.db2.gz HWQSOBIPDJTDBR-INIZCTEOSA-N 1 0 284.334 3.644 20 10 CHCDRO C[N@H+](Cc1ccco1)Cc1ccc(N2CCCC2)cc1 ZINC001203278094 1122424466 /nfs/dbraw/zinc/42/44/66/1122424466.db2.gz ADRAKLCMTPEXDW-UHFFFAOYSA-N 1 0 270.376 3.512 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCc2ccc(F)cc21)c1ccccc1O ZINC000775134967 1122437478 /nfs/dbraw/zinc/43/74/78/1122437478.db2.gz AOTAINRWJVEADA-BZNIZROVSA-N 1 0 271.335 3.869 20 10 CHCDRO C[C@@H](C[NH2+][C@@H](C)c1ccccc1O)Oc1cccc(F)c1 ZINC000183534220 1129060903 /nfs/dbraw/zinc/06/09/03/1129060903.db2.gz LWTQICHZPWXJGK-STQMWFEESA-N 1 0 289.350 3.649 20 10 CHCDRO C[C@H]([NH2+]CCc1cc(F)ccc1F)c1ccccc1O ZINC000183541842 1129062110 /nfs/dbraw/zinc/06/21/10/1129062110.db2.gz LAMXQBJHIFMULZ-NSHDSACASA-N 1 0 277.314 3.564 20 10 CHCDRO Cc1cc(C[N@H+]2CC[C@H](CC(C)C)C2)ccc1N(C)C ZINC001191344729 1122591610 /nfs/dbraw/zinc/59/16/10/1122591610.db2.gz ZYGPTYIMNLCNNF-QGZVFWFLSA-N 1 0 274.452 3.929 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](C)N1CCC[C@H](C)C1)c1ccccc1O ZINC000775486517 1122616108 /nfs/dbraw/zinc/61/61/08/1122616108.db2.gz COAMLESNKKFORQ-UXLLHSPISA-N 1 0 290.451 3.553 20 10 CHCDRO CC[C@H]([NH2+]CCN1CCCCC1)c1cc(Cl)ccc1O ZINC000775486887 1122616782 /nfs/dbraw/zinc/61/67/82/1122616782.db2.gz JANRDMBLZKETKV-HNNXBMFYSA-N 1 0 296.842 3.572 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](OC)C(C)C)c1cc(Cl)ccc1O ZINC000775512060 1122633881 /nfs/dbraw/zinc/63/38/81/1122633881.db2.gz JVUDSRXNTLBBPB-UKRRQHHQSA-N 1 0 285.815 3.757 20 10 CHCDRO CC[C@@H]([NH2+]Cc1nc2cc(C)ccc2[nH]1)c1ccccc1O ZINC000775512389 1122635047 /nfs/dbraw/zinc/63/50/47/1122635047.db2.gz KGPGMBUSNYIIPN-CQSZACIVSA-N 1 0 295.386 3.818 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(OC)cc1C)c1ccccc1O ZINC000775522451 1122639268 /nfs/dbraw/zinc/63/92/68/1122639268.db2.gz PSBNUMCNEJEHTR-KRWDZBQOSA-N 1 0 285.387 3.950 20 10 CHCDRO CC[C@@H]([NH2+]CCC1CC1)c1cc(Cl)ccc1O ZINC000775525221 1122641918 /nfs/dbraw/zinc/64/19/18/1122641918.db2.gz FBRJDQNCOJVNMG-CYBMUJFWSA-N 1 0 253.773 3.886 20 10 CHCDRO CC[C@@H]([NH2+][C@H](COC)C1CC1)c1cc(Cl)ccc1O ZINC000775524607 1122642786 /nfs/dbraw/zinc/64/27/86/1122642786.db2.gz SUMNAYVHOBBEDA-ZIAGYGMSSA-N 1 0 283.799 3.511 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCO[C@H](C)C1)c1cc(Cl)ccc1O ZINC000775525735 1122645848 /nfs/dbraw/zinc/64/58/48/1122645848.db2.gz MWAFNMBVTKQVQQ-OSMZGAPFSA-N 1 0 283.799 3.654 20 10 CHCDRO CC[C@@H](Nc1cnn(-c2cc[nH+]cc2)c1)c1ccccc1O ZINC000775542513 1122655756 /nfs/dbraw/zinc/65/57/56/1122655756.db2.gz PWBDELBSTLHKPO-MRXNPFEDSA-N 1 0 294.358 3.536 20 10 CHCDRO CC[C@H]1CCC[C@H]1[NH2+]Cc1ccc(N(C)C)c(C)c1 ZINC001193402165 1122688469 /nfs/dbraw/zinc/68/84/69/1122688469.db2.gz QSAGDEJYOSLROK-JKSUJKDBSA-N 1 0 260.425 3.729 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1nc(C)cs1)c1ccccc1O ZINC000080274513 1129079729 /nfs/dbraw/zinc/07/97/29/1129079729.db2.gz KQAWFOGNMUGMMF-WCQYABFASA-N 1 0 276.405 3.959 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+](C)Cc2ccccc2)c1O ZINC000775634713 1122840413 /nfs/dbraw/zinc/84/04/13/1122840413.db2.gz VLBMQKSHXXNODN-UHFFFAOYSA-N 1 0 275.779 3.986 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+](C)C2CCCC2)c1O ZINC000775644256 1122851806 /nfs/dbraw/zinc/85/18/06/1122851806.db2.gz CFDRWPRFJCFNEG-UHFFFAOYSA-N 1 0 253.773 3.728 20 10 CHCDRO C[C@H]([NH2+]CC(C)(C)c1ccccn1)c1ccc(N(C)C)cc1 ZINC000834857056 1122855057 /nfs/dbraw/zinc/85/50/57/1122855057.db2.gz YMHIVWHLWFUVCV-HNNXBMFYSA-N 1 0 297.446 3.776 20 10 CHCDRO Cc1cccc(C[N@H+](Cc2ccccc2)C2CC2)c1O ZINC000775648067 1122857042 /nfs/dbraw/zinc/85/70/42/1122857042.db2.gz PAPMSXPSYRJNLD-UHFFFAOYSA-N 1 0 267.372 3.865 20 10 CHCDRO Cc1ccc(OCC[N@@H+](C)Cc2cccc(C)c2O)cc1 ZINC000775646868 1122857958 /nfs/dbraw/zinc/85/79/58/1122857958.db2.gz LASKGZKHIRNICL-UHFFFAOYSA-N 1 0 285.387 3.520 20 10 CHCDRO CC[N@H+](CCC(F)(F)F)Cc1cc(Cl)cc(F)c1[O-] ZINC000775669097 1122882410 /nfs/dbraw/zinc/88/24/10/1122882410.db2.gz RRCOZHMHUDSLCM-UHFFFAOYSA-N 1 0 299.695 3.959 20 10 CHCDRO COc1cc(C)cc(C[NH2+][C@@H](C)c2ccsc2)c1O ZINC000894675780 1122889676 /nfs/dbraw/zinc/88/96/76/1122889676.db2.gz JFAQQXRUIFDQQD-NSHDSACASA-N 1 0 277.389 3.622 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H](c3ccco3)C2)c1O ZINC000775692925 1122911168 /nfs/dbraw/zinc/91/11/68/1122911168.db2.gz QPGGGFXDRIJAPZ-GFCCVEGCSA-N 1 0 291.778 3.937 20 10 CHCDRO Cc1cccc(C[N@@H+]2[C@H](C)C[C@H]3CCCC[C@H]32)c1O ZINC000775701321 1122912053 /nfs/dbraw/zinc/91/20/53/1122912053.db2.gz KICDQJHAJIBREY-IIAWOOMASA-N 1 0 259.393 3.854 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCc3cccc(F)c3[C@H]2C)c1O ZINC000775700263 1122912403 /nfs/dbraw/zinc/91/24/03/1122912403.db2.gz LYDOXGQIHSVYJJ-CYBMUJFWSA-N 1 0 285.362 3.959 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+]2CC[C@H](C)[C@@H]2C)c1O ZINC000775737056 1122929067 /nfs/dbraw/zinc/92/90/67/1122929067.db2.gz NXWGJKWGEHFONA-ONGXEEELSA-N 1 0 253.773 3.584 20 10 CHCDRO CC(C)[C@H]1CC[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000775765542 1122949527 /nfs/dbraw/zinc/94/95/27/1122949527.db2.gz PPQKYSIYMVELSH-GOSISDBHSA-N 1 0 272.436 3.907 20 10 CHCDRO C[C@H]1CCCC[C@H]1[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001198958922 1123016579 /nfs/dbraw/zinc/01/65/79/1123016579.db2.gz FTVHGIAAAKBSDS-XJKSGUPXSA-N 1 0 259.393 3.680 20 10 CHCDRO CCOCc1cc(C[NH2+][C@H]2CCCC[C@@H]2C)ccc1OC ZINC001198959170 1123017731 /nfs/dbraw/zinc/01/77/31/1123017731.db2.gz JJUWPDSQQXSVFW-YOEHRIQHSA-N 1 0 291.435 3.900 20 10 CHCDRO Cc1ccc(O)c(C[N@H+]2CCC[C@H](C(F)(F)F)[C@@H]2C)c1 ZINC000776013692 1123036695 /nfs/dbraw/zinc/03/66/95/1123036695.db2.gz NLMAAOJOKCYSSO-AAEUAGOBSA-N 1 0 287.325 3.863 20 10 CHCDRO CC1=CCC[C@@H](C)[C@H]1C[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC001199865684 1123044916 /nfs/dbraw/zinc/04/49/16/1123044916.db2.gz SXYSFGKKYMYNNG-ZBFHGGJFSA-N 1 0 290.426 3.974 20 10 CHCDRO Cc1ccc(CC[NH2+]Cc2c(O)cccc2Cl)cc1 ZINC000776175318 1123102537 /nfs/dbraw/zinc/10/25/37/1123102537.db2.gz PDECFWKUIBRGNL-UHFFFAOYSA-N 1 0 275.779 3.686 20 10 CHCDRO Cc1cc(Br)cc(C[NH2+]C(C)(C)C2CC2)c1O ZINC000776176696 1123102568 /nfs/dbraw/zinc/10/25/68/1123102568.db2.gz CUNNWWNRICSORJ-UHFFFAOYSA-N 1 0 298.224 3.741 20 10 CHCDRO C[N@H+](CCc1ccccc1)Cc1ccc(N2CCCC2)cc1 ZINC001201602852 1123130812 /nfs/dbraw/zinc/13/08/12/1123130812.db2.gz CPRUMECORAUOPX-UHFFFAOYSA-N 1 0 294.442 3.961 20 10 CHCDRO C[N@@H+](Cc1ccc(N2CCCC2)cc1)CC1CCCC1 ZINC001202167389 1123180492 /nfs/dbraw/zinc/18/04/92/1123180492.db2.gz XIAOZWXTGZNSSE-UHFFFAOYSA-N 1 0 272.436 3.909 20 10 CHCDRO CC[N@H+](CCCC(F)(F)F)Cc1ccccc1O ZINC001202433332 1123211607 /nfs/dbraw/zinc/21/16/07/1123211607.db2.gz MWLDYOWLQUABIS-UHFFFAOYSA-N 1 0 261.287 3.557 20 10 CHCDRO C[C@@H]([NH2+]Cc1cc(F)ccc1F)c1ccccc1O ZINC000107929117 1123229478 /nfs/dbraw/zinc/22/94/78/1123229478.db2.gz AMTYWVBFIRTXGL-SNVBAGLBSA-N 1 0 263.287 3.521 20 10 CHCDRO COc1cc(C[NH2+]C2CC(C)C2)c(O)c(C(C)(C)C)c1 ZINC000850170840 1123244743 /nfs/dbraw/zinc/24/47/43/1123244743.db2.gz RCPKBPYUAPFIRM-UHFFFAOYSA-N 1 0 277.408 3.586 20 10 CHCDRO COc1cc(C[NH2+]C[C@@H](C)SC)c(O)c(C(C)(C)C)c1 ZINC000850221588 1123248051 /nfs/dbraw/zinc/24/80/51/1123248051.db2.gz MEEJEZQPOTWKBX-LLVKDONJSA-N 1 0 297.464 3.539 20 10 CHCDRO Cc1cc(F)ccc1C[C@@H](C)[NH2+]Cc1ccccc1O ZINC000850350395 1123254911 /nfs/dbraw/zinc/25/49/11/1123254911.db2.gz RQMCBCFBBIKLJV-CYBMUJFWSA-N 1 0 273.351 3.561 20 10 CHCDRO c1cc(N2CCCCC2)ccc1C[NH2+][C@H]1[C@@H]2CCC[C@@H]21 ZINC000850392970 1123262098 /nfs/dbraw/zinc/26/20/98/1123262098.db2.gz OYGMLYPEKYRLHV-PIIMJCKOSA-N 1 0 270.420 3.565 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)C1CCC(F)CC1 ZINC000850395192 1123262141 /nfs/dbraw/zinc/26/21/41/1123262141.db2.gz DZBFYNXEUJXLTC-XEBKBJJBSA-N 1 0 277.383 3.628 20 10 CHCDRO C[C@H](C[NH2+][C@H](C)c1cc(Cl)ccc1O)c1ccccn1 ZINC000850482347 1123273082 /nfs/dbraw/zinc/27/30/82/1123273082.db2.gz OSTMTGOYHZUXGY-VXGBXAGGSA-N 1 0 290.794 3.895 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](C)c1ccccn1)c1ccc(C)cc1O ZINC000850481640 1123273596 /nfs/dbraw/zinc/27/35/96/1123273596.db2.gz IHMFWOAETPCYHH-GDBMZVCRSA-N 1 0 284.403 3.940 20 10 CHCDRO CC[C@H](COCC1CC1)[NH2+][C@H](C)c1ccc(C)cc1O ZINC000850492288 1123273958 /nfs/dbraw/zinc/27/39/58/1123273958.db2.gz CRFGHLNVFOZGOG-UKRRQHHQSA-N 1 0 277.408 3.556 20 10 CHCDRO CC[C@H](COCC1CC1)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000850495104 1123275441 /nfs/dbraw/zinc/27/54/41/1123275441.db2.gz WKCSYJQFSOKJRK-WMLDXEAASA-N 1 0 290.451 3.608 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCN(C(C)(C)C)C2)c(O)c1C ZINC000850495020 1123275534 /nfs/dbraw/zinc/27/55/34/1123275534.db2.gz VBWSRKVSTDHZAW-HUUCEWRRSA-N 1 0 290.451 3.532 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCc2cnccc2C)cc1 ZINC000850507993 1123276989 /nfs/dbraw/zinc/27/69/89/1123276989.db2.gz QONRDIDBPSSUIA-MRXNPFEDSA-N 1 0 297.446 3.739 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]Cc2cc(C)cc(C)c2)c1O ZINC000850522189 1123279890 /nfs/dbraw/zinc/27/98/90/1123279890.db2.gz HIZFSWZYAKGLNI-CQSZACIVSA-N 1 0 285.387 3.868 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2C[C@H](O)c3ccccc32)c(O)c1C ZINC000850526988 1123281622 /nfs/dbraw/zinc/28/16/22/1123281622.db2.gz DNDQFCMKKLAZOI-KKXDTOCCSA-N 1 0 297.398 3.838 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2C[C@@H](O)c3ccccc32)c(O)c1C ZINC000850526989 1123282133 /nfs/dbraw/zinc/28/21/33/1123282133.db2.gz DNDQFCMKKLAZOI-MORSLUCNSA-N 1 0 297.398 3.838 20 10 CHCDRO CC[C@H]([NH2+]CCC(C)(C)F)c1ccc(N(C)C)cc1 ZINC000850530601 1123285237 /nfs/dbraw/zinc/28/52/37/1123285237.db2.gz ATDUGUVRVUDOIM-HNNXBMFYSA-N 1 0 266.404 3.932 20 10 CHCDRO C[C@@H]1C[C@@H]([NH2+]C[C@]2(C)CC2(F)F)c2c1c(F)ccc2O ZINC000850536499 1123287066 /nfs/dbraw/zinc/28/70/66/1123287066.db2.gz KQRKDTWTGOFUOB-PWZJLYFZSA-N 1 0 285.309 3.715 20 10 CHCDRO CC[C@H]([NH2+]C[C@@]1(C)CC1(F)F)c1ccc(N(C)C)cc1 ZINC000850535284 1123287077 /nfs/dbraw/zinc/28/70/77/1123287077.db2.gz UFHKSEZRDFXCPY-LSDHHAIUSA-N 1 0 282.378 3.839 20 10 CHCDRO C[C@@H]1C[C@@H]([NH2+]C[C@H]2CCC[C@@H](C)O2)c2c1c(F)ccc2O ZINC000850535690 1123287364 /nfs/dbraw/zinc/28/73/64/1123287364.db2.gz ZHMZGIAWAPVMPB-HKUMRIAESA-N 1 0 293.382 3.627 20 10 CHCDRO C[C@H]([NH2+]C[C@]1(C)CC1(F)F)c1cc(Cl)ccc1O ZINC000850537329 1123288086 /nfs/dbraw/zinc/28/80/86/1123288086.db2.gz TUQDCHFCEXEFOX-UFBFGSQYSA-N 1 0 275.726 3.742 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCc3ccc(O)cc32)c1 ZINC000850543196 1123288720 /nfs/dbraw/zinc/28/87/20/1123288720.db2.gz GJJXAEPDXCGSTH-SJCJKPOMSA-N 1 0 283.371 3.744 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCc2ccc(O)cc21)c1ccc(N(C)C)cc1 ZINC000850543398 1123289007 /nfs/dbraw/zinc/28/90/07/1123289007.db2.gz IXIMFLDBEWRTPX-DJJJIMSYSA-N 1 0 296.414 3.796 20 10 CHCDRO C[C@@H]([NH2+]C[C@H](CO)CC1CC1)c1ccc2ccccc2c1O ZINC000850544942 1123289236 /nfs/dbraw/zinc/28/92/36/1123289236.db2.gz KRSZEYYESRKFOK-UKRRQHHQSA-N 1 0 299.414 3.605 20 10 CHCDRO CC[C@@H]([NH2+]CC1SCCS1)c1ccc(C)cc1O ZINC000850559992 1123291870 /nfs/dbraw/zinc/29/18/70/1123291870.db2.gz HUCVBTZZDBLEBR-GFCCVEGCSA-N 1 0 283.462 3.547 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1CCOC1(C)C)c1ccc(C)cc1O ZINC000850570394 1123294518 /nfs/dbraw/zinc/29/45/18/1123294518.db2.gz GWAPYVALFBJQGD-DZGCQCFKSA-N 1 0 277.408 3.556 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H]2CCOC2(C)C)cc1 ZINC000850571729 1123295651 /nfs/dbraw/zinc/29/56/51/1123295651.db2.gz VEBBUZBTHJPTRE-HOCLYGCPSA-N 1 0 290.451 3.608 20 10 CHCDRO Oc1ccccc1C[N@H+](CCC1CCC1)C[C@H]1CCCO1 ZINC000851840912 1123384290 /nfs/dbraw/zinc/38/42/90/1123384290.db2.gz LQZUKPWUXLUDBG-QGZVFWFLSA-N 1 0 289.419 3.563 20 10 CHCDRO CCCCN1CCCC[C@H]1C[NH2+][C@@H](C)c1ccccc1O ZINC000783509873 1123400965 /nfs/dbraw/zinc/40/09/65/1123400965.db2.gz VHMLXFCEYFXTER-HOTGVXAUSA-N 1 0 290.451 3.697 20 10 CHCDRO C[C@@H](c1cc(F)ccc1F)[N@H+](C)Cc1ccccc1O ZINC000111236015 1123432432 /nfs/dbraw/zinc/43/24/32/1123432432.db2.gz VAVIKVXSYZLKAC-NSHDSACASA-N 1 0 277.314 3.863 20 10 CHCDRO CCC1(C[NH2+][C@H](C)c2ccc(C)cc2O)CCOCC1 ZINC000273559427 1129126712 /nfs/dbraw/zinc/12/67/12/1129126712.db2.gz HRGUTXCIQMGDKO-CQSZACIVSA-N 1 0 277.408 3.558 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cccc(N)c1)c1ccc(C)cc1O ZINC000854217281 1123477890 /nfs/dbraw/zinc/47/78/90/1123477890.db2.gz JSLRKULRMODQSU-MRXNPFEDSA-N 1 0 270.376 3.524 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+]Cc2cccc(N)c2)c1O ZINC000854216048 1123477899 /nfs/dbraw/zinc/47/78/99/1123477899.db2.gz SJOKWFCYSRCDTG-NSHDSACASA-N 1 0 290.794 3.787 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCc3cc(N)ccc32)c(O)c1C ZINC000854226132 1123478266 /nfs/dbraw/zinc/47/82/66/1123478266.db2.gz OMRMZVDFRFTSEU-ACJLOTCBSA-N 1 0 296.414 3.929 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]CC[C@@H]1CCCC1(F)F ZINC000895546039 1123491387 /nfs/dbraw/zinc/49/13/87/1123491387.db2.gz XQEWVSLURJNMEY-LBPRGKRZSA-N 1 0 269.335 3.616 20 10 CHCDRO CCOc1ccc(C[NH2+]Cc2cc(C)ccc2O)cc1F ZINC000113338719 1123521369 /nfs/dbraw/zinc/52/13/69/1123521369.db2.gz HHWGUYIUOZSOCX-UHFFFAOYSA-N 1 0 289.350 3.528 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C[C@@H]2C[C@@H]2c2ccccc2)c1 ZINC000113341228 1123521759 /nfs/dbraw/zinc/52/17/59/1123521759.db2.gz PJBMICLWAHVKGR-DOTOQJQBSA-N 1 0 267.372 3.594 20 10 CHCDRO [O-]c1c(Cl)cccc1C[NH2+][C@@H]1CCc2c1cccc2F ZINC000895855354 1123522779 /nfs/dbraw/zinc/52/27/79/1123522779.db2.gz QNYNOVHFTIWSBD-OAHLLOKOSA-N 1 0 291.753 3.962 20 10 CHCDRO C[C@@H]([NH2+]CCCOC(F)F)c1ccc2ccccc2c1O ZINC000194030180 1129129713 /nfs/dbraw/zinc/12/97/13/1129129713.db2.gz ZAFGEMDWZFRCON-LLVKDONJSA-N 1 0 295.329 3.825 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cccnc1C)c1ccc(N(C)C)cc1 ZINC000858518511 1123659610 /nfs/dbraw/zinc/65/96/10/1123659610.db2.gz ISRWVWRSXAONHC-GOSISDBHSA-N 1 0 283.419 3.697 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccns1)c1cc(Cl)ccc1O ZINC000858577894 1123664728 /nfs/dbraw/zinc/66/47/28/1123664728.db2.gz SEIHRKBYSSUFOR-BDAKNGLRSA-N 1 0 282.796 3.914 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F)c1ccns1 ZINC000858576475 1123664915 /nfs/dbraw/zinc/66/49/15/1123664915.db2.gz KXHPPLUUAYRLAX-FXPVBKGRSA-N 1 0 292.379 3.887 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]C[C@@H]2CCCC23CC3)c1O ZINC000858594005 1123666382 /nfs/dbraw/zinc/66/63/82/1123666382.db2.gz LLPUBERSNWWVCC-OLZOCXBDSA-N 1 0 275.392 3.632 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]C2(C3CC3)CC2)cc1 ZINC000777149442 1123747714 /nfs/dbraw/zinc/74/77/14/1123747714.db2.gz NPOGKINLQORJNS-CYBMUJFWSA-N 1 0 258.409 3.736 20 10 CHCDRO C[C@H](CCCc1cccnc1)[NH2+][C@@H](C)c1ccccc1O ZINC000840772480 1123789977 /nfs/dbraw/zinc/78/99/77/1123789977.db2.gz UPZJMJBJUGXCCH-CABCVRRESA-N 1 0 284.403 3.849 20 10 CHCDRO CCc1cccc(C[NH2+][C@@H]2CCSC3(CCC3)C2)c1O ZINC000896950618 1123792674 /nfs/dbraw/zinc/79/26/74/1123792674.db2.gz GFGVFFLLXKTUQZ-OAHLLOKOSA-N 1 0 291.460 3.863 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@H](C)C1CC(F)(F)C1 ZINC000862348008 1123801837 /nfs/dbraw/zinc/80/18/37/1123801837.db2.gz XTKIZJVKQNFELM-GFCCVEGCSA-N 1 0 282.378 3.796 20 10 CHCDRO Oc1c(C[NH2+][C@@H]2CC[C@@H]3C[C@@H]3C2)ccc2ccccc21 ZINC000862439109 1123809906 /nfs/dbraw/zinc/80/99/06/1123809906.db2.gz HZWNLSXJHVGUSP-FVQBIDKESA-N 1 0 267.372 3.824 20 10 CHCDRO C[C@@H]1C[N@@H+](Cc2cc(Cl)ccc2O)C[C@H](C)C1(F)F ZINC000862443419 1123810861 /nfs/dbraw/zinc/81/08/61/1123810861.db2.gz OWZJEDGKOZVMJV-AOOOYVTPSA-N 1 0 289.753 3.769 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1cccc(O)c1 ZINC000193023713 1123869601 /nfs/dbraw/zinc/86/96/01/1123869601.db2.gz BAWKSUMSVTWOOY-OAHLLOKOSA-N 1 0 296.414 3.843 20 10 CHCDRO C[C@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1cc2c(cc1O)CCC2 ZINC000794670531 1123924701 /nfs/dbraw/zinc/92/47/01/1123924701.db2.gz XRVJLMONKNLURK-IINYFYTJSA-N 1 0 299.336 3.654 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCOC(C)(C)C2)c(O)c1C ZINC000120220544 1123945044 /nfs/dbraw/zinc/94/50/44/1123945044.db2.gz SXXMHFFRFLDXHK-KBPBESRZSA-N 1 0 277.408 3.617 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](CC(C)C)N(C)C)c1ccc(C)cc1O ZINC000794798557 1123949755 /nfs/dbraw/zinc/94/97/55/1123949755.db2.gz WFRPMZBNQDXAGW-RDJZCZTQSA-N 1 0 292.467 3.718 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](CC(C)C)N(C)C)c1ccc(C)cc1O ZINC000794798558 1123949763 /nfs/dbraw/zinc/94/97/63/1123949763.db2.gz WFRPMZBNQDXAGW-WBVHZDCISA-N 1 0 292.467 3.718 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)Cc1ccncc1)c1ccc(C)cc1O ZINC000794799973 1123950310 /nfs/dbraw/zinc/95/03/10/1123950310.db2.gz ASYDBTZTPCUUHI-RHSMWYFYSA-N 1 0 284.403 3.768 20 10 CHCDRO CC[C@@H]([NH2+]CCOCc1ccccc1)c1ccc(C)cc1O ZINC000794799862 1123950903 /nfs/dbraw/zinc/95/09/03/1123950903.db2.gz AAJYIWILJWIKRS-GOSISDBHSA-N 1 0 299.414 3.958 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1Cc2ccccc2O1)c1ccc(C)cc1O ZINC000794793525 1123950991 /nfs/dbraw/zinc/95/09/91/1123950991.db2.gz OWPGJYWEWYFRHD-RDJZCZTQSA-N 1 0 297.398 3.745 20 10 CHCDRO CC[C@H]([NH2+]CCN(C)C1CCCC1)c1ccc(C)cc1O ZINC000794809984 1123955327 /nfs/dbraw/zinc/95/53/27/1123955327.db2.gz SNZVPMMWULFQPJ-KRWDZBQOSA-N 1 0 290.451 3.616 20 10 CHCDRO CC[C@@H]([NH2+]CCN(C)C1CCCC1)c1ccc(C)cc1O ZINC000794809985 1123955476 /nfs/dbraw/zinc/95/54/76/1123955476.db2.gz SNZVPMMWULFQPJ-QGZVFWFLSA-N 1 0 290.451 3.616 20 10 CHCDRO CC[C@H]([NH2+]CCc1c(C)noc1C)c1ccc(C)cc1O ZINC000794811192 1123956451 /nfs/dbraw/zinc/95/64/51/1123956451.db2.gz VQVLVJFQFDAMHF-INIZCTEOSA-N 1 0 288.391 3.589 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)[C@@H]1CCCOC1)c1ccc(C)cc1O ZINC000794818128 1123960755 /nfs/dbraw/zinc/96/07/55/1123960755.db2.gz QIKPQIFIZLRKFO-LZWOXQAQSA-N 1 0 277.408 3.556 20 10 CHCDRO C[C@H]1C[C@@H]([NH2+]CCC2(C)CC2)c2c1c(F)ccc2O ZINC000794828433 1123962487 /nfs/dbraw/zinc/96/24/87/1123962487.db2.gz OVYWKURKSBESLO-CMPLNLGQSA-N 1 0 263.356 3.859 20 10 CHCDRO C[C@H]([NH2+]Cc1cccnc1F)c1ccc2ccccc2c1O ZINC000794834251 1123965211 /nfs/dbraw/zinc/96/52/11/1123965211.db2.gz HYXVKSXCIVUIIG-LBPRGKRZSA-N 1 0 296.345 3.930 20 10 CHCDRO CC[C@H]([NH2+]Cc1cccnc1F)c1cc(Cl)ccc1O ZINC000794832714 1123969727 /nfs/dbraw/zinc/96/97/27/1123969727.db2.gz DCIUWIFRBXHMFV-ZDUSSCGKSA-N 1 0 294.757 3.821 20 10 CHCDRO COC1(C[NH2+][C@H](C)c2ccccc2O)CCC(C)CC1 ZINC000794837668 1123981725 /nfs/dbraw/zinc/98/17/25/1123981725.db2.gz YPZGUKFWZVBXGB-XOYHFGRZSA-N 1 0 277.408 3.638 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1ccc(N(C)CC)cc1)[C@@H](O)C(C)C ZINC000840882103 1123982039 /nfs/dbraw/zinc/98/20/39/1123982039.db2.gz MCBXPBIREKEPLA-WBAXXEDZSA-N 1 0 292.467 3.589 20 10 CHCDRO COC1([C@@H](C)[NH2+][C@H](C)c2cc(Cl)ccc2O)CCC1 ZINC000840884902 1123997120 /nfs/dbraw/zinc/99/71/20/1123997120.db2.gz ROPBYZVIHFORGJ-GHMZBOCLSA-N 1 0 283.799 3.654 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2C[C@H](C)[C@@H]3CCCC[C@@H]32)c1 ZINC000783592786 1124001722 /nfs/dbraw/zinc/00/17/22/1124001722.db2.gz KLDRFSWRTMLTFV-JQFCIGGWSA-N 1 0 289.419 3.801 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]Cc2csc(C)c2C)c1 ZINC000865680219 1124005001 /nfs/dbraw/zinc/00/50/01/1124005001.db2.gz TWDVUJWCXQJSAN-UHFFFAOYSA-N 1 0 291.416 3.759 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2ccc(C(C)(C)C)o2)c1 ZINC000865815021 1124016293 /nfs/dbraw/zinc/01/62/93/1124016293.db2.gz RXTLBKSZKILUPU-UHFFFAOYSA-N 1 0 273.376 3.881 20 10 CHCDRO Oc1ccccc1C[NH2+][C@H](Cc1cccnc1)C1CCCC1 ZINC000865835153 1124019523 /nfs/dbraw/zinc/01/95/23/1124019523.db2.gz ZULJBXMVUUNWLB-GOSISDBHSA-N 1 0 296.414 3.678 20 10 CHCDRO CO[C@](C)([C@H](C)[NH2+]Cc1cc(Cl)cc(C)c1O)C1CC1 ZINC000840961471 1124044354 /nfs/dbraw/zinc/04/43/54/1124044354.db2.gz WPUFTIMJWWWQBD-MEDUHNTESA-N 1 0 297.826 3.647 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CC[C@@H]2CCSC2)c(O)c1 ZINC000866404902 1124063826 /nfs/dbraw/zinc/06/38/26/1124063826.db2.gz XHAFYJREEBLEAF-ZIAGYGMSSA-N 1 0 279.449 3.803 20 10 CHCDRO C[C@H]([NH2+]CC(C)(C)F)c1ccc(Br)cc1O ZINC000866408688 1124064267 /nfs/dbraw/zinc/06/42/67/1124064267.db2.gz NQAIOTGYGKNJMX-QMMMGPOBSA-N 1 0 290.176 3.553 20 10 CHCDRO C[C@@H]([NH2+]CC(C)(C)F)c1ccc(Br)cc1O ZINC000866408687 1124064275 /nfs/dbraw/zinc/06/42/75/1124064275.db2.gz NQAIOTGYGKNJMX-MRVPVSSYSA-N 1 0 290.176 3.553 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2cccc(F)c2F)c1 ZINC000866476499 1124070201 /nfs/dbraw/zinc/07/02/01/1124070201.db2.gz OCABQTSFRZETOK-NSHDSACASA-N 1 0 277.314 3.830 20 10 CHCDRO CC[C@H]([NH2+]Cc1cccc2c1CCOC2)c1ccccc1O ZINC000866478986 1124070890 /nfs/dbraw/zinc/07/08/90/1124070890.db2.gz NRMUEPMIPMEFGF-SFHVURJKSA-N 1 0 297.398 3.706 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C2CCC2)[C@@H]2CCOC2)c1 ZINC000866511179 1124076185 /nfs/dbraw/zinc/07/61/85/1124076185.db2.gz BHJJYLGSFSQFAR-JCKWVBRZSA-N 1 0 289.419 3.556 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C2([C@H]3CCCCO3)CCC2)c1 ZINC000866623401 1124091051 /nfs/dbraw/zinc/09/10/51/1124091051.db2.gz QLZPFCWRCXSVPA-WMLDXEAASA-N 1 0 289.419 3.843 20 10 CHCDRO C[C@H]([NH2+]C1([C@@H]2CCCCO2)CCC1)c1cc(F)ccc1O ZINC000866622540 1124091289 /nfs/dbraw/zinc/09/12/89/1124091289.db2.gz GEWGYLKUBMUYKH-LRDDRELGSA-N 1 0 293.382 3.674 20 10 CHCDRO CC[C@@H]([NH2+]CC1(O)CCCCCC1)c1ccccc1O ZINC000087088998 1129173386 /nfs/dbraw/zinc/17/33/86/1129173386.db2.gz VTSLWBWJDOWKDP-OAHLLOKOSA-N 1 0 277.408 3.518 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+]CCCC(F)F)c2c1c(F)ccc2O ZINC001119607226 1131260149 /nfs/dbraw/zinc/26/01/49/1131260149.db2.gz ZDOJKWLARDQFGJ-SCZZXKLOSA-N 1 0 273.298 3.715 20 10 CHCDRO COc1ccccc1[C@@H](C)[NH2+]Cc1ccc(N(C)C)cc1C ZINC000122705337 1124525237 /nfs/dbraw/zinc/52/52/37/1124525237.db2.gz ZXROWPYFJSWJHG-OAHLLOKOSA-N 1 0 298.430 3.920 20 10 CHCDRO C[C@H]1[C@H](c2ccccc2)CC[N@@H+]1Cc1ccc(N)cc1 ZINC001120370822 1131275232 /nfs/dbraw/zinc/27/52/32/1131275232.db2.gz GOGFBAGOKGDEHO-KBXCAEBGSA-N 1 0 266.388 3.647 20 10 CHCDRO CC[C@H]([NH2+]CCC(C)(C)COC)c1ccc(C)cc1O ZINC000872104596 1124682643 /nfs/dbraw/zinc/68/26/43/1124682643.db2.gz KEDSIJGQVDJSJE-HNNXBMFYSA-N 1 0 279.424 3.804 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1C[C@H]2CCC[C@H]2O1)c1ccc(C)cc1O ZINC000872105731 1124683838 /nfs/dbraw/zinc/68/38/38/1124683838.db2.gz BDIDVTHRKCDQOE-YQYZPQCESA-N 1 0 289.419 3.699 20 10 CHCDRO CC[C@@H]([NH2+]CC1(OC(C)C)CCC1)c1ccccc1O ZINC000872116560 1124687613 /nfs/dbraw/zinc/68/76/13/1124687613.db2.gz SHKBNHHAHZRCCT-OAHLLOKOSA-N 1 0 277.408 3.781 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CC)c1ccccc1O)[C@@H](O)c1ccccc1 ZINC000872133525 1124693088 /nfs/dbraw/zinc/69/30/88/1124693088.db2.gz QOEUUTXYIRUSSI-SCTDSRPQSA-N 1 0 299.414 3.945 20 10 CHCDRO CCCOc1ccc(C[NH2+]Cc2scnc2C)cc1C ZINC000873047360 1124734196 /nfs/dbraw/zinc/73/41/96/1124734196.db2.gz XZSWMHVLCGYTDK-UHFFFAOYSA-N 1 0 290.432 3.839 20 10 CHCDRO CCN(CC)[C@@H](C[NH2+]Cc1ccccc1O)c1ccccc1 ZINC000020826559 1124878990 /nfs/dbraw/zinc/87/89/90/1124878990.db2.gz JJWZZUMFIBUMCS-SFHVURJKSA-N 1 0 298.430 3.565 20 10 CHCDRO COc1ccc([C@@H](C)[N@H+](C)Cc2cc(C)ccc2O)cc1 ZINC000125830269 1124928940 /nfs/dbraw/zinc/92/89/40/1124928940.db2.gz WIZNVFVNOCZKMX-CQSZACIVSA-N 1 0 285.387 3.902 20 10 CHCDRO CCCN(Cc1nc(Cl)cs1)Cc1ccccc1O ZINC000876654408 1124968706 /nfs/dbraw/zinc/96/87/06/1124968706.db2.gz FFKMZKSOWLWEDP-UHFFFAOYSA-N 1 0 296.823 3.914 20 10 CHCDRO Cc1nc(C)c([C@@H](C)[N@H+](C)Cc2c(C)cccc2O)s1 ZINC000876714732 1124973144 /nfs/dbraw/zinc/97/31/44/1124973144.db2.gz CNYDETLLGVLKLQ-GFCCVEGCSA-N 1 0 290.432 3.967 20 10 CHCDRO CCOCc1ccccc1C[NH2+]Cc1c(C)cccc1O ZINC000876914298 1124990316 /nfs/dbraw/zinc/99/03/16/1124990316.db2.gz CWFQRGJTODDYOI-UHFFFAOYSA-N 1 0 285.387 3.527 20 10 CHCDRO CCc1ccc(C[NH2+]Cc2ccc(C)cc2O)s1 ZINC000876931647 1124991959 /nfs/dbraw/zinc/99/19/59/1124991959.db2.gz QPKKTFFJOWCPAT-UHFFFAOYSA-N 1 0 261.390 3.614 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H]2CCOc3c(C)cccc32)c(O)c1 ZINC000876994550 1124995273 /nfs/dbraw/zinc/99/52/73/1124995273.db2.gz LBLPOFCPAQKOFV-MRXNPFEDSA-N 1 0 283.371 3.622 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)CCCC(F)(F)F)c(O)c1 ZINC000877475889 1125030525 /nfs/dbraw/zinc/03/05/25/1125030525.db2.gz PRCGWYWDHCGCJW-LLVKDONJSA-N 1 0 275.314 3.911 20 10 CHCDRO CCCOc1ccc(C[NH2+]C[C@@H](CCC)OC)cc1C ZINC001202546645 1125062523 /nfs/dbraw/zinc/06/25/23/1125062523.db2.gz NTTQLAMOGZDUCF-MRXNPFEDSA-N 1 0 279.424 3.689 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]C1CCC(OC(C)(C)C)CC1 ZINC000877682016 1125062680 /nfs/dbraw/zinc/06/26/80/1125062680.db2.gz FCQJKJGCBBHUOE-UHFFFAOYSA-N 1 0 291.435 3.917 20 10 CHCDRO Oc1cccc2c1C[N@H+](CCCCOc1ccccc1)C2 ZINC000877702972 1125067090 /nfs/dbraw/zinc/06/70/90/1125067090.db2.gz MSDAYGMAZZENMQ-UHFFFAOYSA-N 1 0 283.371 3.567 20 10 CHCDRO CC(C)[C@@H]1C[C@@H]([NH2+][C@H](C)c2ccccc2O)CS1 ZINC000877755647 1125071438 /nfs/dbraw/zinc/07/14/38/1125071438.db2.gz JRPUOBGIXFNZLH-JMSVASOKSA-N 1 0 265.422 3.573 20 10 CHCDRO CCOc1ccc(C[NH2+][C@H](C)c2ccccc2O)c(C)c1 ZINC000877755962 1125073027 /nfs/dbraw/zinc/07/30/27/1125073027.db2.gz UZNROBYAGBDRSP-CQSZACIVSA-N 1 0 285.387 3.950 20 10 CHCDRO CSC(C)(C)CC[NH2+][C@H](C)c1ccccc1O ZINC000877755998 1125073121 /nfs/dbraw/zinc/07/31/21/1125073121.db2.gz XVTGEGHQFRGJLF-LLVKDONJSA-N 1 0 253.411 3.575 20 10 CHCDRO CO[C@@H](c1ccccc1)[C@@H](C)[NH2+][C@@H](C)c1ccccc1O ZINC000877758245 1125073980 /nfs/dbraw/zinc/07/39/80/1125073980.db2.gz PBHIDNUGCHXHRW-PMUMKWKESA-N 1 0 285.387 3.819 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCO[C@H](C(C)(C)C)C1)c1ccccc1O ZINC000877756886 1125074025 /nfs/dbraw/zinc/07/40/25/1125074025.db2.gz BVOAYNYNDAAAAI-IOASZLSFSA-N 1 0 277.408 3.637 20 10 CHCDRO C[C@H]([NH2+]Cc1cccc2c1CCC2)c1ccccc1O ZINC000877758404 1125074983 /nfs/dbraw/zinc/07/49/83/1125074983.db2.gz YKEDDOVRXKLTJT-ZDUSSCGKSA-N 1 0 267.372 3.732 20 10 CHCDRO C[C@@H]([NH2+]Cc1cccc2cccnc21)c1cc(F)ccc1O ZINC000127655567 1125208060 /nfs/dbraw/zinc/20/80/60/1125208060.db2.gz ZPWIZBWHDQRWIK-GFCCVEGCSA-N 1 0 296.345 3.930 20 10 CHCDRO CCC(CC)n1ccc(C[NH2+][C@@H](C)c2ccccc2O)n1 ZINC000879650545 1125223853 /nfs/dbraw/zinc/22/38/53/1125223853.db2.gz GUOWEVWTXODHGQ-ZDUSSCGKSA-N 1 0 287.407 3.801 20 10 CHCDRO Oc1ccccc1C[NH2+]C1CCC2(CCCC2)CC1 ZINC000129498859 1125340326 /nfs/dbraw/zinc/34/03/26/1125340326.db2.gz PFMXWCDZEQHDOV-UHFFFAOYSA-N 1 0 259.393 3.985 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCOC3(CCC3)C2)cc1C(C)C ZINC000129679395 1125346043 /nfs/dbraw/zinc/34/60/43/1125346043.db2.gz FQHQBOFTMAIGDA-UHFFFAOYSA-N 1 0 289.419 3.579 20 10 CHCDRO CCC[C@H]1CCCC[N@@H+]1Cc1cc(OC)ccc1O ZINC000213553324 1125362280 /nfs/dbraw/zinc/36/22/80/1125362280.db2.gz GZPLJIVWRVBKOO-AWEZNQCLSA-N 1 0 263.381 3.555 20 10 CHCDRO CCC[C@@H]1CCCC[N@@H+]1Cc1cc(OC)ccc1O ZINC000213553268 1125362672 /nfs/dbraw/zinc/36/26/72/1125362672.db2.gz GZPLJIVWRVBKOO-CQSZACIVSA-N 1 0 263.381 3.555 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]CC(C)(C)CC(F)F)c1 ZINC000883259553 1125387466 /nfs/dbraw/zinc/38/74/66/1125387466.db2.gz QGPSFKUVPCKKKO-SNVBAGLBSA-N 1 0 287.350 3.733 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]CC[C@@H]1CCCC1(F)F)CC2 ZINC000883274705 1125390409 /nfs/dbraw/zinc/39/04/09/1125390409.db2.gz RYQUPEPIWQVJBW-STQMWFEESA-N 1 0 281.346 3.795 20 10 CHCDRO CSCC[C@H](C)[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000131610963 1125401126 /nfs/dbraw/zinc/40/11/26/1125401126.db2.gz PZMJEOOKHYKJEF-QWHCGFSZSA-N 1 0 266.454 3.545 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCC2(CCC2)O1)c1cc(Cl)ccc1O ZINC000883357959 1125401205 /nfs/dbraw/zinc/40/12/05/1125401205.db2.gz YKHJOTCSVMHVIV-DGCLKSJQSA-N 1 0 295.810 3.798 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCC2(CCC2)O1)c1cc(Cl)ccc1O ZINC000883357960 1125401291 /nfs/dbraw/zinc/40/12/91/1125401291.db2.gz YKHJOTCSVMHVIV-WCQYABFASA-N 1 0 295.810 3.798 20 10 CHCDRO CSCC[C@@H](C)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000131610753 1125401418 /nfs/dbraw/zinc/40/14/18/1125401418.db2.gz PZMJEOOKHYKJEF-OLZOCXBDSA-N 1 0 266.454 3.545 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCC[C@]23CCCO3)c(O)c1C ZINC000883368808 1125403247 /nfs/dbraw/zinc/40/32/47/1125403247.db2.gz BTKLIZQIJRNHRH-KYJSFNMBSA-N 1 0 289.419 3.761 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H]2c3ccccc3CC[C@H]2F)c1 ZINC000883383091 1125406805 /nfs/dbraw/zinc/40/68/05/1125406805.db2.gz SSXNJFOEZHXEHZ-SJLPKXTDSA-N 1 0 285.362 3.816 20 10 CHCDRO C[C@H]1C[C@H](C)C[NH+](Cc2cc(Cl)ccc2O)C1 ZINC000131805378 1125410234 /nfs/dbraw/zinc/41/02/34/1125410234.db2.gz BOROYMXAMWCWCW-QWRGUYRKSA-N 1 0 253.773 3.524 20 10 CHCDRO CC[C@H](C)[C@@H](C)[NH2+]CCCSc1nccs1 ZINC000132160441 1125415085 /nfs/dbraw/zinc/41/50/85/1125415085.db2.gz CUVNTRXMBRZUNJ-WDEREUQCSA-N 1 0 258.456 3.650 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CC(C)(C)C2CCOCC2)cc1C ZINC000897450787 1125418308 /nfs/dbraw/zinc/41/83/08/1125418308.db2.gz HCRMAPNMGWIYQV-UHFFFAOYSA-N 1 0 291.435 3.551 20 10 CHCDRO CC[C@H]([NH2+]CCCSC)c1ccc(N(C)C)cc1 ZINC000132509977 1125419225 /nfs/dbraw/zinc/41/92/25/1125419225.db2.gz VGSKYOFEKCUXAR-HNNXBMFYSA-N 1 0 266.454 3.546 20 10 CHCDRO Cc1cccc2c1C[N@H+](Cc1ccc(N(C)C)c(C)c1)C2 ZINC001139669792 1131357181 /nfs/dbraw/zinc/35/71/81/1131357181.db2.gz OEFDMNNYWXKMGB-UHFFFAOYSA-N 1 0 280.415 3.885 20 10 CHCDRO C[C@H]1CC[N@H+](Cc2ccccc2O)[C@@H](c2ccco2)C1 ZINC000245611762 1129213556 /nfs/dbraw/zinc/21/35/56/1129213556.db2.gz OCOGKZNCGYAXLV-DZGCQCFKSA-N 1 0 271.360 3.958 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@@H]1CCCc3occc31)CC2 ZINC000295901236 1129219394 /nfs/dbraw/zinc/21/93/94/1129219394.db2.gz IRFGTYZUKNYTPM-KGLIPLIRSA-N 1 0 269.344 3.640 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)C1CC1)c1cc2c(cc1O)CCCC2 ZINC000184892678 1129261151 /nfs/dbraw/zinc/26/11/51/1129261151.db2.gz LOIBZBJOPYUAPR-RYUDHWBXSA-N 1 0 259.393 3.720 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(C)c(F)c2)c1 ZINC000184910121 1129261703 /nfs/dbraw/zinc/26/17/03/1129261703.db2.gz ABNXKFQLFYLAIZ-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2ccccc2F)c1 ZINC000037764022 1129266651 /nfs/dbraw/zinc/26/66/51/1129266651.db2.gz AAZYFEFHCYGLKS-RYUDHWBXSA-N 1 0 289.350 3.952 20 10 CHCDRO C[C@H]([NH2+]Cc1ccccc1O)c1c(F)cccc1F ZINC000037771751 1129267266 /nfs/dbraw/zinc/26/72/66/1129267266.db2.gz KMIIVAJHLRGZAO-JTQLQIEISA-N 1 0 263.287 3.521 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCCC12CCOCC2)c1cc(F)ccc1O ZINC000282671431 1129278687 /nfs/dbraw/zinc/27/86/87/1129278687.db2.gz JESPQTRCTFVDNI-MLGOLLRUSA-N 1 0 293.382 3.531 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H](C)CC(C)(C)OC)cc1 ZINC000766191213 1129282147 /nfs/dbraw/zinc/28/21/47/1129282147.db2.gz LKRZQCCFBDJITF-CABCVRRESA-N 1 0 292.467 3.997 20 10 CHCDRO Cc1cc(N(C)C)ccc1CNc1cc[nH+]c2ccccc12 ZINC000734482430 1129309657 /nfs/dbraw/zinc/30/96/57/1129309657.db2.gz FOBAPBHTCNXRCX-UHFFFAOYSA-N 1 0 291.398 3.643 20 10 CHCDRO CCC(C)(CC)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000734845807 1129324054 /nfs/dbraw/zinc/32/40/54/1129324054.db2.gz HLKHIOHSYWNAOR-UHFFFAOYSA-N 1 0 252.377 3.560 20 10 CHCDRO COc1cccc(C[NH2+][C@@]2(C)CCCc3ccccc32)c1O ZINC000734843237 1129324150 /nfs/dbraw/zinc/32/41/50/1129324150.db2.gz HMOPJYARDSHADN-IBGZPJMESA-N 1 0 297.398 3.742 20 10 CHCDRO COc1cccc(C[NH2+][C@]2(C)CCCc3ccccc32)c1O ZINC000734843238 1129324398 /nfs/dbraw/zinc/32/43/98/1129324398.db2.gz HMOPJYARDSHADN-LJQANCHMSA-N 1 0 297.398 3.742 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CC)c1ccc(N(C)C)cc1)[C@@H]1CCCO1 ZINC000090858410 1129333449 /nfs/dbraw/zinc/33/34/49/1129333449.db2.gz CCZJSDJPHXIYKG-KSZLIROESA-N 1 0 290.451 3.751 20 10 CHCDRO CS[C@H]1CCC[C@H]([NH2+]Cc2ccc(N(C)C)c(F)c2)C1 ZINC000735324591 1129339242 /nfs/dbraw/zinc/33/92/42/1129339242.db2.gz UIBZPCQUMMMYTQ-KBPBESRZSA-N 1 0 296.455 3.656 20 10 CHCDRO CCOc1cccc(C[N@H+]([C@@H](C)C2CC2)C2CC2)c1O ZINC000092009595 1129377657 /nfs/dbraw/zinc/37/76/57/1129377657.db2.gz ZVIBAUIOOYTHHA-LBPRGKRZSA-N 1 0 275.392 3.554 20 10 CHCDRO Cc1cc(C[N@H+](C)C[C@@H]2CCCO2)c(O)c(C(C)(C)C)c1 ZINC000738066877 1129389929 /nfs/dbraw/zinc/38/99/29/1129389929.db2.gz POKUFBFXPNLXQI-HNNXBMFYSA-N 1 0 291.435 3.609 20 10 CHCDRO CC[C@@H](C)[C@H](C)[N@H+](Cc1cccc(OC)c1O)C1CC1 ZINC000093132211 1129417776 /nfs/dbraw/zinc/41/77/76/1129417776.db2.gz DDCVSRMFIRZMLL-OLZOCXBDSA-N 1 0 277.408 3.800 20 10 CHCDRO CCS[C@H]1CCCC[N@H+](Cc2cccc(OC)c2O)C1 ZINC000093361816 1129422341 /nfs/dbraw/zinc/42/23/41/1129422341.db2.gz LUODKQAPHZCJHR-AWEZNQCLSA-N 1 0 295.448 3.508 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCO[C@H]1c1ccccc1)c1ccccc1O ZINC000248573976 1129422783 /nfs/dbraw/zinc/42/27/83/1129422783.db2.gz SJCJUEHJOQADMP-SCTDSRPQSA-N 1 0 297.398 3.963 20 10 CHCDRO Cc1cccc([C@H]2CCC[N@H+]2Cc2ccc(N(C)C)cc2)n1 ZINC000093444903 1129423905 /nfs/dbraw/zinc/42/39/05/1129423905.db2.gz VUHCAJOUOMSILH-LJQANCHMSA-N 1 0 295.430 3.793 20 10 CHCDRO C[C@H]([NH2+]CCCOC1CCCCC1)c1cc(F)ccc1O ZINC000094616977 1129448326 /nfs/dbraw/zinc/44/83/26/1129448326.db2.gz GHXRTHDGNKLDEJ-ZDUSSCGKSA-N 1 0 295.398 3.921 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1Cc2ccccc21)c1cc(F)ccc1O ZINC000094617595 1129448452 /nfs/dbraw/zinc/44/84/52/1129448452.db2.gz CZAAHWQWQZEBMV-AAEUAGOBSA-N 1 0 271.335 3.522 20 10 CHCDRO Cc1cc(F)ccc1CC[NH2+][C@H](C)c1ccccc1O ZINC000094949939 1129456515 /nfs/dbraw/zinc/45/65/15/1129456515.db2.gz JOPLCTUFYJASCU-CYBMUJFWSA-N 1 0 273.351 3.733 20 10 CHCDRO COc1ccc(C[NH2+]C[C@H](C)Oc2ccc(C)cc2)cc1C ZINC000742380140 1129476045 /nfs/dbraw/zinc/47/60/45/1129476045.db2.gz IQIMWCQKZIDPEH-INIZCTEOSA-N 1 0 299.414 3.869 20 10 CHCDRO CCC[C@@H]1[C@H](C)CCC[N@@H+]1Cc1cc2c(cc1O)OCO2 ZINC000743380217 1129522773 /nfs/dbraw/zinc/52/27/73/1129522773.db2.gz WJAVUZYXYLVFLB-TZMCWYRMSA-N 1 0 291.391 3.522 20 10 CHCDRO Cc1ccc(C(C)(C)C[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC000303216086 1129533752 /nfs/dbraw/zinc/53/37/52/1129533752.db2.gz TVBYXHGQMRWBOP-UHFFFAOYSA-N 1 0 295.426 3.997 20 10 CHCDRO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)CC1CCC1 ZINC000743841784 1129537167 /nfs/dbraw/zinc/53/71/67/1129537167.db2.gz WZWXSYCMHXXUSL-UHFFFAOYSA-N 1 0 260.425 3.763 20 10 CHCDRO CC[N@@H+](Cc1cc(Br)ccc1O)CC1CCC1 ZINC000743874183 1129543399 /nfs/dbraw/zinc/54/33/99/1129543399.db2.gz VOXYVXAVLUHBBO-UHFFFAOYSA-N 1 0 298.224 3.777 20 10 CHCDRO CCC[N@@H+](Cc1ccc(N(C)C)cc1)C[C@@H]1CCCCO1 ZINC000746136682 1129626829 /nfs/dbraw/zinc/62/68/29/1129626829.db2.gz DZCSUBZICAPEFE-SFHVURJKSA-N 1 0 290.451 3.534 20 10 CHCDRO CSC1CCC(C[NH2+][C@@H]2CCc3cccc(O)c32)CC1 ZINC000720559031 1129657287 /nfs/dbraw/zinc/65/72/87/1129657287.db2.gz UPGVWHQZMXGKHV-PESDSKBTSA-N 1 0 291.460 3.891 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(F)cn1)c1ccc(N(C)C)cc1 ZINC000766607011 1129703139 /nfs/dbraw/zinc/70/31/39/1129703139.db2.gz FVPWNFYLNYLYGK-KRWDZBQOSA-N 1 0 287.382 3.528 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)CCSC)cc1F ZINC000740007515 1129740366 /nfs/dbraw/zinc/74/03/66/1129740366.db2.gz SVXNRDCCEAAEAM-ZDUSSCGKSA-N 1 0 298.471 3.903 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C[C@@H]2C[C@@H]2c2ccccc2)cc1F ZINC000767363961 1129789179 /nfs/dbraw/zinc/78/91/79/1129789179.db2.gz NDIAACYFQJNSRL-DLBZAZTESA-N 1 0 298.405 3.785 20 10 CHCDRO CC(C)CC[C@H]1CCC[N@@H+]1Cc1cc2c(cc1O)OCO2 ZINC000767763401 1129812277 /nfs/dbraw/zinc/81/22/77/1129812277.db2.gz AMMXBZHJKADFFM-CQSZACIVSA-N 1 0 291.391 3.522 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H]2CCCC(F)(F)C2)cc1F ZINC000767929998 1129822472 /nfs/dbraw/zinc/82/24/72/1129822472.db2.gz UXBPZKJBJIEACT-LBPRGKRZSA-N 1 0 286.341 3.559 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](CC)C2CCCCC2)c1 ZINC000768139149 1129836858 /nfs/dbraw/zinc/83/68/58/1129836858.db2.gz WRUUNIYIOGWTBS-UHFFFAOYSA-N 1 0 277.408 3.946 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CC[C@@H]1C)c1ccc(Br)cc1O ZINC000381327063 1129837775 /nfs/dbraw/zinc/83/77/75/1129837775.db2.gz RLBYDOWJDMBQOD-HOTUBEGUSA-N 1 0 284.197 3.604 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](Cc2ccco2)C(C)C)c1 ZINC000768250807 1129846811 /nfs/dbraw/zinc/84/68/11/1129846811.db2.gz WRZGTFSBXKXBEQ-UHFFFAOYSA-N 1 0 289.375 3.795 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1cc(C)ccc1O)[C@H]1CCCOC1 ZINC000723991080 1129851688 /nfs/dbraw/zinc/85/16/88/1129851688.db2.gz ZANHWFQCEXIXJZ-DZKIICNBSA-N 1 0 277.408 3.556 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@H]1c1ccccn1 ZINC000768360232 1129853449 /nfs/dbraw/zinc/85/34/49/1129853449.db2.gz LOCQPZMVKTXDCZ-HNNXBMFYSA-N 1 0 288.778 3.778 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CCC[C@@H]2c2ccccn2)c1 ZINC000768360215 1129853584 /nfs/dbraw/zinc/85/35/84/1129853584.db2.gz LEYMMPBUIZNXCM-QGZVFWFLSA-N 1 0 298.386 3.523 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CC[C@H](c3ccccc3)C2)cc1 ZINC000768360664 1129854117 /nfs/dbraw/zinc/85/41/17/1129854117.db2.gz NYOVTVUVJYHAQY-SFHVURJKSA-N 1 0 280.415 3.742 20 10 CHCDRO COc1cc(C[N@@H+]2CC[C@H](c3ccccc3)C2)c(O)cc1C ZINC000768439232 1129855878 /nfs/dbraw/zinc/85/58/78/1129855878.db2.gz DQBZZNGQCSZGKE-INIZCTEOSA-N 1 0 297.398 3.699 20 10 CHCDRO CC(C)[N@H+](Cc1ccc(N)cc1)Cc1ccc(F)cc1 ZINC000035365364 1129856154 /nfs/dbraw/zinc/85/61/54/1129856154.db2.gz XKJOCCVFCYLOPI-UHFFFAOYSA-N 1 0 272.367 3.819 20 10 CHCDRO COc1cc(C[N@H+](C)[C@H]2CCc3ccccc32)c(O)cc1C ZINC000768442697 1129856897 /nfs/dbraw/zinc/85/68/97/1129856897.db2.gz ZCQUJKSHGZXAMN-KRWDZBQOSA-N 1 0 297.398 3.829 20 10 CHCDRO C[N@H+](CCOC(C)(C)C)Cc1cc2c(cc1O)CCCC2 ZINC000768462180 1129858886 /nfs/dbraw/zinc/85/88/86/1129858886.db2.gz KVOVNOCGGYTIPT-UHFFFAOYSA-N 1 0 291.435 3.518 20 10 CHCDRO COc1cc(C[N@@H+]2CC[C@H](CC(C)C)C2)c(O)cc1C ZINC000768465490 1129858948 /nfs/dbraw/zinc/85/89/48/1129858948.db2.gz IDCNBVHWBPGPEA-CQSZACIVSA-N 1 0 277.408 3.577 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C[C@H]2CCCC(F)(F)C2)cc1 ZINC000800273426 1129861220 /nfs/dbraw/zinc/86/12/20/1129861220.db2.gz DGSJKCDXKMBJKB-AWEZNQCLSA-N 1 0 282.378 3.668 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C2CC(C(F)F)C2)cc1 ZINC000768679113 1129865775 /nfs/dbraw/zinc/86/57/75/1129865775.db2.gz SNBISAUPXZXQGD-UHFFFAOYSA-N 1 0 282.378 3.666 20 10 CHCDRO C[N@H+](Cc1cccc2cc[nH]c21)Cc1ccccc1O ZINC000768872959 1129877700 /nfs/dbraw/zinc/87/77/00/1129877700.db2.gz MYWTWHHBVRUZEV-UHFFFAOYSA-N 1 0 266.344 3.506 20 10 CHCDRO C/C(=C\c1ccccc1)C[N@@H+](C)Cc1ccccc1O ZINC000768873614 1129878684 /nfs/dbraw/zinc/87/86/84/1129878684.db2.gz RTDMJXPEMJFOQA-NTCAYCPXSA-N 1 0 267.372 3.928 20 10 CHCDRO Cc1cc(F)cc2c1C[N@H+](Cc1cc(F)ccc1O)CC2 ZINC000800536590 1129882250 /nfs/dbraw/zinc/88/22/50/1129882250.db2.gz QJVRBBBZGCGXNV-UHFFFAOYSA-N 1 0 289.325 3.537 20 10 CHCDRO CCSCCC[NH2+]Cc1cc(Cl)cc(C)c1O ZINC000800526613 1129882660 /nfs/dbraw/zinc/88/26/60/1129882660.db2.gz AFNPTXCWZBVHQP-UHFFFAOYSA-N 1 0 273.829 3.587 20 10 CHCDRO Cc1ccccc1[C@@]1(F)CC[N@H+](Cc2ccccc2O)C1 ZINC000800537165 1129882970 /nfs/dbraw/zinc/88/29/70/1129882970.db2.gz ZTWLKLYBPQRLCJ-GOSISDBHSA-N 1 0 285.362 3.771 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000769103999 1129890056 /nfs/dbraw/zinc/89/00/56/1129890056.db2.gz VIOIBAGCBHSSOV-CQSZACIVSA-N 1 0 267.372 3.901 20 10 CHCDRO CCOc1ccc(C[N@H+](CC)[C@@H](C)C(C)C)c(O)c1 ZINC000769155910 1129893634 /nfs/dbraw/zinc/89/36/34/1129893634.db2.gz ZTFYFZSRTYKAMK-ZDUSSCGKSA-N 1 0 265.397 3.657 20 10 CHCDRO CCC[N@H+](Cc1ccc(CC)o1)Cc1ccccc1O ZINC000769200925 1129895852 /nfs/dbraw/zinc/89/58/52/1129895852.db2.gz JFFLZDSXVHUECQ-UHFFFAOYSA-N 1 0 273.376 3.960 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H](O)c2cc(C)cc(C)c2)c(O)c1 ZINC000800992825 1129903059 /nfs/dbraw/zinc/90/30/59/1129903059.db2.gz TUKXXJYMZOGNIH-KXBFYZLASA-N 1 0 299.414 3.702 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC[C@@H](c3cccc(F)c3)C2)c1 ZINC000769337602 1129903677 /nfs/dbraw/zinc/90/36/77/1129903677.db2.gz FXVHSXQKCBDXDF-OAHLLOKOSA-N 1 0 285.362 3.829 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC[C@H](c3ccccc3F)C2)c1 ZINC000769378251 1129905336 /nfs/dbraw/zinc/90/53/36/1129905336.db2.gz ASQOPOXHZZMEGA-AWEZNQCLSA-N 1 0 285.362 3.829 20 10 CHCDRO CCCN(CCC)c1ccc(C[N@@H+]2CC[C@@H](OC)C2)cc1 ZINC000769447710 1129910516 /nfs/dbraw/zinc/91/05/16/1129910516.db2.gz VZZNYTNIQXOCTG-GOSISDBHSA-N 1 0 290.451 3.534 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCCC[C@@H]2c2cccn2C)cc1 ZINC000769536730 1129916135 /nfs/dbraw/zinc/91/61/35/1129916135.db2.gz CQJLSYITNGRCQV-LJQANCHMSA-N 1 0 297.446 3.818 20 10 CHCDRO CCOc1ccc(C[N@H+](C)[C@H](C)CCSCC)c(O)c1 ZINC000769548547 1129917085 /nfs/dbraw/zinc/91/70/85/1129917085.db2.gz HTBRDBQSCQIGHL-CYBMUJFWSA-N 1 0 297.464 3.754 20 10 CHCDRO CCOc1cccc(C[N@H+](C)Cc2ccc(N(C)C)cc2)c1 ZINC000770255957 1129943563 /nfs/dbraw/zinc/94/35/63/1129943563.db2.gz LHMVARNFIBMMJZ-UHFFFAOYSA-N 1 0 298.430 3.783 20 10 CHCDRO C[C@@H]1c2c(F)cccc2CC[N@H+]1Cc1ccccc1O ZINC000770509490 1129948879 /nfs/dbraw/zinc/94/88/79/1129948879.db2.gz AZDAJFLUMDAOOX-GFCCVEGCSA-N 1 0 271.335 3.651 20 10 CHCDRO CC1(c2ccccc2)CC[NH+](Cc2ccccc2O)CC1 ZINC000770510892 1129949254 /nfs/dbraw/zinc/94/92/54/1129949254.db2.gz UKWXZESUTGBWIE-UHFFFAOYSA-N 1 0 281.399 3.946 20 10 CHCDRO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1ccccc1O ZINC000770509493 1129949272 /nfs/dbraw/zinc/94/92/72/1129949272.db2.gz BATFDNHAFSBPNU-QGZVFWFLSA-N 1 0 267.372 3.902 20 10 CHCDRO COc1cc(C)cc(C[N@@H+]2CC[C@@H](C)C3(CCC3)C2)c1O ZINC000770672023 1129955070 /nfs/dbraw/zinc/95/50/70/1129955070.db2.gz WPHKANIVXZODIR-CQSZACIVSA-N 1 0 289.419 3.721 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)c(C)n1 ZINC000771388902 1129979286 /nfs/dbraw/zinc/97/92/86/1129979286.db2.gz KPQNSONGNPCDCS-OAHLLOKOSA-N 1 0 297.446 3.924 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)[C@@H]1CCc2cccc(F)c2C1 ZINC001171004382 1131411986 /nfs/dbraw/zinc/41/19/86/1131411986.db2.gz DBKSUNGGJYLDHW-MRXNPFEDSA-N 1 0 299.389 3.911 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CC[C@H]1c1ccccc1 ZINC000771937463 1129996902 /nfs/dbraw/zinc/99/69/02/1129996902.db2.gz CXTGRLUJJFRIQS-HNNXBMFYSA-N 1 0 273.763 3.993 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CC[C@@H]2c2ccccc2)c1 ZINC000771941326 1129997961 /nfs/dbraw/zinc/99/79/61/1129997961.db2.gz ZYVHFBMNQWYDBO-QGZVFWFLSA-N 1 0 283.371 3.738 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CC[C@H](OC(F)F)C2)cc1C(C)C ZINC000802746916 1130035236 /nfs/dbraw/zinc/03/52/36/1130035236.db2.gz AYEVMGRCAMVESQ-ZDUSSCGKSA-N 1 0 299.361 3.638 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]C[C@@]23C[C@@H]2CCCC3)c1O ZINC000903161027 1130121221 /nfs/dbraw/zinc/12/12/21/1130121221.db2.gz CYLNQYMWTJLQCH-GDZNZVCISA-N 1 0 275.392 3.632 20 10 CHCDRO CC[C@@H]([NH2+]Cc1nccc2c1CCCC2)c1ccccc1O ZINC000903180914 1130125282 /nfs/dbraw/zinc/12/52/82/1130125282.db2.gz ATYRRVGTGZDANT-QGZVFWFLSA-N 1 0 296.414 3.907 20 10 CHCDRO C[C@H]([NH2+]Cc1nccc2c1CCCC2)c1ccccc1O ZINC000903185515 1130125962 /nfs/dbraw/zinc/12/59/62/1130125962.db2.gz UOGMVEVRDBPJSK-ZDUSSCGKSA-N 1 0 282.387 3.517 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H]2CCCC3(CC3)C2)c1O ZINC000903279636 1130144213 /nfs/dbraw/zinc/14/42/13/1130144213.db2.gz OFJUEKZNEREKLW-QWHCGFSZSA-N 1 0 275.392 3.774 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2cncs2)c(O)c1 ZINC000903312553 1130151473 /nfs/dbraw/zinc/15/14/73/1130151473.db2.gz WQNPKOAFJZZDTO-GHMZBOCLSA-N 1 0 262.378 3.569 20 10 CHCDRO CC[C@H]([NH2+][C@H](c1ncccn1)C1CC1)c1ccc(C)cc1O ZINC000903321758 1130154548 /nfs/dbraw/zinc/15/45/48/1130154548.db2.gz BVTZBPPWDQHXRP-RDJZCZTQSA-N 1 0 297.402 3.683 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H](c2ncccn2)C2CC2)c(O)c1C ZINC000903327364 1130156410 /nfs/dbraw/zinc/15/64/10/1130156410.db2.gz SDNMTWQPWPRFOV-CJNGLKHVSA-N 1 0 297.402 3.601 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@@H](c1ccccn1)C1CC1)CC2 ZINC000903336504 1130161785 /nfs/dbraw/zinc/16/17/85/1130161785.db2.gz ZOBFKWQQPDZTQY-KBXCAEBGSA-N 1 0 280.371 3.515 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CC[C@H](c3ccccc3)C2)cc1C ZINC000746716704 1130167263 /nfs/dbraw/zinc/16/72/63/1130167263.db2.gz RAADEPRETVNHDZ-KRWDZBQOSA-N 1 0 281.399 3.999 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CCOC12CCCC2)c1ccc(C)cc1O ZINC000903387061 1130169703 /nfs/dbraw/zinc/16/97/03/1130169703.db2.gz FUBJOUGOWMTRLJ-NVXWUHKLSA-N 1 0 289.419 3.843 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)c1ccccc1O)c1cnn(CC2CCC2)c1 ZINC000903403628 1130171566 /nfs/dbraw/zinc/17/15/66/1130171566.db2.gz DJDDPKZESQFBKW-KBPBESRZSA-N 1 0 299.418 3.801 20 10 CHCDRO C[C@@H]([NH2+][C@@H](c1ccncc1)C1CC1)c1ccc(N(C)C)cc1 ZINC000903428996 1130175740 /nfs/dbraw/zinc/17/57/40/1130175740.db2.gz RLJKIOVSNVAQHK-AUUYWEPGSA-N 1 0 295.430 3.950 20 10 CHCDRO C[C@H]([NH2+][C@H](c1ccncc1)C1CC1)c1ccc(N(C)C)cc1 ZINC000903428999 1130176126 /nfs/dbraw/zinc/17/61/26/1130176126.db2.gz RLJKIOVSNVAQHK-LIRRHRJNSA-N 1 0 295.430 3.950 20 10 CHCDRO CCC(O)(CC)CC[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000788264503 1130180374 /nfs/dbraw/zinc/18/03/74/1130180374.db2.gz XYVMVAGNGABYNH-YPMHNXCESA-N 1 0 295.398 3.610 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CCN(C)C2CCCC2)c(O)c1 ZINC000788592529 1130196569 /nfs/dbraw/zinc/19/65/69/1130196569.db2.gz CXTLSCGCVXZBRP-HNNXBMFYSA-N 1 0 290.451 3.534 20 10 CHCDRO Cc1cccc([C@@H](O)C[NH2+][C@H](C)c2c(C)cc(C)cc2O)c1 ZINC000788669446 1130201742 /nfs/dbraw/zinc/20/17/42/1130201742.db2.gz OMKYUFHMYSRCJE-QAPCUYQASA-N 1 0 299.414 3.702 20 10 CHCDRO CC(C)CCC[C@@H](C)[N@@H+]1CCc2cccc(O)c2C1 ZINC001170088535 1130204525 /nfs/dbraw/zinc/20/45/25/1130204525.db2.gz UVELUXMLQYVNDL-CQSZACIVSA-N 1 0 261.409 3.965 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H]2c3ccccc3NC2(C)C)c1O ZINC000903948629 1130211940 /nfs/dbraw/zinc/21/19/40/1130211940.db2.gz SNLKCINCQNXFKG-QGZVFWFLSA-N 1 0 282.387 3.736 20 10 CHCDRO CC[C@@H]([NH2+]CCOC(F)(F)F)c1cc(Cl)ccc1O ZINC000788978947 1130223644 /nfs/dbraw/zinc/22/36/44/1130223644.db2.gz CJXOREGVTXDARD-SNVBAGLBSA-N 1 0 297.704 3.623 20 10 CHCDRO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)C[C@H]1CC[C@H](C)O1 ZINC000789310640 1130242617 /nfs/dbraw/zinc/24/26/17/1130242617.db2.gz SYYVFQPQBJRBEG-MAUKXSAKSA-N 1 0 290.451 3.531 20 10 CHCDRO CC(C)C[C@@H]1CCC[N@@H+]1Cc1c(O)ccc2ccncc21 ZINC000748791990 1130246412 /nfs/dbraw/zinc/24/64/12/1130246412.db2.gz KHSYCYSRCNKUTG-HNNXBMFYSA-N 1 0 284.403 3.951 20 10 CHCDRO COCCC1C[NH+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000826899687 1130308970 /nfs/dbraw/zinc/30/89/70/1130308970.db2.gz TXZBURTVVVKIQF-UHFFFAOYSA-N 1 0 297.398 3.528 20 10 CHCDRO C[C@H]1CC[C@H]([N@H+](C)Cc2ccc(N3CCCC3)cc2)C1 ZINC001170144662 1130330256 /nfs/dbraw/zinc/33/02/56/1130330256.db2.gz MWJTUUJURMAABC-YJBOKZPZSA-N 1 0 272.436 3.907 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)cc1)[C@@H]1CC[C@@H](C)C1 ZINC001170159379 1130394998 /nfs/dbraw/zinc/39/49/98/1130394998.db2.gz TXYYZFUVCUXCCI-RHSMWYFYSA-N 1 0 260.425 3.763 20 10 CHCDRO CC[C@@H]1C[C@H]([NH2+]Cc2cc3ccccc3cc2O)CCO1 ZINC001170183406 1130454691 /nfs/dbraw/zinc/45/46/91/1130454691.db2.gz RPTFBACVKUCCBC-IAGOWNOFSA-N 1 0 285.387 3.593 20 10 CHCDRO CN(C)c1ccc(C=C2CC[NH2+]CC2)c(C(F)(F)F)c1 ZINC001240878522 1130499739 /nfs/dbraw/zinc/49/97/39/1130499739.db2.gz QDNCXMTUSLCUID-UHFFFAOYSA-N 1 0 284.325 3.538 20 10 CHCDRO Cc1cc(C[N@H+]2CCCOC[C@@H]2C)c(O)c(C(C)(C)C)c1 ZINC000772822570 1130502143 /nfs/dbraw/zinc/50/21/43/1130502143.db2.gz QECBAIJMCHBMSL-AWEZNQCLSA-N 1 0 291.435 3.609 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2c(O)ccc3ccccc32)C[C@H](C2CC2)O1 ZINC000793214619 1130530128 /nfs/dbraw/zinc/53/01/28/1130530128.db2.gz PPHDCZPPVDQRFJ-BFUOFWGJSA-N 1 0 297.398 3.545 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CC[C@@]2(C)CC2(F)F)cc1Cl ZINC000827260826 1130530074 /nfs/dbraw/zinc/53/00/74/1130530074.db2.gz RSUDHRLEAIGHDT-ZDUSSCGKSA-N 1 0 289.753 3.879 20 10 CHCDRO C[C@@H]1C[C@@H](C)[NH+]1Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000793220161 1130530855 /nfs/dbraw/zinc/53/08/55/1130530855.db2.gz KQWJGVZTTRYELJ-GHMZBOCLSA-N 1 0 286.341 3.754 20 10 CHCDRO CCC[C@H]([NH2+]Cc1cccc(C)c1O)[C@H](O)c1ccccc1 ZINC000793237940 1130534049 /nfs/dbraw/zinc/53/40/49/1130534049.db2.gz HFIGVNGLPBENJM-PKOBYXMFSA-N 1 0 299.414 3.693 20 10 CHCDRO CC[N@@H+](Cc1cc(Cl)cc(OC)c1O)CC1CCC1 ZINC000793353831 1130543286 /nfs/dbraw/zinc/54/32/86/1130543286.db2.gz WGHAVPPFEFFJAK-UHFFFAOYSA-N 1 0 283.799 3.676 20 10 CHCDRO FC1(F)CC[NH+](Cc2ccc(N3CCCCC3)cc2)CC1 ZINC000793359473 1130545256 /nfs/dbraw/zinc/54/52/56/1130545256.db2.gz MRSNPYUQPIDZRT-UHFFFAOYSA-N 1 0 294.389 3.908 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](CC2CC2)CC2CCC2)c1 ZINC000793391412 1130552048 /nfs/dbraw/zinc/55/20/48/1130552048.db2.gz YDYOLUYEUHIODV-UHFFFAOYSA-N 1 0 289.419 3.803 20 10 CHCDRO CC1(C)CC[C@@H]1[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000793526129 1130563707 /nfs/dbraw/zinc/56/37/07/1130563707.db2.gz XGCSZWSQZJLZEK-INIZCTEOSA-N 1 0 290.476 3.518 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCc2ccc(O)cc21 ZINC000827347483 1130567931 /nfs/dbraw/zinc/56/79/31/1130567931.db2.gz QJNNVWIGIVMSTC-IBGZPJMESA-N 1 0 296.414 3.544 20 10 CHCDRO CC1=C[C@H](C)C[C@H](C[N@H+](C)Cc2ccccc2O)C1 ZINC000811458073 1130610371 /nfs/dbraw/zinc/61/03/71/1130610371.db2.gz TXCROBIXTJNZCR-ZFWWWQNUSA-N 1 0 259.393 3.816 20 10 CHCDRO CCCC[C@@H](C)[N@H+](C)Cc1cc(OCC)ccc1O ZINC000811521053 1130615858 /nfs/dbraw/zinc/61/58/58/1130615858.db2.gz YDSQUJMFYVNZKD-CYBMUJFWSA-N 1 0 265.397 3.801 20 10 CHCDRO COc1cc(C)cc(C[N@@H+]2CC[C@@H](C)C(C)(C)C2)c1O ZINC000759000125 1130633084 /nfs/dbraw/zinc/63/30/84/1130633084.db2.gz NBJMECMCHOOKJU-CYBMUJFWSA-N 1 0 277.408 3.577 20 10 CHCDRO COc1cc(C)cc(C[NH+]2CCC(C)(C3CC3)CC2)c1O ZINC000811785035 1130647196 /nfs/dbraw/zinc/64/71/96/1130647196.db2.gz SQLQDHULRFXXNP-UHFFFAOYSA-N 1 0 289.419 3.721 20 10 CHCDRO CC[C@H](Oc1ccc(N2CC[NH+](CC)CC2)cc1)C(C)C ZINC001234660083 1130669361 /nfs/dbraw/zinc/66/93/61/1130669361.db2.gz DBRGVTNJVPRMNL-SFHVURJKSA-N 1 0 290.451 3.642 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](C(C)C)[C@@H]2CCOC2)cc1C(C)C ZINC000812290153 1130682907 /nfs/dbraw/zinc/68/29/07/1130682907.db2.gz AFFJNONUZPACJT-MRXNPFEDSA-N 1 0 291.435 3.823 20 10 CHCDRO COC[C@@H]1CCC[N@@H+]1Cc1cccc(-c2ccccc2)c1O ZINC001234993221 1130699814 /nfs/dbraw/zinc/69/98/14/1130699814.db2.gz XIIPYNDOSRMBCB-KRWDZBQOSA-N 1 0 297.398 3.670 20 10 CHCDRO Oc1c(C[N@@H+]2CC[C@@H](F)C2)cccc1-c1ccccc1 ZINC001234996092 1130701487 /nfs/dbraw/zinc/70/14/87/1130701487.db2.gz UXUITVUPTOXCBI-OAHLLOKOSA-N 1 0 271.335 3.603 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+]CCCCF)c1O ZINC000812737706 1130710493 /nfs/dbraw/zinc/71/04/93/1130710493.db2.gz XZNBLRHORBTHQI-JTQLQIEISA-N 1 0 259.752 3.754 20 10 CHCDRO C=Cc1ccc(CC[NH2+]Cc2ccc(OCC)cc2O)cc1 ZINC000812773323 1130713407 /nfs/dbraw/zinc/71/34/07/1130713407.db2.gz UGYKOJIGSRGVTH-UHFFFAOYSA-N 1 0 297.398 3.766 20 10 CHCDRO CC[N@@H+](Cc1ccc(N2CCCCC2)cc1)C[C@H](C)OC ZINC000812807917 1130719854 /nfs/dbraw/zinc/71/98/54/1130719854.db2.gz MFAZUFKVRYZKIP-INIZCTEOSA-N 1 0 290.451 3.534 20 10 CHCDRO CCCC[N@H+](Cc1ccccc1O)CC1(COC)CCC1 ZINC000812842240 1130721701 /nfs/dbraw/zinc/72/17/01/1130721701.db2.gz RFLFHUMQSUQRBG-UHFFFAOYSA-N 1 0 291.435 3.811 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)CCC(F)(F)F)cc1 ZINC000781623328 1130731013 /nfs/dbraw/zinc/73/10/13/1130731013.db2.gz BTCWETXJNSFCNE-UHFFFAOYSA-N 1 0 288.357 3.917 20 10 CHCDRO Cc1ccccc1[C@H]1CCC[N@@H+]1Cc1ccc(N)cc1 ZINC001235443863 1130745606 /nfs/dbraw/zinc/74/56/06/1130745606.db2.gz POSPJXZJOYCMKQ-GOSISDBHSA-N 1 0 266.388 3.914 20 10 CHCDRO COc1ccc2c(c1)C[C@@H](C)[N@@H+](Cc1ccccc1O)[C@H]2C ZINC000781925935 1130748132 /nfs/dbraw/zinc/74/81/32/1130748132.db2.gz CJTVZJDFYBRCEK-KGLIPLIRSA-N 1 0 297.398 3.909 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)CSC(C)(C)C)c1 ZINC000813330908 1130760157 /nfs/dbraw/zinc/76/01/57/1130760157.db2.gz IYEBCFUWPRURAO-NEPJUHHUSA-N 1 0 297.464 3.972 20 10 CHCDRO Nc1ccc(C[N@@H+]2CC[C@H](c3cccc(Cl)c3)C2)cc1 ZINC001235949829 1130813778 /nfs/dbraw/zinc/81/37/78/1130813778.db2.gz JAUROBKJHYTTPD-HNNXBMFYSA-N 1 0 286.806 3.912 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CC[C@@H](C)C1)c1cc(Cl)ccc1O ZINC000783308225 1130815205 /nfs/dbraw/zinc/81/52/05/1130815205.db2.gz CJLLIKCIHGSVOR-JFGNBEQYSA-N 1 0 253.773 3.885 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CC[C@@H](C)C1)c1ccc(Br)cc1O ZINC000783311583 1130815582 /nfs/dbraw/zinc/81/55/82/1130815582.db2.gz XQPVLJZEMSYELR-CKYFFXLPSA-N 1 0 298.224 3.994 20 10 CHCDRO CCOC(C)(C)C[NH2+][C@@H](CC)c1cc(Cl)ccc1O ZINC000783313066 1130815624 /nfs/dbraw/zinc/81/56/24/1130815624.db2.gz MCQPZOLEUGKXKM-ZDUSSCGKSA-N 1 0 285.815 3.901 20 10 CHCDRO CC(C)CCC[N@@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000783507968 1130830329 /nfs/dbraw/zinc/83/03/29/1130830329.db2.gz KRHSKVZCJUBPTJ-QGZVFWFLSA-N 1 0 291.435 3.809 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1O)[C@H]1Oc2ccccc2[C@H]1C ZINC000783515988 1130832659 /nfs/dbraw/zinc/83/26/59/1130832659.db2.gz AHIPACQAKYBJRD-QJNYJZHLSA-N 1 0 297.398 3.996 20 10 CHCDRO C[C@H]([NH2+][C@H]1C[C@@H]1Cc1ccccc1)c1ccccc1O ZINC000783516094 1130832850 /nfs/dbraw/zinc/83/28/50/1130832850.db2.gz AXMLVLCJUQBXJM-QRTARXTBSA-N 1 0 267.372 3.674 20 10 CHCDRO Cc1cccc(F)c1C[NH2+][C@@H](C)c1ccccc1O ZINC000783519773 1130834237 /nfs/dbraw/zinc/83/42/37/1130834237.db2.gz XXKAHSVLBFKQOB-LBPRGKRZSA-N 1 0 259.324 3.691 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2c(O)ccc3ccccc32)[C@@H](C)[C@@H](C)O1 ZINC000783544125 1130836857 /nfs/dbraw/zinc/83/68/57/1130836857.db2.gz PJXUCEUYVZDABD-HZSPNIEDSA-N 1 0 285.387 3.543 20 10 CHCDRO Cc1cccc(C[N@H+](C)Cc2cc(F)ccc2O)c1C ZINC000814170235 1130839605 /nfs/dbraw/zinc/83/96/05/1130839605.db2.gz SNWBEHUJJCFVQR-UHFFFAOYSA-N 1 0 273.351 3.780 20 10 CHCDRO C[N@@H+](Cc1c(O)ccc2ccncc21)C[C@@H]1CC=CCC1 ZINC000784013128 1130868500 /nfs/dbraw/zinc/86/85/00/1130868500.db2.gz UEXMHCLAXUHMIW-CQSZACIVSA-N 1 0 282.387 3.729 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)[C@H]1C[C@@H]2[C@H](C1)C2(C)C ZINC001170760804 1130904534 /nfs/dbraw/zinc/90/45/34/1130904534.db2.gz JHILKWOBWCOGBY-QDMKHBRRSA-N 1 0 259.393 3.649 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+]C(C)(C)C(C)C)c1O ZINC000776167845 1130912597 /nfs/dbraw/zinc/91/25/97/1130912597.db2.gz GFLYNLBRQANVNV-UHFFFAOYSA-N 1 0 255.789 3.878 20 10 CHCDRO CS[C@H](C[NH2+]Cc1cc(Cl)ccc1O)C(C)(C)C ZINC000784625806 1130913758 /nfs/dbraw/zinc/91/37/58/1130913758.db2.gz IECSDRFIDDPGFN-CYBMUJFWSA-N 1 0 287.856 3.913 20 10 CHCDRO Cc1ccc([C@H](O)[C@@H](C)[NH2+][C@H](C)c2cc(C)ccc2O)cc1 ZINC000797058959 1130957509 /nfs/dbraw/zinc/95/75/09/1130957509.db2.gz ICXMPLALFBRECH-SPYBWZPUSA-N 1 0 299.414 3.782 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)[C@H](O)c1ccc(C)cc1)c1ccccc1O ZINC000797061393 1130957803 /nfs/dbraw/zinc/95/78/03/1130957803.db2.gz PXCASXXCQVZULN-FNHZYXHNSA-N 1 0 299.414 3.863 20 10 CHCDRO Cc1noc(C)c1[C@@H](C)[NH2+]Cc1ccc(N(C)C)c(C)c1 ZINC000815083365 1130957843 /nfs/dbraw/zinc/95/78/43/1130957843.db2.gz OHNHNXLSTJRMDR-GFCCVEGCSA-N 1 0 287.407 3.517 20 10 CHCDRO CCS[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(N(C)CC)cc1 ZINC000815116286 1130958543 /nfs/dbraw/zinc/95/85/43/1130958543.db2.gz HTUCZQBKITULBK-IAGOWNOFSA-N 1 0 292.492 3.907 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC2(C(F)(F)F)CC2)c(O)c1 ZINC000797070326 1130958841 /nfs/dbraw/zinc/95/88/41/1130958841.db2.gz KJLPCRDLTFJATB-JTQLQIEISA-N 1 0 273.298 3.694 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CC[C@@H](c3ccccn3)C2)cc1 ZINC000815107997 1130961576 /nfs/dbraw/zinc/96/15/76/1130961576.db2.gz RHQZJBULAFTNDR-QGZVFWFLSA-N 1 0 295.430 3.527 20 10 CHCDRO Cc1cc(O)c(CNc2cc3c(c[nH+]2)CCC3)cc1C ZINC000815159252 1130964075 /nfs/dbraw/zinc/96/40/75/1130964075.db2.gz OJLISOCFPLNUMH-UHFFFAOYSA-N 1 0 268.360 3.505 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]C[C@H]1CCC(F)(F)C1 ZINC000797469275 1130989036 /nfs/dbraw/zinc/98/90/36/1130989036.db2.gz YCNHQYVZNPAOJJ-VIFPVBQESA-N 1 0 275.726 3.571 20 10 CHCDRO COc1cccc(CC[NH2+][C@@H](C)c2c(C)cc(C)cc2O)c1 ZINC000815560353 1130999272 /nfs/dbraw/zinc/99/92/72/1130999272.db2.gz FQQJSGGWBZSWMS-HNNXBMFYSA-N 1 0 299.414 3.911 20 10 CHCDRO COc1cccc(CC[NH2+][C@H](C)c2c(C)cc(C)cc2O)c1 ZINC000815560354 1130999431 /nfs/dbraw/zinc/99/94/31/1130999431.db2.gz FQQJSGGWBZSWMS-OAHLLOKOSA-N 1 0 299.414 3.911 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CCc2ccc(C)nc2)c(O)c1 ZINC000815578420 1131001941 /nfs/dbraw/zinc/00/19/41/1131001941.db2.gz NXGRIPSHUCLPLD-HNNXBMFYSA-N 1 0 284.403 3.606 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2cc(C(C)C)no2)c(O)c1 ZINC000815580149 1131002320 /nfs/dbraw/zinc/00/23/20/1131002320.db2.gz DAXOTGAEGIMNKD-ZDUSSCGKSA-N 1 0 288.391 3.971 20 10 CHCDRO COC(C)(C)[C@@H](C)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000815570735 1131006777 /nfs/dbraw/zinc/00/67/77/1131006777.db2.gz LBWBLQXLUUYOMW-OAHLLOKOSA-N 1 0 290.451 3.580 20 10 CHCDRO CCc1ccc(C[N@@H+]2CCc3c(C)cccc3C2)c(O)c1 ZINC001236782881 1131006838 /nfs/dbraw/zinc/00/68/38/1131006838.db2.gz GKCSEPFRTXBOAY-UHFFFAOYSA-N 1 0 281.399 3.821 20 10 CHCDRO Cc1cc(F)ccc1[C@@H](C)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000815573230 1131008246 /nfs/dbraw/zinc/00/82/46/1131008246.db2.gz CEXJTUBKFHHOCH-CYBMUJFWSA-N 1 0 285.362 3.920 20 10 CHCDRO C[C@@]1(CF)CC[N@H+](Cc2cc(Cl)c(Cl)cc2[O-])C1 ZINC001236794238 1131008453 /nfs/dbraw/zinc/00/84/53/1131008453.db2.gz QSZQIPXYZGQYCE-ZDUSSCGKSA-N 1 0 292.181 3.881 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CC[C@@H](C)C[C@@H]2C)c(Cl)c1 ZINC001236800740 1131008893 /nfs/dbraw/zinc/00/88/93/1131008893.db2.gz AZPUYJHMRADJCG-MNOVXSKESA-N 1 0 283.799 3.675 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CC[C@@H]3CCC[C@H]3C2)c(Cl)c1 ZINC001236796640 1131008984 /nfs/dbraw/zinc/00/89/84/1131008984.db2.gz XIXYXZJCYXHDFI-RYUDHWBXSA-N 1 0 295.810 3.676 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CCC[C@@H](C)[C@@H]2C)c(Cl)c1 ZINC001236798219 1131009969 /nfs/dbraw/zinc/00/99/69/1131009969.db2.gz DFJRQULRTXIYCS-MNOVXSKESA-N 1 0 283.799 3.675 20 10 CHCDRO COC1(CC[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)CCC1 ZINC000815642153 1131014331 /nfs/dbraw/zinc/01/43/31/1131014331.db2.gz UBIDJBWPIZTOGE-AAEUAGOBSA-N 1 0 293.382 3.628 20 10 CHCDRO C[C@@H]([NH2+]CC[C@H](C)F)c1cc2c(cc1O)CCCC2 ZINC000815645456 1131015299 /nfs/dbraw/zinc/01/52/99/1131015299.db2.gz GEVMIJDHMBMGMI-NWDGAFQWSA-N 1 0 265.372 3.670 20 10 CHCDRO CC[C@@H]([NH2+]CC[C@@H](C)F)c1ccc(N(C)C)cc1 ZINC000815645534 1131015520 /nfs/dbraw/zinc/01/55/20/1131015520.db2.gz IXAPVWXQNNAZHT-IUODEOHRSA-N 1 0 252.377 3.541 20 10 CHCDRO Oc1cc2ccccc2cc1C[NH+]1CCC2(CCOC2)CC1 ZINC001236826051 1131017206 /nfs/dbraw/zinc/01/72/06/1131017206.db2.gz FQLYEIVLBZDBST-UHFFFAOYSA-N 1 0 297.398 3.548 20 10 CHCDRO CC1(C)CC[N@H+](Cc2cc3ccccc3cc2O)C1 ZINC001236836256 1131018368 /nfs/dbraw/zinc/01/83/68/1131018368.db2.gz BBEZDPGGPFABHD-UHFFFAOYSA-N 1 0 255.361 3.777 20 10 CHCDRO CO[C@H]1CCC[N@H+](Cc2cc3ccccc3cc2O)CC1 ZINC001236833063 1131019941 /nfs/dbraw/zinc/01/99/41/1131019941.db2.gz NRJBQADUZGNBJF-KRWDZBQOSA-N 1 0 285.387 3.546 20 10 CHCDRO C[N@H+](CCc1ccccn1)Cc1cc2ccccc2cc1O ZINC001236839665 1131022003 /nfs/dbraw/zinc/02/20/03/1131022003.db2.gz LAOSKEWTPWYKPF-UHFFFAOYSA-N 1 0 292.382 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ZINC000816531426 1131105878 /nfs/dbraw/zinc/10/58/78/1131105878.db2.gz RBZBHEOWFGMILK-UHFFFAOYSA-N 1 0 281.330 3.974 20 10 CHCDRO Cc1cccc(O)c1C[N@H+]1Cc2ccccc2C[C@H]1C ZINC001237493345 1131106000 /nfs/dbraw/zinc/10/60/00/1131106000.db2.gz XLFRCAQNIIKPRI-CQSZACIVSA-N 1 0 267.372 3.647 20 10 CHCDRO CC[C@]1(C)C[N@H+](Cc2ccc3ccccc3c2O)CCO1 ZINC000816586311 1131108009 /nfs/dbraw/zinc/10/80/09/1131108009.db2.gz FMGMZTAVFODULA-GOSISDBHSA-N 1 0 285.387 3.546 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2ccc3ccccc3c2O)nc1 ZINC000816589682 1131108665 /nfs/dbraw/zinc/10/86/65/1131108665.db2.gz FIOAPOXSZJVYJX-UHFFFAOYSA-N 1 0 292.382 3.881 20 10 CHCDRO CCc1cnc(C[NH2+]Cc2ccc3ccccc3c2O)s1 ZINC000816555167 1131109451 /nfs/dbraw/zinc/10/94/51/1131109451.db2.gz VZPOOGVTPLQKSL-UHFFFAOYSA-N 1 0 298.411 3.854 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H]1CC=C(C)CC1 ZINC000816592491 1131110346 /nfs/dbraw/zinc/11/03/46/1131110346.db2.gz LXEUJVDJVMXSLV-MRXNPFEDSA-N 1 0 258.409 3.861 20 10 CHCDRO CC(C)n1ccc(C[NH2+]Cc2ccc3ccccc3c2O)n1 ZINC000816552153 1131110368 /nfs/dbraw/zinc/11/03/68/1131110368.db2.gz CIZVCJRGXIULFR-UHFFFAOYSA-N 1 0 295.386 3.613 20 10 CHCDRO C[N@@H+](Cc1ccc2ccccc2c1O)C[C@H]1CCCC[C@@H]1O ZINC000816564944 1131111206 /nfs/dbraw/zinc/11/12/06/1131111206.db2.gz WCUYSYDAZVUTQY-QAPCUYQASA-N 1 0 299.414 3.528 20 10 CHCDRO Oc1c(C[NH2+]CCC2CCC2)ccc2ccccc21 ZINC000816557340 1131111323 /nfs/dbraw/zinc/11/13/23/1131111323.db2.gz MXTRLRRMMDGRHM-UHFFFAOYSA-N 1 0 255.361 3.825 20 10 CHCDRO Oc1c(C[NH2+][C@H]2CCC(F)(F)C2)ccc2ccccc21 ZINC000816557483 1131111843 /nfs/dbraw/zinc/11/18/43/1131111843.db2.gz RQMFLJRUDUSPPP-ZDUSSCGKSA-N 1 0 277.314 3.823 20 10 CHCDRO OCCCC1CC[NH+](Cc2ccc3ccccc3c2O)CC1 ZINC000816567349 1131112569 /nfs/dbraw/zinc/11/25/69/1131112569.db2.gz YMQQCTOUGBLVCM-UHFFFAOYSA-N 1 0 299.414 3.530 20 10 CHCDRO Cc1ccoc1C[NH2+]Cc1ccc2ccccc2c1O ZINC000816616757 1131115796 /nfs/dbraw/zinc/11/57/96/1131115796.db2.gz FUIREARCMWWODJ-UHFFFAOYSA-N 1 0 267.328 3.737 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CCC[C@@H](c2ccccc2)C1 ZINC000816619817 1131117661 /nfs/dbraw/zinc/11/76/61/1131117661.db2.gz WNUVCXJOSVGQTG-OAHLLOKOSA-N 1 0 285.362 3.911 20 10 CHCDRO CC1(C)CCC[C@@]1(O)C[NH2+]Cc1ccc2ccccc2c1O ZINC000816640824 1131117754 /nfs/dbraw/zinc/11/77/54/1131117754.db2.gz XXKQUQCGTWLADI-LJQANCHMSA-N 1 0 299.414 3.576 20 10 CHCDRO Cc1cc(Cl)cc(C[NH+]2C[C@@H]3CCC[C@H]3C2)c1O ZINC001237681792 1131126859 /nfs/dbraw/zinc/12/68/59/1131126859.db2.gz SHSXDIZWBBZBBM-RYUDHWBXSA-N 1 0 265.784 3.586 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2CCC[C@H](C(F)F)C2)c1O ZINC001237685075 1131127380 /nfs/dbraw/zinc/12/73/80/1131127380.db2.gz DWFPYGXKBYCYQG-JTQLQIEISA-N 1 0 289.753 3.831 20 10 CHCDRO Cc1cc(Cl)cc(C[NH+]2CC3CCC(CC3)C2)c1O ZINC001237687438 1131128832 /nfs/dbraw/zinc/12/88/32/1131128832.db2.gz AYUPKBACAFGUJP-UHFFFAOYSA-N 1 0 279.811 3.976 20 10 CHCDRO C[C@@H]1CCCCC[N@@H+]1Cc1cc(F)cc(Cl)c1[O-] ZINC001237814546 1131142397 /nfs/dbraw/zinc/14/23/97/1131142397.db2.gz 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/nfs/dbraw/zinc/16/69/84/1131166984.db2.gz TVJINPSCDFOPOQ-UHFFFAOYSA-N 1 0 253.361 3.708 20 10 CHCDRO CC[C@H]1CCCC[N@@H+]1Cc1cc(F)cc(C)c1O ZINC001238067918 1131167256 /nfs/dbraw/zinc/16/72/56/1131167256.db2.gz RSRCDWSNGHOAQX-AWEZNQCLSA-N 1 0 251.345 3.604 20 10 CHCDRO C[C@H]([NH2+]C1CCC([NH+](C)C)CC1)c1cc(Cl)ccc1O ZINC000817587625 1131174122 /nfs/dbraw/zinc/17/41/22/1131174122.db2.gz ZPHTYPIZNOTOHF-XGNXJENSSA-N 1 0 296.842 3.569 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CC12CCSCC2)c1ccccc1O ZINC000817590661 1131174848 /nfs/dbraw/zinc/17/48/48/1131174848.db2.gz ZOXZNMYCHBQCKV-QWHCGFSZSA-N 1 0 277.433 3.576 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CC23CCSCC3)c(O)c1 ZINC000817589589 1131175116 /nfs/dbraw/zinc/17/51/16/1131175116.db2.gz OQAKKOIVPSPAOI-UONOGXRCSA-N 1 0 291.460 3.885 20 10 CHCDRO Nc1ccc(CC[NH2+][C@@H]2CCc3ccc(Cl)cc32)cc1 ZINC000817955491 1131190105 /nfs/dbraw/zinc/19/01/05/1131190105.db2.gz CBFMIJLQQBOHKL-QGZVFWFLSA-N 1 0 286.806 3.742 20 10 CHCDRO Cc1ccccc1C[C@H]([NH2+]CCc1ccc(N)cc1)C1CC1 ZINC000817956720 1131190190 /nfs/dbraw/zinc/19/01/90/1131190190.db2.gz BEFYWXALZVYHNP-FQEVSTJZSA-N 1 0 294.442 3.731 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccc(N)cc1)C1CCCCC1 ZINC000817955452 1131190575 /nfs/dbraw/zinc/19/05/75/1131190575.db2.gz BEYKTCWMPQORNK-KRWDZBQOSA-N 1 0 260.425 3.760 20 10 CHCDRO C[C@@H](Cc1coc2ccccc12)[NH2+]CCc1ccc(N)cc1 ZINC000817958808 1131191062 /nfs/dbraw/zinc/19/10/62/1131191062.db2.gz YMCMQIXDLXCGGW-AWEZNQCLSA-N 1 0 294.398 3.778 20 10 CHCDRO Cc1ccc2c(c1)[C@H]([NH2+]CCc1ccc(N)cc1)CCC2 ZINC000817956327 1131191269 /nfs/dbraw/zinc/19/12/69/1131191269.db2.gz WMDUMLKUIFSMKT-LJQANCHMSA-N 1 0 280.415 3.787 20 10 CHCDRO CC1(C)[C@H]([NH2+]CCc2ccc(N)cc2)C[C@H]1c1ccccc1 ZINC000817956960 1131191616 /nfs/dbraw/zinc/19/16/16/1131191616.db2.gz GLLIRRKXLLEOEO-RBUKOAKNSA-N 1 0 294.442 3.983 20 10 CHCDRO CC1(C)[C@@H](c2ccccc2)C[C@@H]1[NH2+]CCc1ccc(N)cc1 ZINC000817956954 1131191621 /nfs/dbraw/zinc/19/16/21/1131191621.db2.gz GLLIRRKXLLEOEO-MOPGFXCFSA-N 1 0 294.442 3.983 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccc(N)cc1)c1cc(Cl)ccc1O ZINC000817958542 1131191686 /nfs/dbraw/zinc/19/16/86/1131191686.db2.gz XAZWMDXINYECOZ-LLVKDONJSA-N 1 0 290.794 3.521 20 10 CHCDRO CCCC[C@H](CN)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000817962242 1131192805 /nfs/dbraw/zinc/19/28/05/1131192805.db2.gz JUWINJSGYVBXRE-DZGCQCFKSA-N 1 0 286.419 3.714 20 10 CHCDRO CCn1ccnc1[C@H](C)[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C ZINC001117831516 1131203971 /nfs/dbraw/zinc/20/39/71/1131203971.db2.gz PGMXPGMBCWMETE-MELADBBJSA-N 1 0 299.418 3.816 20 10 CHCDRO Cc1cc(Br)cc([C@H](C)[NH2+][C@H]2CC23CC3)c1O ZINC000818355368 1131210495 /nfs/dbraw/zinc/21/04/95/1131210495.db2.gz DORZBRTWZYHRAG-CABZTGNLSA-N 1 0 296.208 3.666 20 10 CHCDRO C[C@H]([NH2+][C@H]1CC12CC2)c1ccc(N2CCCCC2)cc1 ZINC000818356698 1131211708 /nfs/dbraw/zinc/21/17/08/1131211708.db2.gz PWVPCOZRZYZBRK-YOEHRIQHSA-N 1 0 270.420 3.880 20 10 CHCDRO COCC1(CC[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)CC1 ZINC001118238518 1131216001 /nfs/dbraw/zinc/21/60/01/1131216001.db2.gz JPSQWNMPYJOZLL-ZIAGYGMSSA-N 1 0 289.419 3.655 20 10 CHCDRO C[C@@H]([NH2+]CCCCF)c1ccc(Br)cc1O ZINC000390427082 1131219943 /nfs/dbraw/zinc/21/99/43/1131219943.db2.gz MZNRBJYMAOVMSN-SECBINFHSA-N 1 0 290.176 3.555 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2C[C@@H]3[C@H](C2)C3(F)F)c(O)c1C ZINC001118489347 1131228768 /nfs/dbraw/zinc/22/87/68/1131228768.db2.gz JVLIIGYHVKCSHV-VTPLQMEGSA-N 1 0 281.346 3.703 20 10 CHCDRO CC[C@H]([NH2+][C@H]1C[C@@H]2[C@H](C1)C2(F)F)c1ccc(N(C)C)cc1 ZINC001118489237 1131228791 /nfs/dbraw/zinc/22/87/91/1131228791.db2.gz HMVFJIUUERZUSN-UKMLZYKCSA-N 1 0 294.389 3.837 20 10 CHCDRO CCN(Cc1ccccc1O)Cc1c(F)ccc(F)c1F ZINC001137932256 1131438525 /nfs/dbraw/zinc/43/85/25/1131438525.db2.gz PIJOMHUSGHRROJ-UHFFFAOYSA-N 1 0 295.304 3.832 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+]CCCC(C)(F)F)c1O ZINC000824477513 1131470451 /nfs/dbraw/zinc/47/04/51/1131470451.db2.gz UDTZLVHLBODVKR-UHFFFAOYSA-N 1 0 277.742 3.879 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C[C@H]2CSc3ccccc32)c1 ZINC000824484042 1131470499 /nfs/dbraw/zinc/47/04/99/1131470499.db2.gz YTJLDLIIDXPDKE-AWEZNQCLSA-N 1 0 285.412 3.680 20 10 CHCDRO CC1CC([N@H+](C)Cc2ccc(N3CCCCC3)cc2)C1 ZINC001138215509 1131478105 /nfs/dbraw/zinc/47/81/05/1131478105.db2.gz IBOHSTBMLGGUCI-UHFFFAOYSA-N 1 0 272.436 3.907 20 10 CHCDRO CS[C@@H]1CC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000824683767 1131479796 /nfs/dbraw/zinc/47/97/96/1131479796.db2.gz UUJXRFSSFQKPJT-QGZVFWFLSA-N 1 0 290.476 3.614 20 10 CHCDRO CS[C@H]1CC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC000824683766 1131479927 /nfs/dbraw/zinc/47/99/27/1131479927.db2.gz UUJXRFSSFQKPJT-KRWDZBQOSA-N 1 0 290.476 3.614 20 10 CHCDRO Cc1c(C[N@@H+]2C[C@@H](C)C[C@H]2CF)c2ccccc2n1C ZINC001138252537 1131482421 /nfs/dbraw/zinc/48/24/21/1131482421.db2.gz KKKHHVKCXSOMRY-JSGCOSHPSA-N 1 0 274.383 3.667 20 10 CHCDRO Cc1c(C[N@@H+]2CCC[C@@H](CF)C2)c2ccccc2n1C ZINC001138257073 1131483532 /nfs/dbraw/zinc/48/35/32/1131483532.db2.gz USRSKNIZKFSAJO-AWEZNQCLSA-N 1 0 274.383 3.668 20 10 CHCDRO CN1CCCc2cc(C[N@H+](C)CCc3ccccc3)ccc21 ZINC001138354808 1131494129 /nfs/dbraw/zinc/49/41/29/1131494129.db2.gz VUMJQAPECPWCFV-UHFFFAOYSA-N 1 0 294.442 3.744 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]Cc2cnc(C3CC3)o2)cc1 ZINC000825172538 1131501028 /nfs/dbraw/zinc/50/10/28/1131501028.db2.gz WUFUITPDIYYMMC-UHFFFAOYSA-N 1 0 299.418 3.688 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](C)[C@H](C)c2cccnc2)cc1Cl ZINC000825502336 1131513247 /nfs/dbraw/zinc/51/32/47/1131513247.db2.gz WPPNXNWFSHXGFV-GFCCVEGCSA-N 1 0 290.794 3.942 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CCC[C@H]2CCCCO2)cc1Cl ZINC000825514106 1131514212 /nfs/dbraw/zinc/51/42/12/1131514212.db2.gz LSRSQESKVVKCRY-CQSZACIVSA-N 1 0 297.826 3.793 20 10 CHCDRO Cc1cc(C[N@@H+]2CCc3cccc(O)c3C2)c(C)s1 ZINC001138570999 1131522210 /nfs/dbraw/zinc/52/22/10/1131522210.db2.gz SBEDLRFDMJAXPR-UHFFFAOYSA-N 1 0 273.401 3.629 20 10 CHCDRO Cc1cc(C[N@@H+]2CCC[C@]3(CC3(F)F)C2)ccc1N(C)C ZINC000844443687 1131566362 /nfs/dbraw/zinc/56/63/62/1131566362.db2.gz KYWQGYVTERAJIC-INIZCTEOSA-N 1 0 294.389 3.682 20 10 CHCDRO Oc1cc2c(cc1C[N@@H+]1CC[C@]3(CC3(F)F)C1)CCCC2 ZINC000844756271 1131596444 /nfs/dbraw/zinc/59/64/44/1131596444.db2.gz JPQLHOBKMXPEPK-INIZCTEOSA-N 1 0 293.357 3.502 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]CC[C@@H]2CCc3ccccc3N2)c1 ZINC000844904788 1131606173 /nfs/dbraw/zinc/60/61/73/1131606173.db2.gz QVYXUYYKKSXGRR-KRWDZBQOSA-N 1 0 296.414 3.607 20 10 CHCDRO CCc1cccc(C[N@@H+]2CCCc3cc(O)c(O)cc3C2)c1 ZINC001144326899 1131619218 /nfs/dbraw/zinc/61/92/18/1131619218.db2.gz ZZLOXPCXMGTVRH-UHFFFAOYSA-N 1 0 297.398 3.609 20 10 CHCDRO CCOc1ccc(C)cc1C[N@@H+]1CCc2cccc(O)c2C1 ZINC001139607338 1131621969 /nfs/dbraw/zinc/62/19/69/1131621969.db2.gz OGEZDUWGLNJLRG-UHFFFAOYSA-N 1 0 297.398 3.658 20 10 CHCDRO Cc1cc(C[N@H+]2CCC[C@@H](C)[C@@H]2C)ccc1N(C)C ZINC001139672315 1131627036 /nfs/dbraw/zinc/62/70/36/1131627036.db2.gz VLUNCWMXBTYENT-HIFRSBDPSA-N 1 0 260.425 3.681 20 10 CHCDRO Oc1cccc(Br)c1C[NH+]1CCC2(CC2)CC1 ZINC001140100337 1131664311 /nfs/dbraw/zinc/66/43/11/1131664311.db2.gz LQUFDXSHYGVIIH-UHFFFAOYSA-N 1 0 296.208 3.531 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCC[C@@H]2c2ccncc2)c1O ZINC001140178895 1131672916 /nfs/dbraw/zinc/67/29/16/1131672916.db2.gz BTONJEDMLMUIFU-QGZVFWFLSA-N 1 0 282.387 3.741 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCC[C@H]2c2cccnc2)c1O ZINC001140178630 1131673291 /nfs/dbraw/zinc/67/32/91/1131673291.db2.gz RPGXTHYGMPTNRJ-KRWDZBQOSA-N 1 0 282.387 3.741 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccncc1 ZINC000834549239 1131682721 /nfs/dbraw/zinc/68/27/21/1131682721.db2.gz ZMPQBEKPAXWVHG-GOSISDBHSA-N 1 0 295.430 3.705 20 10 CHCDRO CC(C)[C@H]1C[C@@H]([NH2+]Cc2cc(Cl)ccc2O)CS1 ZINC000846054485 1131685115 /nfs/dbraw/zinc/68/51/15/1131685115.db2.gz BZEKFQFHSNGLNZ-TZMCWYRMSA-N 1 0 285.840 3.665 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CC[C@@]3(CC3(F)F)C2)c(Cl)c1 ZINC000846117848 1131688224 /nfs/dbraw/zinc/68/82/24/1131688224.db2.gz RWJPIGWUHHHBAE-CYBMUJFWSA-N 1 0 287.737 3.585 20 10 CHCDRO Cc1ccc2c(c1)[C@H]([NH2+][C@H]1CCc3cccc(O)c31)CC2 ZINC000834639754 1131689844 /nfs/dbraw/zinc/68/98/44/1131689844.db2.gz ASQRMYFGIKFAKU-SJORKVTESA-N 1 0 279.383 3.965 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]C[C@H](C)C(C)(C)C)c1O ZINC000846148432 1131691464 /nfs/dbraw/zinc/69/14/64/1131691464.db2.gz ZIGOHEVVVGOOSO-NWDGAFQWSA-N 1 0 265.397 3.734 20 10 CHCDRO CC[C@H](C)C[C@@H](C)[NH2+][C@@H](C)c1cccc(OC)c1O ZINC000846155035 1131692327 /nfs/dbraw/zinc/69/23/27/1131692327.db2.gz OTQBOJYYBBXLPP-XQQFMLRXSA-N 1 0 265.397 3.876 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@@H]1C[C@@H]1Cc1ccccc1)CC2 ZINC000834668723 1131692588 /nfs/dbraw/zinc/69/25/88/1131692588.db2.gz NPXIEZDEVQWONS-GVDBMIGSSA-N 1 0 279.383 3.600 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CC2CCC(F)(F)CC2)c1O ZINC000846167431 1131692915 /nfs/dbraw/zinc/69/29/15/1131692915.db2.gz KBLMWLXCTGLUMK-NSHDSACASA-N 1 0 299.361 3.877 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H]2C[C@H](c3ccccc3)C2)c1O ZINC000846166995 1131693183 /nfs/dbraw/zinc/69/31/83/1131693183.db2.gz FWSYLQATJHKWDS-BPUTZDHNSA-N 1 0 297.398 3.998 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]C[C@@H]2CCCC(F)(F)C2)c1O ZINC000846166876 1131693203 /nfs/dbraw/zinc/69/32/03/1131693203.db2.gz DSAKGDWLFGHICS-VXGBXAGGSA-N 1 0 299.361 3.877 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H]2CCCC[C@@H]2C)c1O ZINC000846135295 1131693957 /nfs/dbraw/zinc/69/39/57/1131693957.db2.gz BANNFDAISPZTIO-SGMGOOAPSA-N 1 0 263.381 3.630 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CCc2ccccc2C)c1O ZINC000846136485 1131694174 /nfs/dbraw/zinc/69/41/74/1131694174.db2.gz IVUMRDJVHHPZPQ-CQSZACIVSA-N 1 0 285.387 3.603 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]Cc2ccc(C)cc2)c1O ZINC000846135503 1131694191 /nfs/dbraw/zinc/69/41/91/1131694191.db2.gz DCTHFUKWBJFFMJ-CYBMUJFWSA-N 1 0 271.360 3.560 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@H](C)C2CCCC2)c1O ZINC000846144850 1131694783 /nfs/dbraw/zinc/69/47/83/1131694783.db2.gz MINVRIHSPWSSHZ-VXGBXAGGSA-N 1 0 263.381 3.630 20 10 CHCDRO CC[C@@H]1CCC[C@H]1[NH2+][C@@H](C)c1cccc(OC)c1O ZINC000846143868 1131694864 /nfs/dbraw/zinc/69/48/64/1131694864.db2.gz AGGOVKXCOJZXTC-OUCADQQQSA-N 1 0 263.381 3.630 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CCc2cccc(C)c2)c1O ZINC000846141495 1131694916 /nfs/dbraw/zinc/69/49/16/1131694916.db2.gz KHOHTEASUFXJHK-AWEZNQCLSA-N 1 0 285.387 3.603 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@@H](C)c2nc(C)cs2)c1O ZINC000846146676 1131694940 /nfs/dbraw/zinc/69/49/40/1131694940.db2.gz SDXJXSJKJDBORR-MNOVXSKESA-N 1 0 292.404 3.578 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]Cc2ccc(C)s2)c1O ZINC000846141596 1131695133 /nfs/dbraw/zinc/69/51/33/1131695133.db2.gz QWZICCULZIWGFB-LLVKDONJSA-N 1 0 277.389 3.622 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)[C@](C)(O)c2ccccc2)c1 ZINC000846188668 1131697437 /nfs/dbraw/zinc/69/74/37/1131697437.db2.gz OGDPAMVRULKMGR-KHYOSLBOSA-N 1 0 299.414 3.647 20 10 CHCDRO C[C@H]([NH2+]CC[C@]1(C)C[C@@]1(F)Cl)c1ccccc1O ZINC000846185851 1131697641 /nfs/dbraw/zinc/69/76/41/1131697641.db2.gz UDTRKNACVWEWIU-GDLCADMTSA-N 1 0 271.763 3.748 20 10 CHCDRO C[C@]1(CC[NH2+][C@H]2CCc3cccc(O)c32)C[C@@]1(F)Cl ZINC000846184288 1131697694 /nfs/dbraw/zinc/69/76/94/1131697694.db2.gz JLMWVOXKMZKOTB-CQDKDKBSSA-N 1 0 283.774 3.674 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@@](C)(O)c2ccccc2)c(O)c1 ZINC000846187847 1131697753 /nfs/dbraw/zinc/69/77/53/1131697753.db2.gz LPSNANGIFPGXFU-YZVOILCLSA-N 1 0 299.414 3.647 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H](C)[C@@](C)(O)c2ccccc2)c(O)c1 ZINC000846187846 1131697817 /nfs/dbraw/zinc/69/78/17/1131697817.db2.gz LPSNANGIFPGXFU-QMTMVMCOSA-N 1 0 299.414 3.647 20 10 CHCDRO Cc1ccccc1[C@@H]1C[C@H]1[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000846190334 1131698415 /nfs/dbraw/zinc/69/84/15/1131698415.db2.gz QNTGUZPIEKZJDY-GVDBMIGSSA-N 1 0 279.383 3.834 20 10 CHCDRO CS[C@@H](C[NH2+][C@H]1CCc2cccc(O)c21)C(C)(C)C ZINC000834759894 1131703209 /nfs/dbraw/zinc/70/32/09/1131703209.db2.gz GPQOGVZQIJIAGS-JSGCOSHPSA-N 1 0 279.449 3.747 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@@H]1Cc3ccc(Cl)cc3C1)CC2 ZINC000834793990 1131706334 /nfs/dbraw/zinc/70/63/34/1131706334.db2.gz LOGGGDUKXSVCHI-HZPDHXFCSA-N 1 0 299.801 3.790 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCn2ccnc21)c1ccc2ccccc2c1O ZINC000834832814 1131709573 /nfs/dbraw/zinc/70/95/73/1131709573.db2.gz RNPDTSYTIKDVIZ-WBMJQRKESA-N 1 0 293.370 3.538 20 10 CHCDRO Cc1cc(C[NH2+][C@H](C)c2cc(Cl)ccc2O)ccn1 ZINC000834859591 1131712993 /nfs/dbraw/zinc/71/29/93/1131712993.db2.gz FCBFSFRRTLSQSD-LLVKDONJSA-N 1 0 276.767 3.600 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)CC(C)(C)O)c1cc(Cl)ccc1O ZINC000834876785 1131716250 /nfs/dbraw/zinc/71/62/50/1131716250.db2.gz OTPWQXBOEGBKEL-ZWNOBZJWSA-N 1 0 285.815 3.636 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCCc2ncccc2C)c(O)c1C ZINC000834883384 1131717687 /nfs/dbraw/zinc/71/76/87/1131717687.db2.gz KEUYZHGCUYRFJN-INIZCTEOSA-N 1 0 298.430 3.996 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCO[C@H](C(C)C)C2)c1 ZINC000834887225 1131719627 /nfs/dbraw/zinc/71/96/27/1131719627.db2.gz ZXLCPPUPWRXTGL-DAYGRLMNSA-N 1 0 291.435 3.802 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1C[C@H](C)n2ccnc21)c1ccc(C)cc1O ZINC000834895821 1131720840 /nfs/dbraw/zinc/72/08/40/1131720840.db2.gz RVIDWFLDJIOEBP-AEGPPILISA-N 1 0 285.391 3.644 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H]2C[C@H](C)n3ccnc32)cc1 ZINC000834896822 1131722475 /nfs/dbraw/zinc/72/24/75/1131722475.db2.gz OBQLUQQGZLRMIB-ZQIUZPCESA-N 1 0 298.434 3.696 20 10 CHCDRO C[C@@H]([NH2+]C1(Cc2ccc(F)cc2)CC1)c1ccccc1O ZINC000834897895 1131724152 /nfs/dbraw/zinc/72/41/52/1131724152.db2.gz WVPOGGLXDXPLOD-CYBMUJFWSA-N 1 0 285.362 3.957 20 10 CHCDRO CC[N@H+](Cc1ccc2c(c1)CCC2)Cc1ccccc1O ZINC001203035032 1131724545 /nfs/dbraw/zinc/72/45/45/1131724545.db2.gz NYDJJUKJRZTBBY-UHFFFAOYSA-N 1 0 281.399 3.903 20 10 CHCDRO CCc1ncc(C[NH2+][C@H](CC)c2ccc(N(C)C)cc2)o1 ZINC000834901098 1131726084 /nfs/dbraw/zinc/72/60/84/1131726084.db2.gz WUJARTRKRRJUKF-MRXNPFEDSA-N 1 0 287.407 3.544 20 10 CHCDRO CC[C@H]([NH2+]CC(C)(C)C(C)(C)O)c1cc(Cl)ccc1O ZINC000834904266 1131728655 /nfs/dbraw/zinc/72/86/55/1131728655.db2.gz NWGCZSIDSYVMNM-ZDUSSCGKSA-N 1 0 299.842 3.883 20 10 CHCDRO C[C@@H]([NH2+]CC(C)(C)C1(O)CCCC1)c1cc(F)ccc1O ZINC000834906195 1131728742 /nfs/dbraw/zinc/72/87/42/1131728742.db2.gz NPNWDIVEUCYPRD-GFCCVEGCSA-N 1 0 295.398 3.513 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1COCC1(C)C)c1cc(Cl)ccc1O ZINC000834905776 1131728874 /nfs/dbraw/zinc/72/88/74/1131728874.db2.gz WLOLUZLVYDYMRJ-GXTWGEPZSA-N 1 0 283.799 3.511 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccc(C)cn1)c1ccc(C)cc1O ZINC000834909077 1131730813 /nfs/dbraw/zinc/73/08/13/1131730813.db2.gz KHMSGOWULFSKBD-QGZVFWFLSA-N 1 0 284.403 3.687 20 10 CHCDRO CCO[C@@H]1CCC[C@H]1[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000834914825 1131732713 /nfs/dbraw/zinc/73/27/13/1131732713.db2.gz WRJBXAFMAFJKPM-IKVITTDRSA-N 1 0 293.382 3.627 20 10 CHCDRO Oc1cc(Cl)ccc1C[N@@H+]1CCC[C@@H]1c1ccccn1 ZINC001140464124 1131750530 /nfs/dbraw/zinc/75/05/30/1131750530.db2.gz CIFNWKQUCMGFOH-OAHLLOKOSA-N 1 0 288.778 3.778 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]CCc2ccsc2)cc1 ZINC000835035137 1131760317 /nfs/dbraw/zinc/76/03/17/1131760317.db2.gz FYCQROGMKRZNHZ-ARJAWSKDSA-N 1 0 286.444 3.660 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]Cc2ccc(Cl)o2)cc1 ZINC000835033342 1131760433 /nfs/dbraw/zinc/76/04/33/1131760433.db2.gz SKRIHLPAMOWHBQ-ARJAWSKDSA-N 1 0 290.794 3.802 20 10 CHCDRO Cc1ccncc1[C@H](C)[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC000835042203 1131762002 /nfs/dbraw/zinc/76/20/02/1131762002.db2.gz FBQIMIPXEBBQQN-KJPDOMRESA-N 1 0 295.430 3.820 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]CCCC(F)(F)F)cc1 ZINC000835039865 1131762115 /nfs/dbraw/zinc/76/21/15/1131762115.db2.gz LFWHRBMVWNQTNU-HYXAFXHYSA-N 1 0 286.341 3.698 20 10 CHCDRO Cc1noc(C)c1[C@H](C)[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC000835040235 1131762354 /nfs/dbraw/zinc/76/23/54/1131762354.db2.gz OICSMSZYKAAAFB-YBJDMEARSA-N 1 0 299.418 3.721 20 10 CHCDRO C[C@@H](c1ccccn1)[N@H+](C)C/C=C\c1ccc(N(C)C)cc1 ZINC000835043619 1131762865 /nfs/dbraw/zinc/76/28/65/1131762865.db2.gz ADNRAIJETNOKQX-PTZVLDCSSA-N 1 0 295.430 3.854 20 10 CHCDRO C[C@H]1CC[N@H+](C/C=C\c2ccc(N(C)C)cc2)CCS1 ZINC000835049788 1131764941 /nfs/dbraw/zinc/76/49/41/1131764941.db2.gz STKOCIBOBBUGLU-XVWMLYKFSA-N 1 0 290.476 3.593 20 10 CHCDRO C[C@@H]1CCSCC[N@@H+]1C/C=C\c1ccc(N(C)C)cc1 ZINC000835049396 1131765039 /nfs/dbraw/zinc/76/50/39/1131765039.db2.gz RDRBANMEMZXUEO-FOSCPCJNSA-N 1 0 290.476 3.593 20 10 CHCDRO C[C@H]1C[N@H+](C/C=C\c2ccc(N(C)C)cc2)CCC1(F)F ZINC000835052568 1131766982 /nfs/dbraw/zinc/76/69/82/1131766982.db2.gz HGIPBKOSEGXUTD-WSNITJDQSA-N 1 0 294.389 3.743 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]C2(C3(C)CC3)CC2)cc1 ZINC000835053434 1131767270 /nfs/dbraw/zinc/76/72/70/1131767270.db2.gz CGQLPKUPUCPCMQ-SNAWJCMRSA-N 1 0 270.420 3.688 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+]CCC2CC(F)(F)C2)c1O ZINC000835061151 1131768286 /nfs/dbraw/zinc/76/82/86/1131768286.db2.gz XDEHRPWIRFLZMX-UHFFFAOYSA-N 1 0 289.753 3.879 20 10 CHCDRO CN(C)c1ccc(O[C@H](CC[NH+](C)C)c2ccccc2)cc1 ZINC001227939466 1131772237 /nfs/dbraw/zinc/77/22/37/1131772237.db2.gz WMBSCUNCNSKIQH-LJQANCHMSA-N 1 0 298.430 3.824 20 10 CHCDRO Cc1ccc(O)c(C[NH+]2CCC3(CC(F)(F)C3)CC2)c1 ZINC001140619661 1131830208 /nfs/dbraw/zinc/83/02/08/1131830208.db2.gz JIEJTUMDRJMCKY-UHFFFAOYSA-N 1 0 281.346 3.712 20 10 CHCDRO Cc1c(O)ccc(C[N@@H+]2Cc3ccccc3[C@@H](C)C2)c1O ZINC001140742179 1131905717 /nfs/dbraw/zinc/90/57/17/1131905717.db2.gz JLWUIYNQCNUAFS-LBPRGKRZSA-N 1 0 283.371 3.526 20 10 CHCDRO C[C@H]([NH2+]CC1Cc2ccccc2C1)c1ccc(N(C)C)cc1 ZINC000773007964 1131917401 /nfs/dbraw/zinc/91/74/01/1131917401.db2.gz KABBNWDCZARAAU-HNNXBMFYSA-N 1 0 294.442 3.818 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@@](C)(F)C2)c(O)c1 ZINC001140850083 1131945883 /nfs/dbraw/zinc/94/58/83/1131945883.db2.gz CTAZQJVHIVRVDK-QGZVFWFLSA-N 1 0 294.414 3.562 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CC2(C3CC3)CC2)cc1 ZINC000773097626 1131946422 /nfs/dbraw/zinc/94/64/22/1131946422.db2.gz HCPYEIZKIVECCS-CQSZACIVSA-N 1 0 272.436 3.984 20 10 CHCDRO CC[C@@H]1CCC[N@H+](Cc2ccc(N(CC)CC)cc2O)C1 ZINC001140856356 1131948420 /nfs/dbraw/zinc/94/84/20/1131948420.db2.gz YUPQYPMYKJNBLC-OAHLLOKOSA-N 1 0 290.451 3.860 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CC[C@@H](C)C[C@@H]2C)c(O)c1 ZINC001140856343 1131949216 /nfs/dbraw/zinc/94/92/16/1131949216.db2.gz YNPDZGGLYAEWFX-CABCVRRESA-N 1 0 290.451 3.859 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CC3CCC2CC3)c(O)c1 ZINC001140856308 1131949330 /nfs/dbraw/zinc/94/93/30/1131949330.db2.gz WZJLZUSTWAKKAF-UHFFFAOYSA-N 1 0 288.435 3.613 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)C(C)(C)C)c(Cl)c1 ZINC001140925088 1131965055 /nfs/dbraw/zinc/96/50/55/1131965055.db2.gz ZIFOCVPIARSOJW-UHFFFAOYSA-N 1 0 254.805 3.636 20 10 CHCDRO Cc1ccc(C[N@@H+]2CCc3ccc(Cl)cc3C2)c(O)c1 ZINC001140948703 1131969535 /nfs/dbraw/zinc/96/95/35/1131969535.db2.gz WMMFEHPPJYBTDV-UHFFFAOYSA-N 1 0 287.790 3.912 20 10 CHCDRO Cc1ccc(C[N@@H+]2CCCC[C@H]2c2cccnc2)c(O)c1 ZINC001140950054 1131970032 /nfs/dbraw/zinc/97/00/32/1131970032.db2.gz SPVFWZCTYRCBPU-KRWDZBQOSA-N 1 0 282.387 3.823 20 10 CHCDRO CC[N@H+](Cc1ccccc1)Cc1ccc(C)cc1O ZINC001140948519 1131970617 /nfs/dbraw/zinc/97/06/17/1131970617.db2.gz LIXIYQLURJQKKB-UHFFFAOYSA-N 1 0 255.361 3.723 20 10 CHCDRO Cc1ccc(CN2Cc3cccc(Cl)c3C2)c(O)c1 ZINC001140957520 1131973501 /nfs/dbraw/zinc/97/35/01/1131973501.db2.gz CHVRICSUCSQQNU-UHFFFAOYSA-N 1 0 273.763 3.870 20 10 CHCDRO Cc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(C)nc2)c(O)c1 ZINC001140958357 1131973979 /nfs/dbraw/zinc/97/39/79/1131973979.db2.gz YZKOLBAYWWTMRE-KRWDZBQOSA-N 1 0 282.387 3.741 20 10 CHCDRO CCCCC[C@@H](C)[NH2+]Cc1cccc(OCC)c1O ZINC000036792352 1131976999 /nfs/dbraw/zinc/97/69/99/1131976999.db2.gz SLLDCBMQHKRXPB-CYBMUJFWSA-N 1 0 265.397 3.849 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)c1ccccc1O)c1ccc2c(c1)OCO2 ZINC000036982035 1131985870 /nfs/dbraw/zinc/98/58/70/1131985870.db2.gz MZXIFUIRUKYDSY-RYUDHWBXSA-N 1 0 285.343 3.533 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccccc1O)c1ccccc1OC ZINC000036995044 1131987050 /nfs/dbraw/zinc/98/70/50/1131987050.db2.gz GFNOZOBEPQKFHF-OAHLLOKOSA-N 1 0 271.360 3.642 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCCC[C@H]2C)c1 ZINC000037021618 1131989351 /nfs/dbraw/zinc/98/93/51/1131989351.db2.gz XJZGYMOCTLLUNG-TYNCELHUSA-N 1 0 263.381 3.630 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccns2)c(O)c1 ZINC000715966740 1132000587 /nfs/dbraw/zinc/00/05/87/1132000587.db2.gz OTINCXQRUSSSBO-QWRGUYRKSA-N 1 0 262.378 3.569 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccns2)c(O)c1 ZINC000715966736 1132000796 /nfs/dbraw/zinc/00/07/96/1132000796.db2.gz OTINCXQRUSSSBO-GHMZBOCLSA-N 1 0 262.378 3.569 20 10 CHCDRO CN(C)c1ccc(C[NH2+]CC2C[C@H]3CC[C@@H](C2)S3)cc1 ZINC000716065563 1132004895 /nfs/dbraw/zinc/00/48/95/1132004895.db2.gz ULMQJQOVNWZVPU-ZXFUBFMLSA-N 1 0 290.476 3.516 20 10 CHCDRO c1ccc([C@@H]([NH2+]Cc2ccc3c(c2)CCO3)C2CC2)cc1 ZINC000037363405 1132029893 /nfs/dbraw/zinc/02/98/93/1132029893.db2.gz XFWPMRXJRMJSMJ-LJQANCHMSA-N 1 0 279.383 3.862 20 10 CHCDRO Oc1ccc(O)c(C[NH+]2CCC(c3cccs3)CC2)c1 ZINC001141158781 1132030617 /nfs/dbraw/zinc/03/06/17/1132030617.db2.gz NCTMDMAPEVSNLD-UHFFFAOYSA-N 1 0 289.400 3.539 20 10 CHCDRO CC1(c2ccccc2)CC[NH+](Cc2cc(O)ccc2O)CC1 ZINC001141162625 1132031255 /nfs/dbraw/zinc/03/12/55/1132031255.db2.gz XWGNAAKVJXWTTN-UHFFFAOYSA-N 1 0 297.398 3.652 20 10 CHCDRO CCc1ccccc1C[N@@H+]1CCc2cccc(O)c2C1 ZINC001141227706 1132050849 /nfs/dbraw/zinc/05/08/49/1132050849.db2.gz FPNMZBPYXYDYTK-UHFFFAOYSA-N 1 0 267.372 3.513 20 10 CHCDRO CCc1cc(Nc2ccc(C(F)(F)F)cc2O)cc[nH+]1 ZINC001212632291 1132115964 /nfs/dbraw/zinc/11/59/64/1132115964.db2.gz RDMUGVJKIJMBPF-UHFFFAOYSA-N 1 0 282.265 3.534 20 10 CHCDRO COc1ccc(C[NH2+][C@H]2CSc3ccccc3C2)cc1C ZINC001172201148 1132148661 /nfs/dbraw/zinc/14/86/61/1132148661.db2.gz MOFLVYICLBOZCD-MRXNPFEDSA-N 1 0 299.439 3.810 20 10 CHCDRO CC(C)OCC[C@H](C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001172434387 1132208486 /nfs/dbraw/zinc/20/84/86/1132208486.db2.gz PCEZQWZGOSAVHA-INIZCTEOSA-N 1 0 290.451 3.580 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)cc1)[C@@H](C)CCOC(C)C ZINC001172455797 1132238271 /nfs/dbraw/zinc/23/82/71/1132238271.db2.gz XMADVYYXNKHMFO-INIZCTEOSA-N 1 0 292.467 3.778 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)CCOCC(C)C)cc1C ZINC001172463085 1132242900 /nfs/dbraw/zinc/24/29/00/1132242900.db2.gz JPGYETRHJYKNGO-HNNXBMFYSA-N 1 0 279.424 3.544 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)CCOCC(C)C)cc1C ZINC001172463086 1132242994 /nfs/dbraw/zinc/24/29/94/1132242994.db2.gz JPGYETRHJYKNGO-OAHLLOKOSA-N 1 0 279.424 3.544 20 10 CHCDRO CS[C@@H]1CC[N@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000840117663 1132247347 /nfs/dbraw/zinc/24/73/47/1132247347.db2.gz WCEMGJJYTRDPJN-CQSZACIVSA-N 1 0 279.449 3.761 20 10 CHCDRO Oc1cc2c(cc1C[N@@H+]1CC[C@H](F)C1)oc1ccccc12 ZINC000840103273 1132248177 /nfs/dbraw/zinc/24/81/77/1132248177.db2.gz AQGKLZRJBKSPMH-LBPRGKRZSA-N 1 0 285.318 3.835 20 10 CHCDRO CC(C)O[C@H]1C[C@@H]([NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)C1 ZINC000840764138 1132284528 /nfs/dbraw/zinc/28/45/28/1132284528.db2.gz NMIJCNAAHVGEJC-CIQGVGRVSA-N 1 0 293.382 3.625 20 10 CHCDRO C[C@@H](CCCc1cccnc1)[NH2+][C@H]1CCc2cccc(O)c21 ZINC000840771079 1132285514 /nfs/dbraw/zinc/28/55/14/1132285514.db2.gz AAKCBHWNTVXPJF-YOEHRIQHSA-N 1 0 296.414 3.776 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCC[C@@H]2C[C@@H]21)c1cc(Cl)ccc1O ZINC000840820048 1132291007 /nfs/dbraw/zinc/29/10/07/1132291007.db2.gz IYBBVCMIGKUHBJ-JYILRKAJSA-N 1 0 265.784 3.885 20 10 CHCDRO COCC[C@H](C)C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000840834925 1132291608 /nfs/dbraw/zinc/29/16/08/1132291608.db2.gz BXORWWTVASCCNA-UONOGXRCSA-N 1 0 287.403 3.869 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H]2CS[C@@H](C)C2)cc1 ZINC000840855584 1132294764 /nfs/dbraw/zinc/29/47/64/1132294764.db2.gz MQYSWOWUGPGSLQ-KCQAQPDRSA-N 1 0 278.465 3.687 20 10 CHCDRO Oc1ccc(C[NH2+]C2CCC3(CCCC3)CC2)cc1O ZINC001172723771 1132297627 /nfs/dbraw/zinc/29/76/27/1132297627.db2.gz GMJJEJPTWYETMD-UHFFFAOYSA-N 1 0 275.392 3.690 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H](C)C2(OC)CCC2)cc1 ZINC000840884074 1132302160 /nfs/dbraw/zinc/30/21/60/1132302160.db2.gz IRLMOUCZDIZXDN-HUUCEWRRSA-N 1 0 290.451 3.751 20 10 CHCDRO COC1([C@@H](C)[NH2+][C@@H](C)c2cc(Cl)cc(C)c2O)CCC1 ZINC000840883491 1132302789 /nfs/dbraw/zinc/30/27/89/1132302789.db2.gz DIZCIWZZYRJFPR-NWDGAFQWSA-N 1 0 297.826 3.962 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+]C1CCCC1 ZINC000840892439 1132304454 /nfs/dbraw/zinc/30/44/54/1132304454.db2.gz SFWGTHTZNNRBPQ-AWEZNQCLSA-N 1 0 260.425 3.524 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H](C)c1ccccn1 ZINC000840895352 1132306201 /nfs/dbraw/zinc/30/62/01/1132306201.db2.gz XFVGRPURPRTPSJ-JKSUJKDBSA-N 1 0 297.446 3.738 20 10 CHCDRO CCOC1(C)CC[NH+](Cc2c(O)cc(C)cc2Cl)CC1 ZINC000840948894 1132311633 /nfs/dbraw/zinc/31/16/33/1132311633.db2.gz ZDVBLJKUBWNBRQ-UHFFFAOYSA-N 1 0 297.826 3.745 20 10 CHCDRO CCc1nc(C)c(C[NH2+]Cc2c(O)cc(C)cc2Cl)o1 ZINC000840949902 1132311864 /nfs/dbraw/zinc/31/18/64/1132311864.db2.gz FKSRPLSNWDQCNW-UHFFFAOYSA-N 1 0 294.782 3.503 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC(F)(F)[C@@H](C)C2)c(Cl)c1 ZINC000840946858 1132312050 /nfs/dbraw/zinc/31/20/50/1132312050.db2.gz PPSDWZPNIHYAJV-JTQLQIEISA-N 1 0 289.753 3.831 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@H](C)CC(F)(F)F)cc1C ZINC000840963236 1132313897 /nfs/dbraw/zinc/31/38/97/1132313897.db2.gz JGLBRXRBFXPMHW-SECBINFHSA-N 1 0 275.314 3.687 20 10 CHCDRO Oc1ccc2ccccc2c1C[NH+]1CC(c2cccnc2)C1 ZINC001231590834 1132316877 /nfs/dbraw/zinc/31/68/77/1132316877.db2.gz NERYQOKRWMLAAR-UHFFFAOYSA-N 1 0 290.366 3.540 20 10 CHCDRO Oc1ccc2ccccc2c1C[NH+]1CC2(C1)CC(F)(F)C2 ZINC001231588320 1132318112 /nfs/dbraw/zinc/31/81/12/1132318112.db2.gz PHSCFXVKIUASJM-UHFFFAOYSA-N 1 0 289.325 3.777 20 10 CHCDRO Oc1ccc2ccccc2c1C[NH+]1CCC2(CCOC2)CC1 ZINC001231588462 1132318409 /nfs/dbraw/zinc/31/84/09/1132318409.db2.gz QSZHMOKQXQGKED-UHFFFAOYSA-N 1 0 297.398 3.548 20 10 CHCDRO Cc1ccc2c(c1)C[N@@H+](Cc1cccc(C)c1O)CC2 ZINC001231591194 1132319376 /nfs/dbraw/zinc/31/93/76/1132319376.db2.gz VNWUHCNFLFIWCL-UHFFFAOYSA-N 1 0 267.372 3.567 20 10 CHCDRO Cc1cc2c(cn1)C[N@H+](Cc1c(O)ccc3ccccc31)C2 ZINC001231590576 1132319693 /nfs/dbraw/zinc/31/96/93/1132319693.db2.gz ICBQKEYBHVPKKB-UHFFFAOYSA-N 1 0 290.366 3.765 20 10 CHCDRO COc1cccc([C@H]2CC[N@H+](Cc3cccc(C)c3O)C2)c1 ZINC001231594843 1132320682 /nfs/dbraw/zinc/32/06/82/1132320682.db2.gz PYSCDWSSRBRSDS-INIZCTEOSA-N 1 0 297.398 3.699 20 10 CHCDRO C[C@@H]1CC(C)(C)CC[C@H]1[NH2+]CCc1ccc(N)cc1 ZINC000841033861 1132321162 /nfs/dbraw/zinc/32/11/62/1132321162.db2.gz CKEZWLVZQALQFX-CZUORRHYSA-N 1 0 260.425 3.616 20 10 CHCDRO Cc1cccc2c1C[N@H+](Cc1cccc(C)c1O)C2 ZINC001231591289 1132321736 /nfs/dbraw/zinc/32/17/36/1132321736.db2.gz ZLHKJPYVRKUTDQ-UHFFFAOYSA-N 1 0 253.345 3.525 20 10 CHCDRO Nc1ccc(CC[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2)cc1 ZINC000841037073 1132322813 /nfs/dbraw/zinc/32/28/13/1132322813.db2.gz YDYFFKLMRDZJGL-UYAOXDASSA-N 1 0 294.442 3.812 20 10 CHCDRO C[C@]1(c2ccccc2)CC[C@@H]([NH2+]CCc2ccc(N)cc2)C1 ZINC000841039046 1132323174 /nfs/dbraw/zinc/32/31/74/1132323174.db2.gz YHPIEWTUILHLQN-UXHICEINSA-N 1 0 294.442 3.911 20 10 CHCDRO C[C@H](Cc1ccc(F)cc1Cl)[NH2+]Cc1ccccc1O ZINC001172860381 1132345975 /nfs/dbraw/zinc/34/59/75/1132345975.db2.gz CNGNBFHLXKQPBJ-LLVKDONJSA-N 1 0 293.769 3.906 20 10 CHCDRO CN(c1ccc(N)cc1)c1ccc(C2CC[NH+](C)CC2)cc1 ZINC001212691677 1132370204 /nfs/dbraw/zinc/37/02/04/1132370204.db2.gz YUNASRFFZOYYNZ-UHFFFAOYSA-N 1 0 295.430 3.846 20 10 CHCDRO Cc1cccc(C[N@@H+](C)Cc2c(C)cc(C)cc2O)c1 ZINC001231843320 1132375463 /nfs/dbraw/zinc/37/54/63/1132375463.db2.gz VTJRXRMNMVUALZ-UHFFFAOYSA-N 1 0 269.388 3.949 20 10 CHCDRO COc1cc(N(C)C)ccc1C[NH+]1[C@H](C)CCC[C@H]1C ZINC001231848674 1132378893 /nfs/dbraw/zinc/37/88/93/1132378893.db2.gz JTJIZPVBNISXPB-ZIAGYGMSSA-N 1 0 276.424 3.524 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CC[C@@H]3CCC[C@H]3C2)c(O)c1 ZINC001231844628 1132379872 /nfs/dbraw/zinc/37/98/72/1132379872.db2.gz OKYLYKCFJVBIDA-GJZGRUSLSA-N 1 0 259.393 3.631 20 10 CHCDRO 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C[N@H+](CCc1ccccn1)Cc1cccc(C(C)(C)C)c1O ZINC001143104704 1132502178 /nfs/dbraw/zinc/50/21/78/1132502178.db2.gz XVAUNFOQOIMEGD-UHFFFAOYSA-N 1 0 298.430 3.759 20 10 CHCDRO CC(C)(C)c1cccc(C[NH+]2CC(c3cccnc3)C2)c1O ZINC001143112336 1132504421 /nfs/dbraw/zinc/50/44/21/1132504421.db2.gz QVHHKKGLFWHGOZ-UHFFFAOYSA-N 1 0 296.414 3.684 20 10 CHCDRO COCC[N@H+](Cc1cccc(C(C)(C)C)c1O)C(C)C ZINC001143110831 1132504520 /nfs/dbraw/zinc/50/45/20/1132504520.db2.gz QMOLVGVVMLVPEB-UHFFFAOYSA-N 1 0 279.424 3.547 20 10 CHCDRO CCCC[N@H+](C)Cc1c([O-])cc(Br)cc1F ZINC001233027154 1132564383 /nfs/dbraw/zinc/56/43/83/1132564383.db2.gz LHPJFTLRNGHJSN-UHFFFAOYSA-N 1 0 290.176 3.526 20 10 CHCDRO CC[C@H](C)[N@H+](C)Cc1c([O-])cc(Br)cc1F ZINC001233027904 1132565200 /nfs/dbraw/zinc/56/52/00/1132565200.db2.gz GBWFQWWHSIJNPF-QMMMGPOBSA-N 1 0 290.176 3.524 20 10 CHCDRO CC(=O)[C@@H]1CCCC[N@@H+]1Cc1cc(C(C)(C)C)ccc1O ZINC001233286949 1132595153 /nfs/dbraw/zinc/59/51/53/1132595153.db2.gz PUVOHDMOUSXGNA-INIZCTEOSA-N 1 0 289.419 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PATSSNZYBBUZNU-UHFFFAOYSA-N 1 0 269.131 3.568 20 10 CHCDRO Cc1cc(C)c(CNc2ccc3c([nH+]2)CCC3)c(O)c1 ZINC001160810230 1132982739 /nfs/dbraw/zinc/98/27/39/1132982739.db2.gz NRQCDUPGSZVMMS-UHFFFAOYSA-N 1 0 268.360 3.505 20 10 CHCDRO Cc1cc(C)c(CNc2ccc(C)c(C)[nH+]2)c(O)c1 ZINC001160810049 1132983124 /nfs/dbraw/zinc/98/31/24/1132983124.db2.gz ICNZPILIDIYTOZ-UHFFFAOYSA-N 1 0 256.349 3.633 20 10 CHCDRO Cc1cc(C)c(O)c2c1CC(C)(C)[C@H]2Nc1cccc(N)[nH+]1 ZINC001163486951 1133153249 /nfs/dbraw/zinc/15/32/49/1133153249.db2.gz PAQUXJSRNLGWBO-KRWDZBQOSA-N 1 0 297.402 3.722 20 10 CHCDRO C[C@@H]1CCC[N@H+](Cc2c(O)cccc2Cl)[C@H]1C ZINC000252125972 1133185616 /nfs/dbraw/zinc/18/56/16/1133185616.db2.gz KBABVAXFGHJEAR-MNOVXSKESA-N 1 0 253.773 3.666 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCc2cccc(Cl)c2C1 ZINC001203558516 1133339839 /nfs/dbraw/zinc/33/98/39/1133339839.db2.gz LNBIPSWHVNODRY-UHFFFAOYSA-N 1 0 273.763 3.604 20 10 CHCDRO COc1cccc(C[N@H+](C)C(C)(C)Cc2ccccc2)c1O ZINC001203599215 1133343857 /nfs/dbraw/zinc/34/38/57/1133343857.db2.gz DDKFBZPKQSLUNB-UHFFFAOYSA-N 1 0 299.414 3.854 20 10 CHCDRO CN(Cc1cc(Cl)ccc1O)Cc1cccc(F)c1F ZINC001203664587 1133351668 /nfs/dbraw/zinc/35/16/68/1133351668.db2.gz LVUUSMBMEMHCJE-UHFFFAOYSA-N 1 0 297.732 3.956 20 10 CHCDRO COc1ccc(O)c(C[NH+]2CCC3(CC[C@H](F)C3)CC2)c1 ZINC001203680368 1133353049 /nfs/dbraw/zinc/35/30/49/1133353049.db2.gz RORRACYETAETGF-AWEZNQCLSA-N 1 0 293.382 3.505 20 10 CHCDRO Oc1ccc(C[N@H+](Cc2ccccc2)C2CCC2)cc1O ZINC001203881910 1133378223 /nfs/dbraw/zinc/37/82/23/1133378223.db2.gz XUSBKOYEIOESKJ-UHFFFAOYSA-N 1 0 283.371 3.653 20 10 CHCDRO C[N@H+](Cc1ccc(O)c(O)c1)Cc1cccc2ccccc21 ZINC001203879656 1133378561 /nfs/dbraw/zinc/37/85/61/1133378561.db2.gz WPTZKFSUIMQCPX-UHFFFAOYSA-N 1 0 293.366 3.883 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)CC/C=C/c2cccnc2)cc1 ZINC001203937090 1133385755 /nfs/dbraw/zinc/38/57/55/1133385755.db2.gz KDUCGUXZIYRVBC-QPJJXVBHSA-N 1 0 295.430 3.683 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1 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C[C@@H](c1ccccc1Cl)[N@H+](C)Cc1ccc(O)cc1O ZINC001204277369 1133426614 /nfs/dbraw/zinc/42/66/14/1133426614.db2.gz BPBINDOTWJJDRN-NSHDSACASA-N 1 0 291.778 3.944 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[N@@H+]1CCC2(CCC2)C1 ZINC001204321892 1133436234 /nfs/dbraw/zinc/43/62/34/1133436234.db2.gz LWNYWTMMAZQGOE-UHFFFAOYSA-N 1 0 270.420 3.663 20 10 CHCDRO F[C@@H]1CCCC[N@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001204325649 1133438259 /nfs/dbraw/zinc/43/82/59/1133438259.db2.gz SNQYLMPSBVFDJE-MRXNPFEDSA-N 1 0 276.399 3.611 20 10 CHCDRO COc1cc(C)c(C[NH+]2CCC(C(C)(C)C)CC2)c(O)c1 ZINC001205420857 1133575526 /nfs/dbraw/zinc/57/55/26/1133575526.db2.gz JEKGXSONDNONKE-UHFFFAOYSA-N 1 0 291.435 3.967 20 10 CHCDRO COc1ccc(C[NH2+]CC2CCC(C(C)C)CC2)c(O)c1 ZINC001205517208 1133584706 /nfs/dbraw/zinc/58/47/06/1133584706.db2.gz JQFCUGLNKKIRCG-UHFFFAOYSA-N 1 0 291.435 3.953 20 10 CHCDRO CCC(C)(C)[N@H+](C)C/C=C/c1ccc(N(C)C)cc1 ZINC001205634760 1133596981 /nfs/dbraw/zinc/59/69/81/1133596981.db2.gz ZELJLZSVWUCFMZ-CMDGGOBGSA-N 1 0 260.425 3.886 20 10 CHCDRO CCC[C@@H](C[N@H+](C)Cc1ccc(N2CCCC2)cc1)OC ZINC001205708959 1133605237 /nfs/dbraw/zinc/60/52/37/1133605237.db2.gz MSSOHEULJSKWGF-SFHVURJKSA-N 1 0 290.451 3.534 20 10 CHCDRO CCCC[C@@H](C)[N@H+](C)Cc1cc(C)cc(OC)c1O ZINC001206122810 1133660612 /nfs/dbraw/zinc/66/06/12/1133660612.db2.gz VWAGRDOAEUREOP-CYBMUJFWSA-N 1 0 265.397 3.720 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CC[C@H](C3CCC3)C2)cc1Cl ZINC001206284813 1133683170 /nfs/dbraw/zinc/68/31/70/1133683170.db2.gz DCLGWSZVJYXJJS-ZDUSSCGKSA-N 1 0 279.811 3.976 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+][C@@H]1CCCC12CCC2 ZINC001206516713 1133712948 /nfs/dbraw/zinc/71/29/48/1133712948.db2.gz CBELFWCLVSBLOS-CQSZACIVSA-N 1 0 265.784 3.858 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]Cc1cccc2cnccc21 ZINC001206517510 1133713009 /nfs/dbraw/zinc/71/30/09/1133713009.db2.gz VEIMXVFZBXNAMP-UHFFFAOYSA-N 1 0 298.773 3.884 20 10 CHCDRO Cc1ccc2c(c1)C[N@H+](Cc1ccc(N(C)C)cc1C)CC2 ZINC001206584087 1133721755 /nfs/dbraw/zinc/72/17/55/1133721755.db2.gz DPLNAOKGIIJSRZ-UHFFFAOYSA-N 1 0 294.442 3.928 20 10 CHCDRO C[N@H+](CCCc1ccccc1F)Cc1ccccc1O ZINC001207495061 1133809362 /nfs/dbraw/zinc/80/93/62/1133809362.db2.gz RBIHHWAYGOBXQP-UHFFFAOYSA-N 1 0 273.351 3.596 20 10 CHCDRO C[C@@H](C[N@H+](C)Cc1ccc(N(C)C)cc1)c1ccccc1 ZINC001207912327 1133861358 /nfs/dbraw/zinc/86/13/58/1133861358.db2.gz QTTPTJONLGZUNT-INIZCTEOSA-N 1 0 282.431 3.988 20 10 CHCDRO Oc1cc2c(cc1O)C[N@H+](CCCC1CCCC1)CCC2 ZINC001208093838 1133877292 /nfs/dbraw/zinc/87/72/92/1133877292.db2.gz DBIKQTKURNALFC-UHFFFAOYSA-N 1 0 289.419 3.816 20 10 CHCDRO CCN(C)c1ccc(Nc2ccc3c(c2)OCCN3)cc1 ZINC001209792107 1134065046 /nfs/dbraw/zinc/06/50/46/1134065046.db2.gz KTDQJIGBRXWAGZ-UHFFFAOYSA-N 1 0 283.375 3.691 20 10 CHCDRO CC[C@H](C[NH2+]Cc1cc(C)ccc1O)CC(F)(F)F ZINC000402598923 1134663251 /nfs/dbraw/zinc/66/32/51/1134663251.db2.gz MZDQNSHQASLHIZ-NSHDSACASA-N 1 0 275.314 3.769 20 10 CHCDRO CC[C@H]1C[N@H+](Cc2c(O)ccc3ccccc32)[C@H](C)CO1 ZINC000403825817 1134876813 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C[C@@H]1[NH2+]C[C@H]1Oc1ccc(NN=C2C=CC(=O)C=C2)cc1 ZINC001218391995 1135098152 /nfs/dbraw/zinc/09/81/52/1135098152.db2.gz NUGPGVLCFVCOCG-MEDUHNTESA-N 1 0 283.331 3.547 20 10 CHCDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]CCOc1ccccc1 ZINC000314533571 1135146218 /nfs/dbraw/zinc/14/62/18/1135146218.db2.gz ALLOOTFUTQZWGS-GOEBONIOSA-N 1 0 297.398 3.918 20 10 CHCDRO Cc1noc(C)c1[C@@H](C)[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000316720409 1135169444 /nfs/dbraw/zinc/16/94/44/1135169444.db2.gz TXHPRQDBPSUDHL-GFCCVEGCSA-N 1 0 299.418 3.525 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)c2cc(C)ccc2O)cc1 ZINC000035628579 260030841 /nfs/dbraw/zinc/03/08/41/260030841.db2.gz IXOLZAGXUUFKRO-CYBMUJFWSA-N 1 0 271.360 3.560 20 10 CHCDRO CCCC[NH2+][C@H](CC)c1cc(Br)ccc1O ZINC000019907045 170919178 /nfs/dbraw/zinc/91/91/78/170919178.db2.gz FGVUWZURKDFRCI-GFCCVEGCSA-N 1 0 286.213 3.996 20 10 CHCDRO CCN(CC)CC[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000019919346 170927684 /nfs/dbraw/zinc/92/76/84/170927684.db2.gz ZYRQKMKGLNSUSU-CQSZACIVSA-N 1 0 286.419 3.538 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1)c1ccccc1O ZINC000020095485 170994400 /nfs/dbraw/zinc/99/44/00/170994400.db2.gz JREMCYIQAYFKEH-NWDGAFQWSA-N 1 0 259.324 3.943 20 10 CHCDRO C[C@H]([NH2+]CCc1c[nH]c2ccccc12)c1ccccc1O ZINC000020122491 171002574 /nfs/dbraw/zinc/00/25/74/171002574.db2.gz XRWTUFMFCDAJNB-ZDUSSCGKSA-N 1 0 280.371 3.767 20 10 CHCDRO C[C@H](C[NH2+][C@@H](C)c1ccccc1O)c1ccccc1 ZINC000020137102 171024753 /nfs/dbraw/zinc/02/47/53/171024753.db2.gz NHTSKVCAGUVVSE-KGLIPLIRSA-N 1 0 255.361 3.847 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cccs1 ZINC000020146051 171031728 /nfs/dbraw/zinc/03/17/28/171031728.db2.gz WOKDIDPIOMPFDO-GFCCVEGCSA-N 1 0 260.406 3.665 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(F)c(F)c1 ZINC000020146094 171031876 /nfs/dbraw/zinc/03/18/76/171031876.db2.gz DOHUBUUOGCSIPL-LBPRGKRZSA-N 1 0 290.357 3.882 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2cccnc2)c1 ZINC000035628822 172307792 /nfs/dbraw/zinc/30/77/92/172307792.db2.gz ZJIXYQGASNQNNS-OLZOCXBDSA-N 1 0 256.349 3.507 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H](C)CCc2ccccc2)c1 ZINC000071406565 176155655 /nfs/dbraw/zinc/15/56/55/176155655.db2.gz IDJGJWNXQHDAQC-OAHLLOKOSA-N 1 0 269.388 3.812 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2cccc(Cl)c2)c1 ZINC000071409250 176156739 /nfs/dbraw/zinc/15/67/39/176156739.db2.gz XNVXHIICIKCKBU-UHFFFAOYSA-N 1 0 261.752 3.644 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)Cc1c(C)noc1C)c1ccccc1O ZINC000155925449 261110066 /nfs/dbraw/zinc/11/00/66/261110066.db2.gz JXTCIJJXXFZRPV-BZNIZROVSA-N 1 0 288.391 3.669 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CCOC2(CCCC2)C1)c1ccccc1O ZINC000156766287 261131817 /nfs/dbraw/zinc/13/18/17/261131817.db2.gz JAEXAPGNQBSFGC-GDBMZVCRSA-N 1 0 289.419 3.925 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc(F)cc(OC)c1)c1ccccc1O ZINC000157008794 261137159 /nfs/dbraw/zinc/13/71/59/261137159.db2.gz AARBDKWHNSSHAO-MRXNPFEDSA-N 1 0 289.350 3.781 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1cccnc1)c1ccc(N(C)C)cc1 ZINC000158521589 261166619 /nfs/dbraw/zinc/16/66/19/261166619.db2.gz MDNDANHTOKLQGS-KBXCAEBGSA-N 1 0 283.419 3.950 20 10 CHCDRO COc1cc(Cl)ccc1C[NH2+][C@@H](C)c1ccccc1O ZINC000183503922 261978051 /nfs/dbraw/zinc/97/80/51/261978051.db2.gz GTBKUWPPYBMOAP-NSHDSACASA-N 1 0 291.778 3.905 20 10 CHCDRO C[C@H]([NH2+]CCc1ccccn1)c1cc2c(cc1O)CCCC2 ZINC000184839317 262030927 /nfs/dbraw/zinc/03/09/27/262030927.db2.gz VOPWPJWZRSXUTA-AWEZNQCLSA-N 1 0 296.414 3.559 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(F)c(C)c2)c1 ZINC000184911679 262033174 /nfs/dbraw/zinc/03/31/74/262033174.db2.gz NPYZZOFHEJRTPK-ZDUSSCGKSA-N 1 0 273.351 3.999 20 10 CHCDRO CC[C@@H](C)[C@@H](O)C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000185438906 262054643 /nfs/dbraw/zinc/05/46/43/262054643.db2.gz DDRSNLBTGONYTA-IGCXYCKISA-N 1 0 287.403 3.603 20 10 CHCDRO Cc1noc(C)c1[C@@H](C)C[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000186157532 262082482 /nfs/dbraw/zinc/08/24/82/262082482.db2.gz DDOIQOYHEZYWBM-RYUDHWBXSA-N 1 0 288.391 3.760 20 10 CHCDRO Cc1noc(C)c1[C@H](C)C[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000186157498 262082917 /nfs/dbraw/zinc/08/29/17/262082917.db2.gz DDOIQOYHEZYWBM-NEPJUHHUSA-N 1 0 288.391 3.760 20 10 CHCDRO Cc1noc(C)c1[C@@H](C)C[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000186158321 262082987 /nfs/dbraw/zinc/08/29/87/262082987.db2.gz NCQCGRSHQSQXOV-UWVGGRQHSA-N 1 0 292.354 3.590 20 10 CHCDRO Cc1cnc([C@H](C)C[NH2+][C@H](C)c2cc(C)ccc2O)s1 ZINC000186766156 262108867 /nfs/dbraw/zinc/10/88/67/262108867.db2.gz ZYIXKVVLSNVZNA-DGCLKSJQSA-N 1 0 290.432 3.920 20 10 CHCDRO CCc1cnc(C[NH2+][C@@H](C)c2cc(C)ccc2O)s1 ZINC000185584158 262305581 /nfs/dbraw/zinc/30/55/81/262305581.db2.gz GUSNJNFJWSFNHA-NSHDSACASA-N 1 0 276.405 3.570 20 10 CHCDRO C[C@H]([NH2+]CCCCCCO)c1ccc2ccccc2c1O ZINC000186231322 262312137 /nfs/dbraw/zinc/31/21/37/262312137.db2.gz SCVUYGCUTLIWEY-AWEZNQCLSA-N 1 0 287.403 3.749 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@H]1CCc3c1cccc3F)CC2 ZINC000297946385 263212737 /nfs/dbraw/zinc/21/27/37/263212737.db2.gz YJACGXTVUACNFI-HOTGVXAUSA-N 1 0 283.346 3.796 20 10 CHCDRO Cc1ccc2c(c1)[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1O)CO2 ZINC000373266538 267658236 /nfs/dbraw/zinc/65/82/36/267658236.db2.gz NENCDEBYYPDPKP-NHYWBVRUSA-N 1 0 287.334 3.624 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](C)c2cccnc2)cc1 ZINC000158493707 327629814 /nfs/dbraw/zinc/62/98/14/327629814.db2.gz QQMHXKKNJFJJEG-CABCVRRESA-N 1 0 283.419 3.950 20 10 CHCDRO COC[C@H]([NH2+][C@@H](C)c1cc(C)ccc1O)c1ccc(C)o1 ZINC000185630217 327841635 /nfs/dbraw/zinc/84/16/35/327841635.db2.gz XAZXRGUITUJXOT-ZFWWWQNUSA-N 1 0 289.375 3.640 20 10 CHCDRO C[C@H]([NH2+]C1(c2ccccc2)CC1)c1ccccc1O ZINC000272845334 328200964 /nfs/dbraw/zinc/20/09/64/328200964.db2.gz KHQDCRBGDORHFL-ZDUSSCGKSA-N 1 0 253.345 3.732 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@H](C)c2ccc(C)cc2)c1 ZINC000037770901 326861033 /nfs/dbraw/zinc/86/10/33/326861033.db2.gz SYQDBPUIPAIHRR-CYBMUJFWSA-N 1 0 271.360 3.560 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H](c2ccccn2)C2CCC2)c1 ZINC000527771338 330282002 /nfs/dbraw/zinc/28/20/02/330282002.db2.gz HUOLUVZNBBOQNW-GOSISDBHSA-N 1 0 282.387 3.727 20 10 CHCDRO COc1ccc(C(C)(C)[NH2+]Cc2ccccc2O)cc1F ZINC000527780774 330283069 /nfs/dbraw/zinc/28/30/69/330283069.db2.gz JENSRUIEAXGDLB-UHFFFAOYSA-N 1 0 289.350 3.565 20 10 CHCDRO CC[C@@H](c1ccc(C)cc1O)[NH+]1CCC(CCOC)CC1 ZINC000527937296 330293663 /nfs/dbraw/zinc/29/36/63/330293663.db2.gz SDILSGYPSOVFIZ-KRWDZBQOSA-N 1 0 291.435 3.900 20 10 CHCDRO C[C@H]([NH2+]CC1CC=CC1)c1cc(Br)ccc1O ZINC000527946661 330294274 /nfs/dbraw/zinc/29/42/74/330294274.db2.gz IFHQXUOPSZWHNP-JTQLQIEISA-N 1 0 296.208 3.772 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2cccnc2C)c(O)c1C ZINC000527986740 330298737 /nfs/dbraw/zinc/29/87/37/330298737.db2.gz LXAONIPGQLXIKQ-AWEZNQCLSA-N 1 0 270.376 3.563 20 10 CHCDRO CCC[C@@](C)(O)C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000230661820 333320044 /nfs/dbraw/zinc/32/00/44/333320044.db2.gz ZGBPQDYBECLOPU-FZKQIMNGSA-N 1 0 287.403 3.747 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCSC1)c1ccc2ccccc2c1O ZINC000230667640 333320380 /nfs/dbraw/zinc/32/03/80/333320380.db2.gz CRXMAJSUWQSBDJ-DGCLKSJQSA-N 1 0 273.401 3.702 20 10 CHCDRO CC(C)C[C@H](CO)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000040773765 519362948 /nfs/dbraw/zinc/36/29/48/519362948.db2.gz XCUWEMABAVJCCA-UKRRQHHQSA-N 1 0 287.403 3.603 20 10 CHCDRO CCOCc1ccccc1C[NH2+][C@@H](C)c1ccccc1O ZINC000037762242 520214226 /nfs/dbraw/zinc/21/42/26/520214226.db2.gz JYRPRXBMCYTLET-AWEZNQCLSA-N 1 0 285.387 3.780 20 10 CHCDRO CCOc1cccc(C[N@H+](C)[C@@H](C)c2ccco2)c1O ZINC000131075128 521334656 /nfs/dbraw/zinc/33/46/56/521334656.db2.gz IHBODAFKZSEZOV-LBPRGKRZSA-N 1 0 275.348 3.577 20 10 CHCDRO CCc1nc(C)c(C[NH2+][C@H](C)c2cc(Cl)ccc2O)o1 ZINC000291910813 522208487 /nfs/dbraw/zinc/20/84/87/522208487.db2.gz MUFVZHAWZXWDGA-SECBINFHSA-N 1 0 294.782 3.755 20 10 CHCDRO CC[C@H]([NH2+]CCCOC(C)C)c1ccc(C)cc1O ZINC000280030639 522585192 /nfs/dbraw/zinc/58/51/92/522585192.db2.gz ICZRRSIJHIDDCB-HNNXBMFYSA-N 1 0 265.397 3.556 20 10 CHCDRO CC[C@H]([NH2+]CC[C@H]1CCO[C@H](C)C1)c1ccccc1O ZINC000274776071 522599208 /nfs/dbraw/zinc/59/92/08/522599208.db2.gz OAEUXLLVLWDWOB-YCPHGPKFSA-N 1 0 277.408 3.638 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccncc1C)c1ccc(C)cc1O ZINC000280016672 522602485 /nfs/dbraw/zinc/60/24/85/522602485.db2.gz HCAYVSZMZNIPBO-KRWDZBQOSA-N 1 0 284.403 3.687 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCSC1)c1ccc(N(C)C)cc1 ZINC000280200912 522622466 /nfs/dbraw/zinc/62/24/66/522622466.db2.gz VNPGSGFTZGQUDC-BBRMVZONSA-N 1 0 278.465 3.546 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](CO)c1ccccc1)c1ccc(C)cc1O ZINC000280105858 522626454 /nfs/dbraw/zinc/62/64/54/522626454.db2.gz NIWWFYHUXOKBOL-AEFFLSMTSA-N 1 0 299.414 3.517 20 10 CHCDRO CC[C@@H](c1ccncc1)[N@H+](C)Cc1cc(C)ccc1O ZINC000290557635 523122188 /nfs/dbraw/zinc/12/21/88/523122188.db2.gz SECUUHOCXZHXDJ-INIZCTEOSA-N 1 0 270.376 3.679 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)c2ccc(C)o2)cc1C ZINC000035052690 524074205 /nfs/dbraw/zinc/07/42/05/524074205.db2.gz WROIFMJYSSHVKE-ZDUSSCGKSA-N 1 0 259.349 3.756 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H](C)c2cc(F)ccc2O)c1 ZINC000094617667 524155580 /nfs/dbraw/zinc/15/55/80/524155580.db2.gz GSNCQJDQDNJLDY-NWDGAFQWSA-N 1 0 289.350 3.952 20 10 CHCDRO C[C@H](CCO)CC[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000297411095 524200315 /nfs/dbraw/zinc/20/03/15/524200315.db2.gz UAZAZFQHMHOCTK-KBPBESRZSA-N 1 0 287.403 3.605 20 10 CHCDRO COc1ccc(N2CCC([NH2+][C@H](C)CC(C)C)CC2)cc1 ZINC000157394940 524403294 /nfs/dbraw/zinc/40/32/94/524403294.db2.gz AHDNKGJCCGOROJ-OAHLLOKOSA-N 1 0 290.451 3.688 20 10 CHCDRO Cc1cccc(C[NH2+][C@H](C)c2ccc(F)cc2F)c1O ZINC000158087610 524438941 /nfs/dbraw/zinc/43/89/41/524438941.db2.gz GQYPMHHYDBVSOR-LLVKDONJSA-N 1 0 277.314 3.830 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)c2ccc(C)cc2O)s1 ZINC000050225189 524590482 /nfs/dbraw/zinc/59/04/82/524590482.db2.gz TUUJLSTVVJSOQX-LBPRGKRZSA-N 1 0 261.390 3.921 20 10 CHCDRO C[C@@H](Cc1ccsc1)[NH2+]Cc1cc(Cl)ccc1O ZINC000049154913 524940174 /nfs/dbraw/zinc/94/01/74/524940174.db2.gz VBYXZGGIELBVNE-JTQLQIEISA-N 1 0 281.808 3.828 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC[C@H]2c2ccncc2)cc1C ZINC000289868709 525316451 /nfs/dbraw/zinc/31/64/51/525316451.db2.gz RBWUMLQNNICMLV-KRWDZBQOSA-N 1 0 282.387 3.741 20 10 CHCDRO COc1ccc([C@H](C)[NH2+][C@H](C)c2cc(F)ccc2O)cc1 ZINC000094618476 525334185 /nfs/dbraw/zinc/33/41/85/525334185.db2.gz ZGOJSUWESJRWPD-NWDGAFQWSA-N 1 0 289.350 3.952 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)[C@@H](O)c1ccccc1)c1ccc(N(C)C)cc1 ZINC000290197950 525524656 /nfs/dbraw/zinc/52/46/56/525524656.db2.gz GKXJMBPFWYRXPI-YZVOILCLSA-N 1 0 298.430 3.525 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(Cl)cn1 ZINC000274964456 525525201 /nfs/dbraw/zinc/52/52/01/525525201.db2.gz XCOFRMIROYRSPF-GFCCVEGCSA-N 1 0 289.810 3.652 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCOC(C)(C)C1)c1cc(Cl)ccc1O ZINC000120214313 525684030 /nfs/dbraw/zinc/68/40/30/525684030.db2.gz HOGYPBKJNSSVOD-PWSUYJOCSA-N 1 0 283.799 3.654 20 10 CHCDRO C[C@@H]([NH2+][C@H]1C[C@H](c2ccccc2)C1)c1ccccc1O ZINC000280699186 525695971 /nfs/dbraw/zinc/69/59/71/525695971.db2.gz CCRZKXUMJNLOMT-FVQBIDKESA-N 1 0 267.372 3.989 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC2CC(F)(F)C2)c(O)c1C ZINC000293380660 525916527 /nfs/dbraw/zinc/91/65/27/525916527.db2.gz IHZBNTBPCVDQJH-NSHDSACASA-N 1 0 269.335 3.705 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCOC3(CCC3)C2)c(O)c1C ZINC000273530915 525945226 /nfs/dbraw/zinc/94/52/26/525945226.db2.gz WHTCGCOJVGYZHA-GJZGRUSLSA-N 1 0 289.419 3.761 20 10 CHCDRO COc1cccc(C[NH2+]C2CC(C)(c3ccccc3)C2)c1O ZINC000264933503 526011094 /nfs/dbraw/zinc/01/10/94/526011094.db2.gz BVPZKNXHEPBSME-UHFFFAOYSA-N 1 0 297.398 3.611 20 10 CHCDRO Oc1ccccc1C[NH2+][C@H]1CCCc2sccc21 ZINC000061331041 526374190 /nfs/dbraw/zinc/37/41/90/526374190.db2.gz SQOMMJLJGYFHAD-ZDUSSCGKSA-N 1 0 259.374 3.621 20 10 CHCDRO CN(C)c1ccc(C[NH2+]CCc2ccc(Cl)cc2)cc1 ZINC000013721323 567942081 /nfs/dbraw/zinc/94/20/81/567942081.db2.gz WEPFNGMPUTXITN-UHFFFAOYSA-N 1 0 288.822 3.738 20 10 CHCDRO CC(C)=CCC[NH2+]Cc1c(O)cccc1Br ZINC000706883324 1121443833 /nfs/dbraw/zinc/44/38/33/1121443833.db2.gz MIXRDCNRLCKGSP-UHFFFAOYSA-N 1 0 284.197 3.601 20 10 CHCDRO CCSCCC[NH2+][C@@H](CC)c1ccccc1O ZINC000271683166 1122171883 /nfs/dbraw/zinc/17/18/83/1122171883.db2.gz IVMKRIULWDVSQI-ZDUSSCGKSA-N 1 0 253.411 3.576 20 10 CHCDRO COc1cc(C[NH2+]CCCSC)c(O)c(C(C)(C)C)c1 ZINC000850143088 1123244345 /nfs/dbraw/zinc/24/43/45/1123244345.db2.gz CBDJNSPUCDXLIL-UHFFFAOYSA-N 1 0 297.464 3.541 20 10 CHCDRO CSCC1(CC[NH2+]Cc2cc(C)c(C)cc2O)CC1 ZINC000850355455 1123255409 /nfs/dbraw/zinc/25/54/09/1123255409.db2.gz FHSMTVMZXCGMFU-UHFFFAOYSA-N 1 0 279.449 3.632 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H](C)CCc2ccsc2)c1 ZINC000862475911 1123812328 /nfs/dbraw/zinc/81/23/28/1123812328.db2.gz BKTDQIJNLDJFDX-ZDUSSCGKSA-N 1 0 275.417 3.873 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CS[C@H](C)C1)c1cccc(Cl)c1[O-] ZINC000840860982 1123861254 /nfs/dbraw/zinc/86/12/54/1123861254.db2.gz YKMOSTLBSYJRFO-NRUUGDAUSA-N 1 0 285.840 3.980 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)CCSC)c1ccc(C)cc1O ZINC000794803728 1123953254 /nfs/dbraw/zinc/95/32/54/1123953254.db2.gz SOMGHMNDNNJYJS-OCCSQVGLSA-N 1 0 267.438 3.883 20 10 CHCDRO CSc1ccc(C[NH2+][C@H](C)c2ccccc2O)o1 ZINC000883224334 1125380072 /nfs/dbraw/zinc/38/00/72/1125380072.db2.gz JWVMTQKCQQKRMK-SNVBAGLBSA-N 1 0 263.362 3.558 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccns1)c1cc(Cl)ccc1O ZINC000883247160 1125384211 /nfs/dbraw/zinc/38/42/11/1125384211.db2.gz BBWILZXOTIWHOX-ZDUSSCGKSA-N 1 0 296.823 3.786 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CC3CCC2CC3)cc1Cl ZINC001231870567 1132384716 /nfs/dbraw/zinc/38/47/16/1132384716.db2.gz JSABPTGNIJTRPW-UHFFFAOYSA-N 1 0 265.784 3.728 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCC(F)(F)C1)c1ccc(Cl)cc1O ZINC000841749899 1132389129 /nfs/dbraw/zinc/38/91/29/1132389129.db2.gz JMPCZQXMDCFORQ-WCBMZHEXSA-N 1 0 275.726 3.884 20 10 CHCDRO CO[C@@H](C[NH2+][C@@H](C)c1c(C)cc(C)cc1O)CC(C)C ZINC000841754712 1132391973 /nfs/dbraw/zinc/39/19/73/1132391973.db2.gz BOOQFFJAYGIPSL-LSDHHAIUSA-N 1 0 279.424 3.721 20 10 CHCDRO CCSC[C@H](C)[NH2+]Cc1cc2ccccc2cc1O ZINC001173293988 1132442490 /nfs/dbraw/zinc/44/24/90/1132442490.db2.gz BJYMIFYPBCKPGR-LBPRGKRZSA-N 1 0 275.417 3.777 20 10 CHCDRO COc1ccc(O)c(C[NH+]2CCC3(CCCC3)CC2)c1 ZINC000133991235 1125516508 /nfs/dbraw/zinc/51/65/08/1125516508.db2.gz JKERTPVPJPZBQU-UHFFFAOYSA-N 1 0 275.392 3.557 20 10 CHCDRO Oc1ccccc1C[NH2+]C[C@@H]1CCCc2ccccc21 ZINC000134226035 1125544498 /nfs/dbraw/zinc/54/44/98/1125544498.db2.gz JZYNXWFITCLBAP-HNNXBMFYSA-N 1 0 267.372 3.602 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CC[C@H]([C@@H]2CCCO2)C1 ZINC000884482666 1125567889 /nfs/dbraw/zinc/56/78/89/1125567889.db2.gz GEDKAKKDTFRYBR-KXBFYZLASA-N 1 0 297.398 3.546 20 10 CHCDRO CCO[C@@H]1C[C@H]([NH2+]Cc2ccccc2O)C12CCCCC2 ZINC000135805478 1125600830 /nfs/dbraw/zinc/60/08/30/1125600830.db2.gz MJSANSGXYCEOTD-DLBZAZTESA-N 1 0 289.419 3.610 20 10 CHCDRO CC[NH+](CC)CCC[C@H](C)[NH2+][C@@H](C)c1c([O-])cccc1F ZINC000886487852 1125680372 /nfs/dbraw/zinc/68/03/72/1125680372.db2.gz XYAMTAJNJMWBLW-KBPBESRZSA-N 1 0 296.430 3.692 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H]2CC[C@H](C)[C@@H](C)C2)c1O ZINC000221375037 1125729538 /nfs/dbraw/zinc/72/95/38/1125729538.db2.gz UOPDHVSXPPRQFG-KCQAQPDRSA-N 1 0 277.408 3.705 20 10 CHCDRO COc1ccc(C[N@H+](C)Cc2cc3c(cc2O)CCC3)cc1 ZINC000192460265 1125769103 /nfs/dbraw/zinc/76/91/03/1125769103.db2.gz RQBQTPOHWXVARA-UHFFFAOYSA-N 1 0 297.398 3.522 20 10 CHCDRO COc1cccc(C[N@H+](C)[C@@H](C)c2ccc(F)cc2)c1O ZINC000122184041 1125785058 /nfs/dbraw/zinc/78/50/58/1125785058.db2.gz ZDGUROOHROZSKM-LBPRGKRZSA-N 1 0 289.350 3.733 20 10 CHCDRO Cc1cc(C)c(O)c(C[NH+]2CCC3(CCC3)CC2)c1 ZINC000795714311 1129440002 /nfs/dbraw/zinc/44/00/02/1129440002.db2.gz PVMWLXXOVPBFEX-UHFFFAOYSA-N 1 0 259.393 3.775 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC000800276621 1129862422 /nfs/dbraw/zinc/86/24/22/1129862422.db2.gz MVUVOEHWIVVRNA-JTQLQIEISA-N 1 0 289.753 3.961 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](CC)C[C@@H](C)CC)c1 ZINC000769537633 1129916529 /nfs/dbraw/zinc/91/65/29/1129916529.db2.gz NGGNLQCJSBGSQP-ZDUSSCGKSA-N 1 0 265.397 3.659 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)Cc2cccc(F)c2)cc1 ZINC000302746175 1126740823 /nfs/dbraw/zinc/74/08/23/1126740823.db2.gz ZRGFRAZQKJBXFL-UHFFFAOYSA-N 1 0 272.367 3.524 20 10 CHCDRO COc1ccc(F)cc1[C@@H](C)[NH2+]Cc1cccc(C)c1O ZINC000158107370 1126746771 /nfs/dbraw/zinc/74/67/71/1126746771.db2.gz ZZSSFHHEILGMMJ-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO COc1cc(C)ccc1C[NH2+]Cc1c(O)cccc1Cl ZINC000151033633 1126749744 /nfs/dbraw/zinc/74/97/44/1126749744.db2.gz DOSFRWHORIIOQB-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO C[C@H]([NH2+]C1CCOCC1)c1ccc(N2CCCCC2)cc1 ZINC000178270396 1126810626 /nfs/dbraw/zinc/81/06/26/1126810626.db2.gz NPLFPQVYSYTKFP-HNNXBMFYSA-N 1 0 288.435 3.507 20 10 CHCDRO CC[C@@](C)([NH2+]Cc1cc(F)ccc1O)c1nc(C)cs1 ZINC000180753451 1126847903 /nfs/dbraw/zinc/84/79/03/1126847903.db2.gz OZRLURSJEFRPEE-OAHLLOKOSA-N 1 0 294.395 3.711 20 10 CHCDRO COc1ccc(O)c(C[NH2+]C2(c3ccccc3)CCC2)c1 ZINC000181327310 1126854479 /nfs/dbraw/zinc/85/44/79/1126854479.db2.gz VFNFNEOYEMIEDF-UHFFFAOYSA-N 1 0 283.371 3.570 20 10 CHCDRO CCCCC[N@H+](CCCOC)Cc1cc(F)ccc1O ZINC000780792102 1130693219 /nfs/dbraw/zinc/69/32/19/1130693219.db2.gz FXKZTUWMKAFXHL-UHFFFAOYSA-N 1 0 283.387 3.560 20 10 CHCDRO C[C@@H]([NH2+]CCCNc1ccccc1)c1ccccc1O ZINC000183520151 1126887342 /nfs/dbraw/zinc/88/73/42/1126887342.db2.gz NLXKPPNGZDWPOD-CQSZACIVSA-N 1 0 270.376 3.545 20 10 CHCDRO C[C@@H](C[NH2+][C@@H](C)c1ccccc1O)Oc1ccccc1F ZINC000183534699 1126888990 /nfs/dbraw/zinc/88/89/90/1126888990.db2.gz XOEPOMDZRLNLRS-STQMWFEESA-N 1 0 289.350 3.649 20 10 CHCDRO C[C@@H]([NH2+]C1(c2ccccc2F)CC1)c1ccccc1O ZINC000183660986 1126889699 /nfs/dbraw/zinc/88/96/99/1126889699.db2.gz CMAPTBVBYUDBKH-GFCCVEGCSA-N 1 0 271.335 3.871 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCC[C@@H]1CCO)c1ccc2ccccc2c1O ZINC000187975012 1126917751 /nfs/dbraw/zinc/91/77/51/1126917751.db2.gz QPRHFEQVTDMZFN-JCKWVBRZSA-N 1 0 299.414 3.747 20 10 CHCDRO CSCc1cccc(C[NH2+]Cc2cc(F)ccc2O)c1 ZINC000188974677 1126926905 /nfs/dbraw/zinc/92/69/05/1126926905.db2.gz ADEPSBRRPSNVFE-UHFFFAOYSA-N 1 0 291.391 3.684 20 10 CHCDRO CCCC[C@@H](C)[N@H+](C)Cc1ccc(N2CCOCC2)cc1 ZINC000777466675 1126944416 /nfs/dbraw/zinc/94/44/16/1126944416.db2.gz DTKPVHMDMRTOGD-MRXNPFEDSA-N 1 0 290.451 3.534 20 10 CHCDRO CSC[C@@H]1CCC[N@H+](Cc2c(O)cccc2Cl)C1 ZINC000814178878 1130834456 /nfs/dbraw/zinc/83/44/56/1130834456.db2.gz HAOUNACJIWYFHY-LLVKDONJSA-N 1 0 285.840 3.621 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H]2CCO[C@@H](C(C)(C)C)C2)cc1C ZINC000270602174 1127059073 /nfs/dbraw/zinc/05/90/73/1127059073.db2.gz AUPSMNQUICPJDV-DOTOQJQBSA-N 1 0 291.435 3.692 20 10 CHCDRO C[C@@H]1C[C@@H]([NH2+]Cc2cc(-c3ccccc3)ccc2O)CCO1 ZINC000271198800 1127072553 /nfs/dbraw/zinc/07/25/53/1127072553.db2.gz AZLQSNPHHLLBCD-KDOFPFPSSA-N 1 0 297.398 3.716 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCSC1)c1ccc(N2CCCCC2)cc1 ZINC000271422923 1127079402 /nfs/dbraw/zinc/07/94/02/1127079402.db2.gz ASNQFTSPWVRJPX-ZBFHGGJFSA-N 1 0 290.476 3.833 20 10 CHCDRO CC1(C)CCC[N@@H+]1Cc1c(O)cccc1OC(F)(F)F ZINC001237119563 1131053745 /nfs/dbraw/zinc/05/37/45/1131053745.db2.gz IWDAELKOHIMWNG-UHFFFAOYSA-N 1 0 289.297 3.665 20 10 CHCDRO CCCC[N@H+](C)Cc1cc(C(C)(C)C)cc(O)c1O ZINC000913064167 1127120871 /nfs/dbraw/zinc/12/08/71/1127120871.db2.gz FHUFLWAPKZOICA-UHFFFAOYSA-N 1 0 265.397 3.627 20 10 CHCDRO CC[C@@H](CSC)[NH2+]Cc1ccc(N(CC)CC)cc1 ZINC000163863741 1127147371 /nfs/dbraw/zinc/14/73/71/1127147371.db2.gz AOLGYMXBGKPVGL-HNNXBMFYSA-N 1 0 280.481 3.764 20 10 CHCDRO CC[C@@H](CC(F)(F)F)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000760659653 1127153213 /nfs/dbraw/zinc/15/32/13/1127153213.db2.gz MXPSYAUDDWHYDX-LBPRGKRZSA-N 1 0 274.330 3.573 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)C[C@H](O)c1ccco1)c1ccccc1O ZINC000156415899 1127154933 /nfs/dbraw/zinc/15/49/33/1127154933.db2.gz FNIPOUOUUCNGSN-NOLJZWGESA-N 1 0 289.375 3.538 20 10 CHCDRO Cc1csc(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)n1 ZINC000284264029 1127179072 /nfs/dbraw/zinc/17/90/72/1127179072.db2.gz WLCYOFKNMMSRDP-LBPRGKRZSA-N 1 0 276.405 3.625 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2ccoc2)cc1 ZINC000164788613 1127187299 /nfs/dbraw/zinc/18/72/99/1127187299.db2.gz ZYSUFLWDYJOBFS-AWEZNQCLSA-N 1 0 272.392 3.977 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2ccoc2)cc1 ZINC000164788733 1127186746 /nfs/dbraw/zinc/18/67/46/1127186746.db2.gz ZYSUFLWDYJOBFS-CQSZACIVSA-N 1 0 272.392 3.977 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2CCCC[C@H]2C)cc1Br ZINC001237675779 1131126424 /nfs/dbraw/zinc/12/64/24/1131126424.db2.gz ARKJMKXJSUXCKV-LLVKDONJSA-N 1 0 298.224 3.838 20 10 CHCDRO CC(C)(F)CC[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000698196997 1127191041 /nfs/dbraw/zinc/19/10/41/1127191041.db2.gz VSQFQYYFNBNFJW-UHFFFAOYSA-N 1 0 278.415 3.905 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CC[C@@H]2CCO[C@@H](C)C2)c(O)c1 ZINC000285293283 1127221490 /nfs/dbraw/zinc/22/14/90/1127221490.db2.gz RTRAVUKIILJEEH-HRCADAONSA-N 1 0 291.435 3.865 20 10 CHCDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]Cc1ccoc1 ZINC000168737293 1127224685 /nfs/dbraw/zinc/22/46/85/1127224685.db2.gz CBWWQHDNBKVUJE-AAEUAGOBSA-N 1 0 257.333 3.632 20 10 CHCDRO CC(C)[N@@H+](Cc1cc(F)c(Cl)cc1[O-])CC1CC1 ZINC001237935300 1131153581 /nfs/dbraw/zinc/15/35/81/1131153581.db2.gz CDFRXPLFJWIKIG-UHFFFAOYSA-N 1 0 271.763 3.805 20 10 CHCDRO Cc1cccc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCO3)c1 ZINC000157190509 1127260671 /nfs/dbraw/zinc/26/06/71/1127260671.db2.gz ANMKSXMQBVODLX-CQSZACIVSA-N 1 0 267.372 3.781 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@H](C(F)(F)F)C2)cc1C ZINC000057535367 1127263316 /nfs/dbraw/zinc/26/33/16/1127263316.db2.gz HFEICHDYJJYCTM-CYBMUJFWSA-N 1 0 287.325 3.783 20 10 CHCDRO COCC(C)(C)CCC[NH2+][C@H](C)c1cc(F)ccc1O ZINC000287217971 1127297457 /nfs/dbraw/zinc/29/74/57/1127297457.db2.gz XIGBQXAQWIDCHA-GFCCVEGCSA-N 1 0 283.387 3.635 20 10 CHCDRO COCCC(C)(C)C[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000760894216 1127319423 /nfs/dbraw/zinc/31/94/23/1127319423.db2.gz KCVBADBSHFOUQG-AAEUAGOBSA-N 1 0 295.398 3.732 20 10 CHCDRO C[C@H]([NH2+]CCC[C@@H]1CCCCO1)c1cc(F)cc(F)c1[O-] ZINC000760904260 1127325493 /nfs/dbraw/zinc/32/54/93/1127325493.db2.gz BOTOEXUDUSJQNG-AAEUAGOBSA-N 1 0 299.361 3.670 20 10 CHCDRO CC(C)c1ccc(O)c(C[N@@H+]2CCSC(C)(C)C2)c1 ZINC001308620202 1127396711 /nfs/dbraw/zinc/39/67/11/1127396711.db2.gz SCJYVLZVURPTFK-UHFFFAOYSA-N 1 0 279.449 3.843 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CCC[C@@H]1c1ccccc1 ZINC000226562060 1127410762 /nfs/dbraw/zinc/41/07/62/1127410762.db2.gz FGOZTPPCEIGIGN-MRXNPFEDSA-N 1 0 271.335 3.868 20 10 CHCDRO CC[C@H]1CCC[C@H]([NH2+]Cc2cc(F)ccc2O)C1 ZINC000226611044 1127412490 /nfs/dbraw/zinc/41/24/90/1127412490.db2.gz WBYQVJGSCGGRNO-FZMZJTMJSA-N 1 0 251.345 3.590 20 10 CHCDRO CC[C@@H]1CCC[C@H]([NH2+]Cc2cc(F)ccc2O)C1 ZINC000226611039 1127412512 /nfs/dbraw/zinc/41/25/12/1127412512.db2.gz WBYQVJGSCGGRNO-RISCZKNCSA-N 1 0 251.345 3.590 20 10 CHCDRO C[NH+](C)Cc1cccc(NCc2cccc(Cl)c2O)c1 ZINC000158046657 1127415862 /nfs/dbraw/zinc/41/58/62/1127415862.db2.gz LRPRXGBHLHVLPD-UHFFFAOYSA-N 1 0 290.794 3.719 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCCc3ccccc3C2)c1O ZINC000158031656 1127415970 /nfs/dbraw/zinc/41/59/70/1127415970.db2.gz BOLPLLTZZXANPF-UHFFFAOYSA-N 1 0 267.372 3.649 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cccc(C)c1O)c1ccccc1OC ZINC000158102456 1127436631 /nfs/dbraw/zinc/43/66/31/1127436631.db2.gz KDBQHLSURXOBGJ-MRXNPFEDSA-N 1 0 285.387 3.950 20 10 CHCDRO CCn1cc([C@H](C)[NH2+]Cc2c(C)c3ccccc3n2C)cn1 ZINC000359008164 1127444359 /nfs/dbraw/zinc/44/43/59/1127444359.db2.gz WDBCZQYKHKYBHR-AWEZNQCLSA-N 1 0 296.418 3.554 20 10 CHCDRO CCOc1cccc(C[NH2+][C@H]2CCC[C@H](C)CC2)c1O ZINC000227309971 1127469412 /nfs/dbraw/zinc/46/94/12/1127469412.db2.gz ACIXCEVGTAHKCH-ZFWWWQNUSA-N 1 0 277.408 3.849 20 10 CHCDRO C[C@H]([NH2+][C@@H](c1ccccc1)[C@@H]1CCOC1)c1ccccc1O ZINC000360697802 1127506613 /nfs/dbraw/zinc/50/66/13/1127506613.db2.gz IYZLLBXHXMBBEW-GMBSWORKSA-N 1 0 297.398 3.821 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2cccc(F)c2)c(O)c1 ZINC000293622907 1127509285 /nfs/dbraw/zinc/50/92/85/1127509285.db2.gz HCAMZUISWDZMCC-CYBMUJFWSA-N 1 0 273.351 3.999 20 10 CHCDRO COC1(CC[NH2+][C@@H](C)c2ccc(C)c(C)c2O)CCC1 ZINC000293681832 1127512723 /nfs/dbraw/zinc/51/27/23/1127512723.db2.gz KIHVIBZANZFJPO-AWEZNQCLSA-N 1 0 277.408 3.619 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@](C)(O)c2ccccc2)c(O)c1 ZINC000293923004 1127534210 /nfs/dbraw/zinc/53/42/10/1127534210.db2.gz XLNJZMOEKAGHBJ-KXBFYZLASA-N 1 0 299.414 3.567 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@H]2CCO[C@H](C3CC3)C2)c(O)c1 ZINC000294343930 1127566157 /nfs/dbraw/zinc/56/61/57/1127566157.db2.gz PNRDBDTZMOZXHN-QRTARXTBSA-N 1 0 289.419 3.617 20 10 CHCDRO CC[C@@H]1CCCC[N@@H+]1Cc1cc(Cl)cc(OC)c1O ZINC000228561073 1127567682 /nfs/dbraw/zinc/56/76/82/1127567682.db2.gz NXINYKQWLNIJMG-CYBMUJFWSA-N 1 0 283.799 3.819 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]CCC2CCCC2)c1O ZINC000228670322 1127582807 /nfs/dbraw/zinc/58/28/07/1127582807.db2.gz KJCWCHAVUGYHLG-UHFFFAOYSA-N 1 0 283.799 3.724 20 10 CHCDRO CCC1(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)CCOCC1 ZINC000294558960 1127583128 /nfs/dbraw/zinc/58/31/28/1127583128.db2.gz BHCNDNXCBGBJAI-OAHLLOKOSA-N 1 0 291.435 3.866 20 10 CHCDRO CCC[C@@H](CC)[NH2+]Cc1cc(Cl)cc(OC)c1O ZINC000228673657 1127584186 /nfs/dbraw/zinc/58/41/86/1127584186.db2.gz HULMTFRSMFTJQG-GFCCVEGCSA-N 1 0 271.788 3.723 20 10 CHCDRO C[N@H+](Cc1c(O)cccc1Br)CC(C)(C)C ZINC000707141342 1127652594 /nfs/dbraw/zinc/65/25/94/1127652594.db2.gz CPGNAPKBDAPEAR-UHFFFAOYSA-N 1 0 286.213 3.633 20 10 CHCDRO CC(C)Oc1ccccc1C[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000296028849 1127661202 /nfs/dbraw/zinc/66/12/02/1127661202.db2.gz PZRSEYNYGHPIBP-MRXNPFEDSA-N 1 0 297.398 3.957 20 10 CHCDRO CCO[C@H](C[NH2+][C@@H]1CCc2cccc(O)c21)c1ccccc1 ZINC000296584084 1127676684 /nfs/dbraw/zinc/67/66/84/1127676684.db2.gz WGSHXXYLUKZNAW-SJLPKXTDSA-N 1 0 297.398 3.747 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]Cc1nc(C3CC3)cs1)CC2 ZINC000297089250 1127688497 /nfs/dbraw/zinc/68/84/97/1127688497.db2.gz XEKDHNKXSUAYKA-LBPRGKRZSA-N 1 0 286.400 3.503 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)CC(F)(F)F)c1ccccc1O ZINC000229578873 1127696584 /nfs/dbraw/zinc/69/65/84/1127696584.db2.gz JIYZDTFYWZJIDA-KOLCDFICSA-N 1 0 261.287 3.774 20 10 CHCDRO Cc1ncsc1C[N@@H+](C)Cc1c(O)ccc2ccccc21 ZINC000172495979 1127766640 /nfs/dbraw/zinc/76/66/40/1127766640.db2.gz RYLUKNFVEPVBSN-UHFFFAOYSA-N 1 0 298.411 3.942 20 10 CHCDRO CCC(CC)(C[NH2+]Cc1ccc(N(C)C)cc1)SC ZINC000230708031 1127772665 /nfs/dbraw/zinc/77/26/65/1127772665.db2.gz BWAHSMIWVXQOGH-UHFFFAOYSA-N 1 0 280.481 3.764 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2OCCc3ccccc32)c1 ZINC000371870659 1127782852 /nfs/dbraw/zinc/78/28/52/1127782852.db2.gz RRFLADLIBWVLFC-KUHUBIRLSA-N 1 0 297.398 3.665 20 10 CHCDRO Cc1ccc2c(c1)[C@H]([NH2+][C@H](C)c1cc(C)ccc1O)CO2 ZINC000373265107 1127830749 /nfs/dbraw/zinc/83/07/49/1127830749.db2.gz IDFLYKXCPCBUSJ-CZUORRHYSA-N 1 0 283.371 3.793 20 10 CHCDRO C[C@@H](Cc1cccs1)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000035253930 1127904602 /nfs/dbraw/zinc/90/46/02/1127904602.db2.gz OKTIFYBEOZOTCJ-ZDUSSCGKSA-N 1 0 274.433 3.535 20 10 CHCDRO CCC[C@H](C)[NH2+][C@H](C)c1ccc(Br)cc1O ZINC000134898892 1128049775 /nfs/dbraw/zinc/04/97/75/1128049775.db2.gz ZGKCCWIXTGCDAM-VHSXEESVSA-N 1 0 286.213 3.994 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cnn(C2CCC2)c1 ZINC000924573858 1128105063 /nfs/dbraw/zinc/10/50/63/1128105063.db2.gz LDZGIHPGNKCTJA-AWEZNQCLSA-N 1 0 298.434 3.525 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)C1CC1)c1cc(Br)ccc1O ZINC000134911296 1128115785 /nfs/dbraw/zinc/11/57/85/1128115785.db2.gz ODLPJSHVCBVSKT-RKDXNWHRSA-N 1 0 284.197 3.604 20 10 CHCDRO CCSCC[NH2+]Cc1ccc(N(CC)CC)c(F)c1 ZINC000761519751 1128133007 /nfs/dbraw/zinc/13/30/07/1128133007.db2.gz HLKKBTRFHXBSSI-UHFFFAOYSA-N 1 0 284.444 3.515 20 10 CHCDRO CC[C@H](c1cccc(Cl)c1[O-])[NH+]1CCC([NH3+])(CC)CC1 ZINC000925759806 1128141018 /nfs/dbraw/zinc/14/10/18/1128141018.db2.gz MFKDWFFGQOAYIE-CQSZACIVSA-N 1 0 296.842 3.700 20 10 CHCDRO C[C@@H](Cc1cccc(F)c1)[NH2+][C@@H](C)c1ccccc1O ZINC001168459215 1128142115 /nfs/dbraw/zinc/14/21/15/1128142115.db2.gz KUPXSGFSYWBVGU-STQMWFEESA-N 1 0 273.351 3.813 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H]2CC[C@H]2SC)cc1F ZINC000761988257 1128259104 /nfs/dbraw/zinc/25/91/04/1128259104.db2.gz ZKRPWQVGFYPMAD-GOEBONIOSA-N 1 0 296.455 3.656 20 10 CHCDRO CC[C@@H]([NH2+]C[C@]12CCC[C@H]1OCC2)c1ccc(C)cc1O ZINC000926917221 1128202375 /nfs/dbraw/zinc/20/23/75/1128202375.db2.gz YTTHSCXIEPWPLU-KBAYOESNSA-N 1 0 289.419 3.701 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1C[C@H]1C(F)(F)F)c1ccccc1O ZINC000926946252 1128204656 /nfs/dbraw/zinc/20/46/56/1128204656.db2.gz AOHSJTQRMUSNTM-WCQGTBRESA-N 1 0 273.298 3.631 20 10 CHCDRO Cc1cnc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)c(C)c1 ZINC000926954262 1128205933 /nfs/dbraw/zinc/20/59/33/1128205933.db2.gz IXGKTIHVRKSMKF-HNNXBMFYSA-N 1 0 283.419 3.615 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@H]1CCSC3(CCC3)C1)CC2 ZINC000927039837 1128210664 /nfs/dbraw/zinc/21/06/64/1128210664.db2.gz SSQWVQPEGCKPKC-KBPBESRZSA-N 1 0 289.444 3.787 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@@H]1CCSC3(CCC3)C1)CC2 ZINC000927039840 1128211125 /nfs/dbraw/zinc/21/11/25/1128211125.db2.gz SSQWVQPEGCKPKC-ZIAGYGMSSA-N 1 0 289.444 3.787 20 10 CHCDRO C[C@H]([N@H+](C)Cc1cc2c(cc1O)CCC2)C(C)(C)C ZINC000914568109 1128211602 /nfs/dbraw/zinc/21/16/02/1128211602.db2.gz AJUKVMATHOVMFD-LBPRGKRZSA-N 1 0 261.409 3.747 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc(C2CC2)nn1C)c1ccc(C)cc1O ZINC000927103148 1128218348 /nfs/dbraw/zinc/21/83/48/1128218348.db2.gz YJHFILZAMWJVAI-MRXNPFEDSA-N 1 0 299.418 3.552 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CC[C@@H]2CCC3(CCC3)O2)c1 ZINC000927127196 1128220590 /nfs/dbraw/zinc/22/05/90/1128220590.db2.gz GKIJNRFDEBXIGL-CABCVRRESA-N 1 0 289.419 3.843 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C2([C@H]3CCCCO3)CC2)c(O)c1C ZINC000927164523 1128223879 /nfs/dbraw/zinc/22/38/79/1128223879.db2.gz XKARLNYJRNCRMX-GDBMZVCRSA-N 1 0 289.419 3.761 20 10 CHCDRO Cc1c(C[NH+]2CCC(C)(F)CC2)c2ccccc2n1C ZINC001138252534 1128280229 /nfs/dbraw/zinc/28/02/29/1128280229.db2.gz KHYWNOBYVNGBTO-UHFFFAOYSA-N 1 0 274.383 3.811 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCc2ccccc2F)c1 ZINC000035628598 1128319254 /nfs/dbraw/zinc/31/92/54/1128319254.db2.gz ZZQIIOCDGZAIJP-ZDUSSCGKSA-N 1 0 273.351 3.733 20 10 CHCDRO CCC(CC)[C@H](C[NH2+][C@@H](C)c1cc(C)ccc1O)N(C)C ZINC000035628956 1128319341 /nfs/dbraw/zinc/31/93/41/1128319341.db2.gz VIJYXFMHAURGDO-YOEHRIQHSA-N 1 0 292.467 3.718 20 10 CHCDRO COc1ccc(CC[NH2+][C@H](C)c2cc(C)ccc2O)cc1 ZINC000035628565 1128319522 /nfs/dbraw/zinc/31/95/22/1128319522.db2.gz VIAMHNVYMJIGEW-CQSZACIVSA-N 1 0 285.387 3.603 20 10 CHCDRO CCC(CC)[C@@H](C[NH2+][C@H](C)c1cc(C)ccc1O)N(C)C ZINC000035628957 1128319625 /nfs/dbraw/zinc/31/96/25/1128319625.db2.gz VIJYXFMHAURGDO-RHSMWYFYSA-N 1 0 292.467 3.718 20 10 CHCDRO COc1cccc(C[N@H+](C)Cc2cc(C)cc(C)c2O)c1 ZINC000915803558 1128340005 /nfs/dbraw/zinc/34/00/05/1128340005.db2.gz HNDAICPQRMLMPK-UHFFFAOYSA-N 1 0 285.387 3.650 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H](CO)CC2CCCC2)c1 ZINC000798936805 1128391406 /nfs/dbraw/zinc/39/14/06/1128391406.db2.gz GTAIEDFXGOSPTG-HOCLYGCPSA-N 1 0 291.435 3.540 20 10 CHCDRO Cc1cc(C[NH2+][C@H](c2ccccn2)C2CC2)ccc1N(C)C ZINC000932384109 1128407137 /nfs/dbraw/zinc/40/71/37/1128407137.db2.gz GFZHYBWBLQBPDB-IBGZPJMESA-N 1 0 295.430 3.697 20 10 CHCDRO Oc1ccccc1C[NH2+][C@@H]1CCc2ccc(Cl)cc21 ZINC000763394896 1128432463 /nfs/dbraw/zinc/43/24/63/1128432463.db2.gz HFGOIWSDGURORX-OAHLLOKOSA-N 1 0 273.763 3.823 20 10 CHCDRO CC[C@@H]([NH2+]CC(C)(C)N1CCCCC1)c1ccccc1O ZINC000154856688 1128580026 /nfs/dbraw/zinc/58/00/26/1128580026.db2.gz XFNPEQFBBOAKSG-MRXNPFEDSA-N 1 0 290.451 3.697 20 10 CHCDRO CC(C)C[C@H](C)[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1 ZINC000155307239 1128604190 /nfs/dbraw/zinc/60/41/90/1128604190.db2.gz IZTMEVBJZNNCBT-JKSUJKDBSA-N 1 0 290.451 3.608 20 10 CHCDRO CC(C)[C@H]1CCC[N@@H+]1Cc1ccc2c(c1)CCCN2C ZINC001138359125 1128628758 /nfs/dbraw/zinc/62/87/58/1128628758.db2.gz LMLMQQLDTSHJQQ-QGZVFWFLSA-N 1 0 272.436 3.689 20 10 CHCDRO C[N@H+](CCc1ccc(F)cc1)Cc1cc2c(cc1O)CCC2 ZINC000919948288 1128653686 /nfs/dbraw/zinc/65/36/86/1128653686.db2.gz IHEDMBQPHWTLRI-UHFFFAOYSA-N 1 0 299.389 3.695 20 10 CHCDRO C[C@@H]1c2c(F)cccc2CC[N@H+]1Cc1cc(F)ccc1O ZINC000779020213 1128683406 /nfs/dbraw/zinc/68/34/06/1128683406.db2.gz KEAFAGRMOGOHEB-LLVKDONJSA-N 1 0 289.325 3.790 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]Cc2cccc(C)n2)cc1 ZINC000048329588 1128699279 /nfs/dbraw/zinc/69/92/79/1128699279.db2.gz ZZCNEEZZSWTPBW-UHFFFAOYSA-N 1 0 283.419 3.526 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@H+](C)CCOc2ccccc2)c1 ZINC000216023662 1128736707 /nfs/dbraw/zinc/73/67/07/1128736707.db2.gz MQOPXRDAJUVFIS-UHFFFAOYSA-N 1 0 285.387 3.520 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2CCOc3ccccc32)c1 ZINC000185404893 1117818945 /nfs/dbraw/zinc/81/89/45/1117818945.db2.gz ZJYSJKKJZUCFDN-CABCVRRESA-N 1 0 297.398 3.918 20 10 CHCDRO CCc1nc(C[NH2+][C@@H](C)c2cc(C)ccc2O)cs1 ZINC000185397055 1117819622 /nfs/dbraw/zinc/81/96/22/1117819622.db2.gz GEBNBUUIQQDDGL-NSHDSACASA-N 1 0 276.405 3.570 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]C/C=C/c2ccccc2)c1 ZINC000185440112 1117823268 /nfs/dbraw/zinc/82/32/68/1117823268.db2.gz IXFYSMKRBGFGGU-MRZGDXHCSA-N 1 0 283.371 3.765 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCCNc2ccccc2)c1 ZINC000185489350 1117828671 /nfs/dbraw/zinc/82/86/71/1117828671.db2.gz BAOZHJPXJRQLTA-OAHLLOKOSA-N 1 0 284.403 3.853 20 10 CHCDRO CCc1cnc(CC[NH2+][C@H](C)c2cc(C)ccc2O)s1 ZINC000185583237 1117852395 /nfs/dbraw/zinc/85/23/95/1117852395.db2.gz KXTFELRNXILMQK-GFCCVEGCSA-N 1 0 290.432 3.613 20 10 CHCDRO CCO[C@H](CC[NH2+][C@@H](C)c1ccc(C)cc1O)C(C)C ZINC000185625681 1117859960 /nfs/dbraw/zinc/85/99/60/1117859960.db2.gz NQLAJFCRNSUABY-WMLDXEAASA-N 1 0 279.424 3.802 20 10 CHCDRO COCCC1(C[NH2+][C@H](C)c2ccc(C)cc2O)CCC1 ZINC000185753373 1117880353 /nfs/dbraw/zinc/88/03/53/1117880353.db2.gz IRZXYANTNVHFQZ-CQSZACIVSA-N 1 0 277.408 3.558 20 10 CHCDRO C[C@H]1CCC[N@H+](Cc2cc3c(cc2O)CCC3)CC1 ZINC000748081659 1117923339 /nfs/dbraw/zinc/92/33/39/1117923339.db2.gz BICAPOFLWQLOFV-ZDUSSCGKSA-N 1 0 259.393 3.503 20 10 CHCDRO C[C@@H]1CCCC[N@H+](Cc2cc(Br)ccc2O)C1 ZINC000705477087 1117973364 /nfs/dbraw/zinc/97/33/64/1117973364.db2.gz LJZWTYPWCPJRRZ-LLVKDONJSA-N 1 0 298.224 3.777 20 10 CHCDRO COc1ccccc1C[C@@H]1CCC[N@@H+]1Cc1ccccc1O ZINC000179564968 1128748985 /nfs/dbraw/zinc/74/89/85/1128748985.db2.gz IDRDXRRRCOIDGZ-KRWDZBQOSA-N 1 0 297.398 3.608 20 10 CHCDRO CS[C@@H]1CCCC[C@H]1[NH2+][C@H](C)c1cc(F)ccc1O ZINC000300418714 1118027935 /nfs/dbraw/zinc/02/79/35/1118027935.db2.gz AMZYEYRCACDFGT-WDBKCZKBSA-N 1 0 283.412 3.856 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H](C)c2ccc(C)cc2)c1O ZINC000037770016 1118037255 /nfs/dbraw/zinc/03/72/55/1118037255.db2.gz FWZIWEHXEKJRGI-AWEZNQCLSA-N 1 0 285.387 3.950 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]CCc2cccc(Cl)c2)c1 ZINC000237683812 1128751944 /nfs/dbraw/zinc/75/19/44/1128751944.db2.gz XEIJYTVWBJEKBD-UHFFFAOYSA-N 1 0 275.779 3.686 20 10 CHCDRO Cc1ccccc1CC(C)(C)[NH2+]Cc1ccccc1O ZINC000237718415 1128753844 /nfs/dbraw/zinc/75/38/44/1128753844.db2.gz BMDSFFRLKOAWIG-UHFFFAOYSA-N 1 0 269.388 3.812 20 10 CHCDRO Cc1[nH]c2ccccc2c1CC[NH2+]Cc1ccccc1O ZINC000237716544 1128754112 /nfs/dbraw/zinc/75/41/12/1128754112.db2.gz FTUCNKUIZRJZEK-UHFFFAOYSA-N 1 0 280.371 3.514 20 10 CHCDRO CCOc1ccccc1C[NH2+][C@@H](C)c1ccccc1O ZINC000179878168 1118079657 /nfs/dbraw/zinc/07/96/57/1118079657.db2.gz NTSNHDCCFRJXHS-ZDUSSCGKSA-N 1 0 271.360 3.642 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H]2CS[C@@H](C(C)(C)C)C2)cc1 ZINC000754129432 1118108809 /nfs/dbraw/zinc/10/88/09/1118108809.db2.gz QCXOXWSHJCXNBN-GDBMZVCRSA-N 1 0 292.492 3.762 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCc2ccc(C)o2)cc1 ZINC000764921483 1118125425 /nfs/dbraw/zinc/12/54/25/1118125425.db2.gz QEQCCMDWWPSUNO-OAHLLOKOSA-N 1 0 286.419 3.937 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(N2CCSCC2)cc1)C(C)C ZINC000765081394 1118133650 /nfs/dbraw/zinc/13/36/50/1118133650.db2.gz QCUBWVHSHDCGFR-QGZVFWFLSA-N 1 0 292.492 3.764 20 10 CHCDRO CC[C@@H](C)[C@@H](C)[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000765080169 1118134202 /nfs/dbraw/zinc/13/42/02/1118134202.db2.gz LMGXPORZTGLHCT-HUUCEWRRSA-N 1 0 292.492 3.764 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCc2ccc(O)cc2)cc1 ZINC000765348167 1118146939 /nfs/dbraw/zinc/14/69/39/1118146939.db2.gz JCOBJNABWFSRGG-OAHLLOKOSA-N 1 0 298.430 3.742 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccc(O)cc1)c1ccc(N(C)C)cc1 ZINC000765349761 1118146985 /nfs/dbraw/zinc/14/69/85/1118146985.db2.gz OCKVKGYAOQDYRJ-LJQANCHMSA-N 1 0 298.430 3.742 20 10 CHCDRO Cc1ccccc1OCC[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000765397187 1118148317 /nfs/dbraw/zinc/14/83/17/1118148317.db2.gz ZWCIPUZEEKLZOO-INIZCTEOSA-N 1 0 298.430 3.791 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](C)C1CC1)c1ccc(N(C)C)cc1 ZINC000765397146 1118148447 /nfs/dbraw/zinc/14/84/47/1118148447.db2.gz ZQJCDOHRNVPCKK-DYVFJYSZSA-N 1 0 260.425 3.839 20 10 CHCDRO C[C@@H](COc1ccccc1)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000765438990 1118151342 /nfs/dbraw/zinc/15/13/42/1118151342.db2.gz OLVNGNAMTBVDGN-HOTGVXAUSA-N 1 0 298.430 3.871 20 10 CHCDRO CO[C@@H](C)C[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000188123716 1128760442 /nfs/dbraw/zinc/76/04/42/1128760442.db2.gz CQNQKCDZIFTIAC-HOTGVXAUSA-N 1 0 290.451 3.753 20 10 CHCDRO Cc1cccc(C[N@H+](C)CCc2ccc(F)cc2)c1O ZINC000179797042 1128759906 /nfs/dbraw/zinc/75/99/06/1128759906.db2.gz KMMYHKNHUXVHJN-UHFFFAOYSA-N 1 0 273.351 3.514 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccc(N(C)C)cc1 ZINC000765608842 1118182015 /nfs/dbraw/zinc/18/20/15/1118182015.db2.gz MBVJXONJARTLDL-CQSZACIVSA-N 1 0 296.414 3.538 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cc(F)cc(F)c1 ZINC000765608665 1118182199 /nfs/dbraw/zinc/18/21/99/1118182199.db2.gz ITJKZEZLNWNUOD-LLVKDONJSA-N 1 0 289.325 3.751 20 10 CHCDRO CC[C@H](C)N(C)CC[NH2+][C@H](C)c1ccc(N(C)CC)cc1 ZINC000765653570 1118188140 /nfs/dbraw/zinc/18/81/40/1118188140.db2.gz BOCUDLJRWPBEGN-JKSUJKDBSA-N 1 0 291.483 3.524 20 10 CHCDRO C[C@@H]([NH2+]CC1(C2CC2)CCC1)c1cc(F)ccc1O ZINC000186156635 1118199362 /nfs/dbraw/zinc/19/93/62/1118199362.db2.gz OPMXZRKDSQGKKP-LLVKDONJSA-N 1 0 263.356 3.762 20 10 CHCDRO CC[C@@](C)(O)C[N@H+](Cc1ccccc1)Cc1ccccc1O ZINC000188579844 1128763239 /nfs/dbraw/zinc/76/32/39/1128763239.db2.gz KDVTUMLJKOGUIC-LJQANCHMSA-N 1 0 299.414 3.555 20 10 CHCDRO CCOC(C)(C)C[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000188687675 1128764171 /nfs/dbraw/zinc/76/41/71/1128764171.db2.gz RBAHVGJNDFHQMS-CYBMUJFWSA-N 1 0 291.435 3.737 20 10 CHCDRO C[C@H]([NH2+]Cc1cc2ccccc2o1)c1ccccc1O ZINC000179896300 1128764203 /nfs/dbraw/zinc/76/42/03/1128764203.db2.gz IOFAGQLNYJBMOC-LBPRGKRZSA-N 1 0 267.328 3.989 20 10 CHCDRO CN(C)c1ccc(C[NH2+]Cc2cccc3[nH]ccc32)cc1 ZINC000070938684 1118272414 /nfs/dbraw/zinc/27/24/14/1118272414.db2.gz LLYKEHNNBRDRCX-UHFFFAOYSA-N 1 0 279.387 3.524 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](C)Cc2cccc(F)c2)c1 ZINC000160469285 1118431036 /nfs/dbraw/zinc/43/10/36/1118431036.db2.gz HLHJTKQWQAJMLJ-UHFFFAOYSA-N 1 0 289.350 3.562 20 10 CHCDRO C[C@@H]1CCC[C@@H]([NH2+]Cc2ccc3c(c2)CCCN3C)C1 ZINC000050286457 1118475088 /nfs/dbraw/zinc/47/50/88/1118475088.db2.gz VSUHCZQKMWKSTN-RHSMWYFYSA-N 1 0 272.436 3.737 20 10 CHCDRO C[C@@H]([NH2+]CCC1CC1)c1ccc2ccccc2c1O ZINC000088454733 1118520247 /nfs/dbraw/zinc/52/02/47/1118520247.db2.gz OJLMTNLAWZEVAX-GFCCVEGCSA-N 1 0 255.361 3.996 20 10 CHCDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]CCc1cscn1 ZINC000111627247 1118523128 /nfs/dbraw/zinc/52/31/28/1118523128.db2.gz UMVBSBDZBDWEIG-WCQYABFASA-N 1 0 288.416 3.538 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H]1CCCC12CC2 ZINC000706937020 1118572629 /nfs/dbraw/zinc/57/26/29/1118572629.db2.gz RVQYVTCXWZWKTG-KRWDZBQOSA-N 1 0 268.404 3.909 20 10 CHCDRO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1cc(Cl)ccc1O ZINC000128029104 1118578333 /nfs/dbraw/zinc/57/83/33/1118578333.db2.gz UTSZLSGJXVBMKI-PHIMTYICSA-N 1 0 253.773 3.809 20 10 CHCDRO COc1ccc(C[NH2+]C[C@@H]2CCCC[C@H]2C)cc1C ZINC000109935544 1118590073 /nfs/dbraw/zinc/59/00/73/1118590073.db2.gz OELUBJZLZVIXLZ-CJNGLKHVSA-N 1 0 261.409 3.920 20 10 CHCDRO CC[C@H]([NH2+]CCC[C@H]1CCOC1)c1ccc(C)cc1O ZINC000834906434 1118623674 /nfs/dbraw/zinc/62/36/74/1118623674.db2.gz WTLASZNENKMOIV-HOCLYGCPSA-N 1 0 277.408 3.558 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2c(O)cccc2Cl)s1 ZINC000083551942 1118702564 /nfs/dbraw/zinc/70/25/64/1118702564.db2.gz QTVHKYYAVZEZHR-UHFFFAOYSA-N 1 0 267.781 3.705 20 10 CHCDRO CC1(C)C[N@H+](Cc2ccc(Cl)cc2O)CCC1(F)F ZINC001140462826 1118721274 /nfs/dbraw/zinc/72/12/74/1118721274.db2.gz LQSAPEIZCMYZCW-UHFFFAOYSA-N 1 0 289.753 3.913 20 10 CHCDRO C[C@H]1C[C@H](C)C[NH+](Cc2ccc(Cl)cc2O)C1 ZINC001140465218 1118739477 /nfs/dbraw/zinc/73/94/77/1118739477.db2.gz IOKNLQFAHVTCOC-QWRGUYRKSA-N 1 0 253.773 3.524 20 10 CHCDRO CCS[C@H]1CC[C@@H]([N@H+](C)Cc2cccc(C)c2O)C1 ZINC000180668051 1128801642 /nfs/dbraw/zinc/80/16/42/1128801642.db2.gz GDHRUIZDRNBNCX-CABCVRRESA-N 1 0 279.449 3.807 20 10 CHCDRO CCS[C@@H]1CC[C@H]([N@H+](C)Cc2cc(OC)ccc2O)C1 ZINC000180668229 1128801824 /nfs/dbraw/zinc/80/18/24/1128801824.db2.gz ODWQRYCQDXHAOW-DZGCQCFKSA-N 1 0 295.448 3.507 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]CC2(C3CC3)CC2)cc1 ZINC000835041760 1118816091 /nfs/dbraw/zinc/81/60/91/1118816091.db2.gz NJUNVIVRTJRSNM-ARJAWSKDSA-N 1 0 270.420 3.546 20 10 CHCDRO CCC[C@H]1CCCC[N@@H+]1Cc1ccc(OC)cc1O ZINC000213659507 1118818467 /nfs/dbraw/zinc/81/84/67/1118818467.db2.gz ISHDOSVEVVBIOQ-AWEZNQCLSA-N 1 0 263.381 3.555 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]C2(C3(C)CC3)CC2)cc1 ZINC000835053432 1118830210 /nfs/dbraw/zinc/83/02/10/1118830210.db2.gz CGQLPKUPUCPCMQ-PLNGDYQASA-N 1 0 270.420 3.688 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]C2(c3ccccc3)CC2)c1 ZINC000068979763 1128813877 /nfs/dbraw/zinc/81/38/77/1128813877.db2.gz WIUMMLHIDDZIGD-UHFFFAOYSA-N 1 0 283.371 3.570 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@H]2CCCS2)cc1 ZINC000246975994 1119000942 /nfs/dbraw/zinc/00/09/42/1119000942.db2.gz IRFMGMFNYWWBBU-XJKSGUPXSA-N 1 0 278.465 3.689 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2cccc(Cl)c2[O-])[C@@H](C)C1 ZINC000224468484 1119003870 /nfs/dbraw/zinc/00/38/70/1119003870.db2.gz DYEPTGJAWCQUAM-MNOVXSKESA-N 1 0 253.773 3.666 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCc2ccccc2C1)c1ccccc1O ZINC000051630693 1119059113 /nfs/dbraw/zinc/05/91/13/1119059113.db2.gz WSXKUPGFZAHXLX-CJNGLKHVSA-N 1 0 267.372 3.600 20 10 CHCDRO CC1(C)CCC[N@H+](Cc2cc(F)ccc2O)CC1 ZINC000226565725 1119161868 /nfs/dbraw/zinc/16/18/68/1119161868.db2.gz KDHVGUORLWZQDJ-UHFFFAOYSA-N 1 0 251.345 3.543 20 10 CHCDRO COC[C@H](C)C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000178667394 1119221185 /nfs/dbraw/zinc/22/11/85/1119221185.db2.gz PLKSSKYCOQITIU-HZPDHXFCSA-N 1 0 290.451 3.610 20 10 CHCDRO CCC(CC)(C[NH2+]Cc1cc(F)ccc1O)SC ZINC000226613186 1119225336 /nfs/dbraw/zinc/22/53/36/1119225336.db2.gz AFUNDZHBUDHYMB-UHFFFAOYSA-N 1 0 271.401 3.543 20 10 CHCDRO COc1cccc(CNc2cc(C)[nH+]c3ccccc23)c1O ZINC000091479216 1119234856 /nfs/dbraw/zinc/23/48/56/1119234856.db2.gz QJVGAPWHBKHQRR-UHFFFAOYSA-N 1 0 294.354 3.870 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCc2ccc(Cl)nc2)c1 ZINC000185750527 1119276970 /nfs/dbraw/zinc/27/69/70/1119276970.db2.gz VKRHWBBGTMKSEJ-LBPRGKRZSA-N 1 0 290.794 3.642 20 10 CHCDRO Cc1csc(C[NH2+]Cc2c(O)cccc2Cl)c1 ZINC000383352234 1119278593 /nfs/dbraw/zinc/27/85/93/1119278593.db2.gz UWBHFFBEBXZXEE-UHFFFAOYSA-N 1 0 267.781 3.705 20 10 CHCDRO CC1(C[NH2+]Cc2ccc(N3CCCC3)cc2)CCC1 ZINC000226787962 1119334797 /nfs/dbraw/zinc/33/47/97/1119334797.db2.gz HGBCQGNJKDFKHR-UHFFFAOYSA-N 1 0 258.409 3.567 20 10 CHCDRO CC(C)(C)c1cc(O)c(O)c(C[N@@H+]2CCC[C@@H]2C2CC2)c1 ZINC000728562209 1119339396 /nfs/dbraw/zinc/33/93/96/1119339396.db2.gz IJXJBNKQVGVQJA-OAHLLOKOSA-N 1 0 289.419 3.770 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1ccccc1 ZINC000223238696 1119593035 /nfs/dbraw/zinc/59/30/35/1119593035.db2.gz DRFYWBXOVUIBRS-SWLSCSKDSA-N 1 0 253.345 3.730 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2ccccc2O)[C@@H]1c1ccccc1 ZINC000179584510 1119751437 /nfs/dbraw/zinc/75/14/37/1119751437.db2.gz DKAZEJLOWUVRGO-DYVFJYSZSA-N 1 0 253.345 3.585 20 10 CHCDRO C[C@@H]1C[C@@H](c2ccccc2)C[N@@H+]1Cc1ccccc1O ZINC000179576758 1119751847 /nfs/dbraw/zinc/75/18/47/1119751847.db2.gz YLCRFNSYHOGBER-RHSMWYFYSA-N 1 0 267.372 3.770 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCCOc2ccccc2)c(O)c1 ZINC000052092021 1119781567 /nfs/dbraw/zinc/78/15/67/1119781567.db2.gz NZQXZDQWIUIIIV-HNNXBMFYSA-N 1 0 285.387 3.820 20 10 CHCDRO CC[C@H]([NH2+]Cc1cccc(OC)c1O)C1CCCCC1 ZINC000052335344 1119813680 /nfs/dbraw/zinc/81/36/80/1119813680.db2.gz QCHRSAJFGOFLPO-HNNXBMFYSA-N 1 0 277.408 3.849 20 10 CHCDRO CC[C@H]([NH2+]CC(C)(C)N1CCCCC1)c1ccccc1O ZINC000154856579 1119830339 /nfs/dbraw/zinc/83/03/39/1119830339.db2.gz XFNPEQFBBOAKSG-INIZCTEOSA-N 1 0 290.451 3.697 20 10 CHCDRO CCOc1cccc(C[NH2+]C[C@@H]2CCCCC2(F)F)c1O ZINC000295175052 1119870287 /nfs/dbraw/zinc/87/02/87/1119870287.db2.gz UXFFKPXXLAXPOB-ZDUSSCGKSA-N 1 0 299.361 3.706 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H](C)CCCOC)cc1F ZINC000178035705 1119903597 /nfs/dbraw/zinc/90/35/97/1119903597.db2.gz MBSNXPSWHONGGY-CQSZACIVSA-N 1 0 296.430 3.577 20 10 CHCDRO Nc1ccc(C[N@@H+]2CC[C@H](C3CCCCC3)C2)cc1 ZINC000708822364 1119905982 /nfs/dbraw/zinc/90/59/82/1119905982.db2.gz QAMFNSXZMVKRBA-INIZCTEOSA-N 1 0 258.409 3.671 20 10 CHCDRO Cc1cc(CN[C@H](C)c2ncco2)c(C)n1-c1ccccc1 ZINC000926765710 1119977063 /nfs/dbraw/zinc/97/70/63/1119977063.db2.gz ZYHUQQHABMCVGO-CQSZACIVSA-N 1 0 295.386 3.933 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H]2CCCCC2(C)C)c1O ZINC000094323707 1120051641 /nfs/dbraw/zinc/05/16/41/1120051641.db2.gz UUMIPPRBEYCTCQ-OAHLLOKOSA-N 1 0 277.408 3.849 20 10 CHCDRO CCSCC[C@H](C)[NH2+][C@@H](C)c1ccccc1O ZINC000167455386 1120081018 /nfs/dbraw/zinc/08/10/18/1120081018.db2.gz BQLBDTATNNGIHP-RYUDHWBXSA-N 1 0 253.411 3.575 20 10 CHCDRO CCC(CC)[C@@H](O)C[NH2+][C@@H](CC)c1ccc(N(C)C)cc1 ZINC000765929609 1120213893 /nfs/dbraw/zinc/21/38/93/1120213893.db2.gz WHLOSUCXYONRHG-ROUUACIJSA-N 1 0 292.467 3.590 20 10 CHCDRO CCS[C@@H]1CCCC[N@H+](Cc2cc(OC)ccc2O)C1 ZINC000180221365 1120269376 /nfs/dbraw/zinc/26/93/76/1120269376.db2.gz GMCNZQDWTOXVIH-OAHLLOKOSA-N 1 0 295.448 3.508 20 10 CHCDRO CCc1cnccc1[C@@H](C)[NH2+]Cc1ccc2c(c1)CCCO2 ZINC000921964082 1120307740 /nfs/dbraw/zinc/30/77/40/1120307740.db2.gz NQMRJUUHUDXLGF-CQSZACIVSA-N 1 0 296.414 3.820 20 10 CHCDRO CC[C@@H](C[NH2+][C@H](C)c1ccc(C)c(C)c1O)N1CCCC1 ZINC000756400918 1120311667 /nfs/dbraw/zinc/31/16/67/1120311667.db2.gz LFCVONACOJMYIO-CVEARBPZSA-N 1 0 290.451 3.534 20 10 CHCDRO CC(C)(C[NH2+]Cc1ccc2c(c1)CCCO2)C(F)(F)F ZINC000922106507 1120368548 /nfs/dbraw/zinc/36/85/48/1120368548.db2.gz LKQBYIVVWBBUAQ-UHFFFAOYSA-N 1 0 287.325 3.690 20 10 CHCDRO CCCC(O)(CCC)C[NH2+][C@H](C)c1cc(C)ccc1O ZINC000185500689 1120378549 /nfs/dbraw/zinc/37/85/49/1120378549.db2.gz AZBOWTJJQWETCF-CQSZACIVSA-N 1 0 279.424 3.683 20 10 CHCDRO CCO[C@H](CC[NH2+][C@@H](C)c1cc(F)ccc1O)C(C)C ZINC000185625810 1120380068 /nfs/dbraw/zinc/38/00/68/1120380068.db2.gz VAZNXVKRZLNBOH-BLLLJJGKSA-N 1 0 283.387 3.633 20 10 CHCDRO CCOC1(C[NH2+][C@H](C)c2ccc(C)cc2O)CCCC1 ZINC000312325503 1120383962 /nfs/dbraw/zinc/38/39/62/1120383962.db2.gz GTRALQHLPVLUBV-CQSZACIVSA-N 1 0 277.408 3.701 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](CCO)C2CCCCC2)c(O)c1 ZINC000185829233 1120386641 /nfs/dbraw/zinc/38/66/41/1120386641.db2.gz ADJGUEVBYKQSQR-YOEHRIQHSA-N 1 0 291.435 3.683 20 10 CHCDRO C[C@H](COc1ccccc1)[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000756496700 1120387667 /nfs/dbraw/zinc/38/76/67/1120387667.db2.gz XLDOYJKZEXYRJY-OLZOCXBDSA-N 1 0 289.350 3.649 20 10 CHCDRO CC(C)C[C@@H]1OCCC[C@@H]1[NH2+][C@@H](C)c1ccccc1O ZINC000186826601 1120406207 /nfs/dbraw/zinc/40/62/07/1120406207.db2.gz FWPZYJXBHUORFR-QRTARXTBSA-N 1 0 277.408 3.637 20 10 CHCDRO COC1(C[NH2+][C@H](C)c2ccc(F)cc2[O-])CCCCC1 ZINC000186515883 1120454101 /nfs/dbraw/zinc/45/41/01/1120454101.db2.gz CHYUGXLIXUNHHL-GFCCVEGCSA-N 1 0 281.371 3.531 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)Cc2ccc(O)cc2)c(O)c1C ZINC000756532788 1120464981 /nfs/dbraw/zinc/46/49/81/1120464981.db2.gz GAFXEMMJFBPMDK-ZFWWWQNUSA-N 1 0 299.414 3.996 20 10 CHCDRO Cc1ccc(CC[NH2+][C@H](C)c2ccc(C)c(C)c2O)cn1 ZINC000756570536 1120538600 /nfs/dbraw/zinc/53/86/00/1120538600.db2.gz WHAMTYJELGSWLU-OAHLLOKOSA-N 1 0 284.403 3.606 20 10 CHCDRO Cc1cc(F)ccc1[C@@H](C)[NH2+]Cc1ccccc1O ZINC000922665543 1120574033 /nfs/dbraw/zinc/57/40/33/1120574033.db2.gz NTUILFUPPBZOFQ-GFCCVEGCSA-N 1 0 259.324 3.691 20 10 CHCDRO CSC1(C[NH2+][C@@H](C)c2ccc(C)cc2O)CCC1 ZINC000193806066 1120582390 /nfs/dbraw/zinc/58/23/90/1120582390.db2.gz NLNYXORYIMWKMC-LBPRGKRZSA-N 1 0 265.422 3.637 20 10 CHCDRO COc1ccccc1[C@H](C)[NH2+][C@H](C)c1ccccc1O ZINC000020096747 1120583803 /nfs/dbraw/zinc/58/38/03/1120583803.db2.gz BTASRJDHHMNLDA-OLZOCXBDSA-N 1 0 271.360 3.813 20 10 CHCDRO Cc1csc([C@H](C)C[NH2+][C@@H](C)c2ccccc2O)n1 ZINC000186569606 1120585945 /nfs/dbraw/zinc/58/59/45/1120585945.db2.gz SAEBBPBEDXZSEW-PWSUYJOCSA-N 1 0 276.405 3.611 20 10 CHCDRO C[C@H]([NH2+]C1(Cc2ccccc2)CC1)c1ccccc1O ZINC000186578926 1120598430 /nfs/dbraw/zinc/59/84/30/1120598430.db2.gz FUKXONQOWUNXQM-AWEZNQCLSA-N 1 0 267.372 3.818 20 10 CHCDRO CCCN(Cc1sc(C)nc1C)c1ccc(C[NH3+])cc1 ZINC000194981111 1120611779 /nfs/dbraw/zinc/61/17/79/1120611779.db2.gz QVJSPXPEOJZWML-UHFFFAOYSA-N 1 0 289.448 3.635 20 10 CHCDRO CCCO[C@H]1CCC[N@H+](Cc2c(O)cccc2Cl)CC1 ZINC000124031230 1120639454 /nfs/dbraw/zinc/63/94/54/1120639454.db2.gz XRFCITUFCYQUGQ-ZDUSSCGKSA-N 1 0 297.826 3.827 20 10 CHCDRO C[N@H+](Cc1ccccc1O)[C@H]1Cc2cccc(Cl)c2C1 ZINC001168739270 1120651961 /nfs/dbraw/zinc/65/19/61/1120651961.db2.gz NMQCZCJLPGDKHX-AWEZNQCLSA-N 1 0 287.790 3.645 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCCC23CCOCC3)c1 ZINC000282433088 1120660794 /nfs/dbraw/zinc/66/07/94/1120660794.db2.gz DIFXBECJSGXGDL-RHSMWYFYSA-N 1 0 289.419 3.701 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCC[C@H](O)C1)c1ccc2ccccc2c1O ZINC000185538650 1120911878 /nfs/dbraw/zinc/91/18/78/1120911878.db2.gz GLQRBBFBPZODTN-LZWOXQAQSA-N 1 0 299.414 3.747 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]CCc2ccccc2C)c1 ZINC000094182681 1120979973 /nfs/dbraw/zinc/97/99/73/1120979973.db2.gz ARCWBSGFBMZFQG-CQSZACIVSA-N 1 0 285.387 3.603 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccccc1F)c1cc(F)ccc1O ZINC000094616732 1121086440 /nfs/dbraw/zinc/08/64/40/1121086440.db2.gz QKXIMNQMDQLUBP-SNVBAGLBSA-N 1 0 263.287 3.521 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cccc(COC)c1)c1ccccc1O ZINC000038010506 1121094833 /nfs/dbraw/zinc/09/48/33/1121094833.db2.gz RLHXELWMTKSPEU-QGZVFWFLSA-N 1 0 285.387 3.780 20 10 CHCDRO CC1(C)CC(C[NH2+]Cc2c(O)cccc2Cl)C1 ZINC000701692661 1121164696 /nfs/dbraw/zinc/16/46/96/1121164696.db2.gz IYFMIFJHUYQRTD-UHFFFAOYSA-N 1 0 253.773 3.571 20 10 CHCDRO CC[C@H]1CCC[C@H]1[NH2+]CCCSc1nccs1 ZINC000766070317 1121180424 /nfs/dbraw/zinc/18/04/24/1121180424.db2.gz COADRODXEUDSOO-NWDGAFQWSA-N 1 0 270.467 3.794 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2cc(C)cc(C)c2)c1 ZINC000182434374 1128969779 /nfs/dbraw/zinc/96/97/79/1128969779.db2.gz SYOLZXCWPNGSIY-AWEZNQCLSA-N 1 0 285.387 3.868 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](OC)C1CCCC1)c1ccccc1O ZINC000703128690 1121236234 /nfs/dbraw/zinc/23/62/34/1121236234.db2.gz PDWOULSTTKCVPD-RDJZCZTQSA-N 1 0 277.408 3.638 20 10 CHCDRO CC(C)CC[C@](C)(O)C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000766128975 1121291254 /nfs/dbraw/zinc/29/12/54/1121291254.db2.gz NPDDBPXJPHWFQA-QAPCUYQASA-N 1 0 292.467 3.590 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)C2(C)CC2)cc1 ZINC000706827932 1121441195 /nfs/dbraw/zinc/44/11/95/1121441195.db2.gz VNKWJJVVZXPWOG-AWEZNQCLSA-N 1 0 260.425 3.811 20 10 CHCDRO Oc1cccc(Cl)c1C[NH+]1C2CCCC1CCC2 ZINC000707154388 1121450323 /nfs/dbraw/zinc/45/03/23/1121450323.db2.gz GLIUVCFADOYBBY-UHFFFAOYSA-N 1 0 265.784 3.953 20 10 CHCDRO CCC[C@@H]1CCC[N@H+](Cc2cccc(OCC)c2O)C1 ZINC000708480830 1121464272 /nfs/dbraw/zinc/46/42/72/1121464272.db2.gz MCKWZUOQDWKOGI-CQSZACIVSA-N 1 0 277.408 3.803 20 10 CHCDRO CCC[C@H]1CCC[N@H+](Cc2cccc(OCC)c2O)C1 ZINC000708480829 1121464770 /nfs/dbraw/zinc/46/47/70/1121464770.db2.gz MCKWZUOQDWKOGI-AWEZNQCLSA-N 1 0 277.408 3.803 20 10 CHCDRO C[C@@H]([NH2+]Cc1csc(C2CC2)n1)c1ccccc1O ZINC000708228057 1121464913 /nfs/dbraw/zinc/46/49/13/1121464913.db2.gz OQVHJRPLWWJWFV-SNVBAGLBSA-N 1 0 274.389 3.577 20 10 CHCDRO CCc1cccc(C[NH2+][C@@H](C)c2cccc(O)c2)c1O ZINC000709426760 1121470681 /nfs/dbraw/zinc/47/06/81/1121470681.db2.gz HVOYANUFOMXKIH-LBPRGKRZSA-N 1 0 271.360 3.511 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCC2(CCCC2)O1)c1ccccc1O ZINC000709496878 1121470821 /nfs/dbraw/zinc/47/08/21/1121470821.db2.gz BOWIYYZXVZHCMW-KGLIPLIRSA-N 1 0 275.392 3.535 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCc2ccccc21)c1ccccc1O ZINC000182790982 1128997040 /nfs/dbraw/zinc/99/70/40/1128997040.db2.gz XZCCCKDIQWNOPN-HIFRSBDPSA-N 1 0 267.372 3.773 20 10 CHCDRO C[C@@H]1CCC[C@@H]([NH2+]Cc2ccc3c(c2)CCCO3)[C@H]1C ZINC001177092317 1121711752 /nfs/dbraw/zinc/71/17/52/1121711752.db2.gz BWSYJJCIJGCLJY-JKIFEVAISA-N 1 0 273.420 3.926 20 10 CHCDRO Cc1cc(C[N@H+]2C[C@H](C)OC[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC000255956304 1121715611 /nfs/dbraw/zinc/71/56/11/1121715611.db2.gz GUGHSWIFABWSIF-KGLIPLIRSA-N 1 0 291.435 3.607 20 10 CHCDRO C[C@H]([NH2+]CC1(CO)CCCC1)c1ccc2ccccc2c1O ZINC000178874196 1121785273 /nfs/dbraw/zinc/78/52/73/1121785273.db2.gz SDIPNZBRPQGRSX-AWEZNQCLSA-N 1 0 299.414 3.749 20 10 CHCDRO CCN(C)c1ccc(C[NH+]2CCC(OC(C)C)CC2)cc1 ZINC000773756372 1121796461 /nfs/dbraw/zinc/79/64/61/1121796461.db2.gz KOFPZUFXPYKFRX-UHFFFAOYSA-N 1 0 290.451 3.532 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C[C@](C)(CC)OC)cc1F ZINC001178769288 1121814523 /nfs/dbraw/zinc/81/45/23/1121814523.db2.gz LAYPIQOOYAOVAR-KRWDZBQOSA-N 1 0 296.430 3.577 20 10 CHCDRO Oc1cc(OCc2ccccc2)ccc1C[NH+]1CCCC1 ZINC000182937363 1129012300 /nfs/dbraw/zinc/01/23/00/1129012300.db2.gz PLYXKPPWESOIJL-UHFFFAOYSA-N 1 0 283.371 3.567 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc(F)c(N(C)C)cc1F)[C@H]1CC1(C)C ZINC001178977455 1121831031 /nfs/dbraw/zinc/83/10/31/1121831031.db2.gz MBFUYOIKRYIKOO-IUODEOHRSA-N 1 0 296.405 3.945 20 10 CHCDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]CCOCC1CC1 ZINC000731041021 1121845242 /nfs/dbraw/zinc/84/52/42/1121845242.db2.gz LAFLJARISWQJLG-UHFFFAOYSA-N 1 0 297.398 3.575 20 10 CHCDRO CCN(C)c1ccc(C[NH+]2CCC3(CC3)CC2)cc1 ZINC000773811414 1121870632 /nfs/dbraw/zinc/87/06/32/1121870632.db2.gz CLPLBPXBMPEBMN-UHFFFAOYSA-N 1 0 258.409 3.519 20 10 CHCDRO CCC(C)(C)CC[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC001179332595 1121872442 /nfs/dbraw/zinc/87/24/42/1121872442.db2.gz CDDWXROAPZDTPY-UHFFFAOYSA-N 1 0 266.404 3.808 20 10 CHCDRO C[C@@H]1C[C@@H]1[C@@H]1C[C@H]1C[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001179592862 1121892284 /nfs/dbraw/zinc/89/22/84/1121892284.db2.gz JIJWHYPOCZDEFH-TWKWOARYSA-N 1 0 284.447 3.669 20 10 CHCDRO CC1(C)CC[C@@H](CC[NH2+]Cc2c(O)cccc2Cl)OC1 ZINC001179685395 1121898359 /nfs/dbraw/zinc/89/83/59/1121898359.db2.gz LUDXYLIGKTVHSQ-LBPRGKRZSA-N 1 0 297.826 3.731 20 10 CHCDRO c1cc2c(cc1C[NH2+][C@@H]1CCCC3(CC3)C1)CCCO2 ZINC001179670145 1121900911 /nfs/dbraw/zinc/90/09/11/1121900911.db2.gz DUDMVFDEOIGUDQ-MRXNPFEDSA-N 1 0 271.404 3.824 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CC[C@H](c3ccco3)C2)cc1C ZINC000732182302 1121909992 /nfs/dbraw/zinc/90/99/92/1121909992.db2.gz GFSAASXHYLHSHG-AWEZNQCLSA-N 1 0 271.360 3.592 20 10 CHCDRO CC[C@H]1C[N@H+](Cc2cc(C(C)C)c(C)cc2O)C[C@@H](C)O1 ZINC000732184553 1121910197 /nfs/dbraw/zinc/91/01/97/1121910197.db2.gz CLZUIKMRSMHBPQ-ZBFHGGJFSA-N 1 0 291.435 3.823 20 10 CHCDRO C[C@H]1CCC[N@H+](C/C=C/c2ccc(N(C)C)cc2)CC1 ZINC001180030808 1121939695 /nfs/dbraw/zinc/93/96/95/1121939695.db2.gz PXPDJNDDNWTKFV-YERXGYGTSA-N 1 0 272.436 3.888 20 10 CHCDRO COC1(C[N@H+](Cc2ccc(N(C)C)cc2)C(C)C)CCC1 ZINC001180076333 1121945900 /nfs/dbraw/zinc/94/59/00/1121945900.db2.gz FISHVSRRLLEDSJ-UHFFFAOYSA-N 1 0 290.451 3.532 20 10 CHCDRO Cc1ccc(C[N@H+]2C[C@@H](C)[C@@H]2c2ccccc2)c(O)c1 ZINC001180141994 1121950604 /nfs/dbraw/zinc/95/06/04/1121950604.db2.gz KFTXUQVVSIKOMQ-RDTXWAMCSA-N 1 0 267.372 3.894 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(N(C)CC)cc1)c1nccs1 ZINC000773839017 1121951836 /nfs/dbraw/zinc/95/18/36/1121951836.db2.gz OQTGPGTTWKSRJA-HNNXBMFYSA-N 1 0 289.448 3.840 20 10 CHCDRO C[C@@H]1CC[C@H](C)[N@H+]1C/C=C/c1ccc(N(C)C)cc1 ZINC001180108866 1121953396 /nfs/dbraw/zinc/95/33/96/1121953396.db2.gz ZFFRYYZBDDHBAN-FKZIUMHTSA-N 1 0 258.409 3.639 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H]2CCc3ccccc3C2)cc1F ZINC000733323236 1121976408 /nfs/dbraw/zinc/97/64/08/1121976408.db2.gz RVAKUSHOQCWXGY-KRWDZBQOSA-N 1 0 298.405 3.539 20 10 CHCDRO CCCCC[C@@H](C)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000733322933 1121976798 /nfs/dbraw/zinc/97/67/98/1121976798.db2.gz GONYLUTUIWPCHX-CYBMUJFWSA-N 1 0 266.404 3.950 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C2(c3ccc(F)cc3)CC2)c1 ZINC000733328229 1121977872 /nfs/dbraw/zinc/97/78/72/1121977872.db2.gz MOGZYHDRANWWGO-UHFFFAOYSA-N 1 0 271.335 3.619 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C2CC(c3cccc(F)c3)C2)c1 ZINC000733328391 1121978609 /nfs/dbraw/zinc/97/86/09/1121978609.db2.gz SZEGTKCHTIOYAE-UHFFFAOYSA-N 1 0 285.362 3.876 20 10 CHCDRO CC[C@](C)(C[N@H+](Cc1ccc(N(C)C)cc1)C1CC1)OC ZINC001180558791 1121999330 /nfs/dbraw/zinc/99/93/30/1121999330.db2.gz UQTCYZRSRHIFRX-GOSISDBHSA-N 1 0 290.451 3.532 20 10 CHCDRO C[C@H](c1ccc(Cl)cc1)[N@H+](C)Cc1ccc(O)cc1O ZINC001204278720 1122011213 /nfs/dbraw/zinc/01/12/13/1122011213.db2.gz JBQSHTKHCLOVSN-LLVKDONJSA-N 1 0 291.778 3.944 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]C[C@H]1CCCCC1(F)F ZINC001182054503 1122107934 /nfs/dbraw/zinc/10/79/34/1122107934.db2.gz VIOIHOCVYNWZGS-OAHLLOKOSA-N 1 0 296.405 3.976 20 10 CHCDRO Nc1ccc(C[NH+]2CCC(c3ccccc3)CC2)cc1 ZINC000071766364 1122110092 /nfs/dbraw/zinc/11/00/92/1122110092.db2.gz HIEFQNQOYHEIIG-UHFFFAOYSA-N 1 0 266.388 3.648 20 10 CHCDRO CN(C)c1ccc(/C=C\C[N@@H+]2CCC[C@@H](C3CC3)C2)cc1 ZINC001182184890 1122116776 /nfs/dbraw/zinc/11/67/76/1122116776.db2.gz USSRUMHXALVURL-LKIHTYOGSA-N 1 0 284.447 3.888 20 10 CHCDRO CN(C)c1ccc(/C=C/C[N@@H+]2CCC[C@@H](C3CC3)C2)cc1 ZINC001182184891 1122117382 /nfs/dbraw/zinc/11/73/82/1122117382.db2.gz USSRUMHXALVURL-YWPBOTNQSA-N 1 0 284.447 3.888 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1ccc2c(c1)OCO2)c1ccccc1O ZINC000192750311 1129033959 /nfs/dbraw/zinc/03/39/59/1129033959.db2.gz CECMRCFHFWYCPS-DOMZBBRYSA-N 1 0 299.370 3.923 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2ccc3c(c2)OCO3)c1 ZINC000192751147 1129034136 /nfs/dbraw/zinc/03/41/36/1129034136.db2.gz OQRNDLBTGKRUQS-CHWSQXEVSA-N 1 0 299.370 3.841 20 10 CHCDRO CCc1cccc(C[N@@H+]2CCSC[C@H]2C2CCC2)c1O ZINC001182463708 1122166692 /nfs/dbraw/zinc/16/66/92/1122166692.db2.gz WLFXXMMBRJFECK-INIZCTEOSA-N 1 0 291.460 3.672 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H]2CCO[C@@H](CC(C)C)C2)cc1C ZINC000271994746 1122185732 /nfs/dbraw/zinc/18/57/32/1122185732.db2.gz MPMKADPRSJVDGU-SJORKVTESA-N 1 0 291.435 3.692 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H]2CCO[C@@H](CC(C)C)C2)cc1C ZINC000271994745 1122185950 /nfs/dbraw/zinc/18/59/50/1122185950.db2.gz MPMKADPRSJVDGU-IRXDYDNUSA-N 1 0 291.435 3.692 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(Br)cc(C)c1O)C1CC1 ZINC001182929924 1122198628 /nfs/dbraw/zinc/19/86/28/1122198628.db2.gz PMKXXHFWVOEVRB-ZDUSSCGKSA-N 1 0 298.224 3.741 20 10 CHCDRO CCc1cccc(C[N@@H+]2CCCC3(CC3)CC2)c1O ZINC001183155358 1122207370 /nfs/dbraw/zinc/20/73/70/1122207370.db2.gz FMZYXXLOYAQDIB-UHFFFAOYSA-N 1 0 259.393 3.721 20 10 CHCDRO Cc1cc(C[NH2+][C@H]2CCO[C@H]2C)c(C)n1-c1cccc(C)c1 ZINC001183268615 1122216171 /nfs/dbraw/zinc/21/61/71/1122216171.db2.gz HUMXOHJWYVCFGV-LPHOPBHVSA-N 1 0 298.430 3.670 20 10 CHCDRO Cc1ccc(C[NH+]2CC([C@H]3CCC[C@H](C)C3)C2)c(O)c1 ZINC001183441910 1122224058 /nfs/dbraw/zinc/22/40/58/1122224058.db2.gz BDDMGHRZCZOZPG-ZFWWWQNUSA-N 1 0 273.420 3.959 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)cn1 ZINC000273369803 1122230766 /nfs/dbraw/zinc/23/07/66/1122230766.db2.gz FTJVDDBTJMYUEN-AWEZNQCLSA-N 1 0 270.376 3.563 20 10 CHCDRO C=C/C=C/CC[NH2+]Cc1ccc2ccccc2c1O ZINC001183581317 1122230786 /nfs/dbraw/zinc/23/07/86/1122230786.db2.gz FUMXXTFCIKSEDD-ONEGZZNKSA-N 1 0 253.345 3.767 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccsc2)c(O)c1C ZINC000273400946 1122231825 /nfs/dbraw/zinc/23/18/25/1122231825.db2.gz NDCAYVHBPFAXOR-GFCCVEGCSA-N 1 0 261.390 3.921 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCO[C@H](C(C)C)C2)c1 ZINC000273491806 1122235984 /nfs/dbraw/zinc/23/59/84/1122235984.db2.gz OKDBLFJBAMCUFA-VBQJREDUSA-N 1 0 277.408 3.555 20 10 CHCDRO C[C@@H]([NH2+]C1(c2ccccc2)CC1)c1cc(F)ccc1O ZINC000273535739 1122237149 /nfs/dbraw/zinc/23/71/49/1122237149.db2.gz XGEOOKHBWVOHOL-GFCCVEGCSA-N 1 0 271.335 3.871 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCOC3(CCC3)C2)c(O)c1C ZINC000273530913 1122237953 /nfs/dbraw/zinc/23/79/53/1122237953.db2.gz WHTCGCOJVGYZHA-CABCVRRESA-N 1 0 289.419 3.761 20 10 CHCDRO CC1(C)CO[C@H](CC[NH2+]Cc2ccc3ccccc3c2O)C1 ZINC001183789225 1122238807 /nfs/dbraw/zinc/23/88/07/1122238807.db2.gz SVCKTAZVLZRYPM-MRXNPFEDSA-N 1 0 299.414 3.840 20 10 CHCDRO CC[C@H]1CCC[C@H](C[NH2+]Cc2c([O-])cccc2F)C1 ZINC001183920349 1122247934 /nfs/dbraw/zinc/24/79/34/1122247934.db2.gz XBHPSYVFIZGSJW-STQMWFEESA-N 1 0 265.372 3.837 20 10 CHCDRO CC[C@H]([NH2+]CCN(C)c1ccccc1)c1ccccc1O ZINC000183327159 1129044839 /nfs/dbraw/zinc/04/48/39/1129044839.db2.gz VPNBGFGZCSDYAP-KRWDZBQOSA-N 1 0 284.403 3.569 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCC[C@@H](C)[C@@H](C)C2)c1O ZINC001203602259 1122303127 /nfs/dbraw/zinc/30/31/27/1122303127.db2.gz LSTGZLFKRPTXRI-KGLIPLIRSA-N 1 0 277.408 3.659 20 10 CHCDRO CCO[C@H](C[NH2+]Cc1ccc(OC)c(C)c1)c1ccccc1 ZINC000775029282 1122396235 /nfs/dbraw/zinc/39/62/35/1122396235.db2.gz ZPUCEODOLQWMMU-LJQANCHMSA-N 1 0 299.414 3.871 20 10 CHCDRO C[C@H](C[NH2+][C@@H](C)c1ccccc1O)N(C)c1ccccc1 ZINC000183419210 1129053532 /nfs/dbraw/zinc/05/35/32/1129053532.db2.gz DOZBMEWVSPJCRK-CABCVRRESA-N 1 0 284.403 3.568 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H]1CCO[C@H](C(C)C)C1 ZINC000775140236 1122439439 /nfs/dbraw/zinc/43/94/39/1122439439.db2.gz LGPXMZXNXAPMCH-MSOLQXFVSA-N 1 0 290.451 3.565 20 10 CHCDRO C[C@H](Cc1ccccc1F)[NH2+][C@H](C)c1ccccc1O ZINC000183438763 1129055284 /nfs/dbraw/zinc/05/52/84/1129055284.db2.gz JDIHTDPETNYSAQ-CHWSQXEVSA-N 1 0 273.351 3.813 20 10 CHCDRO COc1cc(CC[NH2+][C@H](C)c2ccccc2O)ccc1C ZINC000183527569 1129060834 /nfs/dbraw/zinc/06/08/34/1129060834.db2.gz IKSYXEKHGLDXGU-CQSZACIVSA-N 1 0 285.387 3.603 20 10 CHCDRO Cc1ccc(C[NH2+][C@H]2C[C@H](c3cccc(F)c3)C2)c(O)c1 ZINC001205540576 1122553743 /nfs/dbraw/zinc/55/37/43/1122553743.db2.gz IXLSKIXZZVIACI-JCNLHEQBSA-N 1 0 285.362 3.876 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc(C)ccc1O)c1ccccc1OC ZINC000071407548 1129062627 /nfs/dbraw/zinc/06/26/27/1129062627.db2.gz LYPZRIQHUPQJOS-MRXNPFEDSA-N 1 0 285.387 3.950 20 10 CHCDRO Cc1cc(N(Cc2ccc(N(C)C)cc2)C2CC2)cc[nH+]1 ZINC000775447952 1122589476 /nfs/dbraw/zinc/58/94/76/1122589476.db2.gz JEHLGVSURMNGHA-UHFFFAOYSA-N 1 0 281.403 3.625 20 10 CHCDRO CC([NH2+]Cc1cc(Cl)ccc1O)(C1CC1)C1CC1 ZINC000691861812 1129064737 /nfs/dbraw/zinc/06/47/37/1129064737.db2.gz OQOGRGGQZCPELW-UHFFFAOYSA-N 1 0 265.784 3.714 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccco1)c1cc(Cl)ccc1O ZINC000775483239 1122615684 /nfs/dbraw/zinc/61/56/84/1122615684.db2.gz QENWCZDFISZNBN-CQSZACIVSA-N 1 0 279.767 3.922 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)C1CC1)c1cc(Cl)ccc1O ZINC000775485392 1122616788 /nfs/dbraw/zinc/61/67/88/1122616788.db2.gz SPNNFWLIYVTGIG-TVQRCGJNSA-N 1 0 253.773 3.885 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(C)nc1)c1cc(Cl)ccc1O ZINC000775487604 1122618288 /nfs/dbraw/zinc/61/82/88/1122618288.db2.gz LLMZOMKGQWCUTG-OAHLLOKOSA-N 1 0 290.794 3.990 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1COc2ccccc2C1)c1ccccc1O ZINC000775487489 1122618632 /nfs/dbraw/zinc/61/86/32/1122618632.db2.gz CHYMYUQCQRVMGS-RHSMWYFYSA-N 1 0 297.398 3.684 20 10 CHCDRO CC[C@H]([NH2+]CC1CCC1)c1cc(Cl)ccc1O ZINC000775491172 1122619389 /nfs/dbraw/zinc/61/93/89/1122619389.db2.gz ZCLBQUKRGZXUSL-ZDUSSCGKSA-N 1 0 253.773 3.886 20 10 CHCDRO CC[C@@H]([NH2+]Cc1nccs1)c1cc(Cl)ccc1O ZINC000775494106 1122625075 /nfs/dbraw/zinc/62/50/75/1122625075.db2.gz YCSVTPJXQNXXTH-LLVKDONJSA-N 1 0 282.796 3.743 20 10 CHCDRO CCC[C@@](C)(O)C[NH2+][C@@H](CC)c1cc(Cl)ccc1O ZINC000775503243 1122628845 /nfs/dbraw/zinc/62/88/45/1122628845.db2.gz DVLSFPRBHVSDPN-DZGCQCFKSA-N 1 0 285.815 3.637 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)CCOC)c1cc(Cl)ccc1O ZINC000775501456 1122628957 /nfs/dbraw/zinc/62/89/57/1122628957.db2.gz QVRJOWNKZUAPET-GWCFXTLKSA-N 1 0 271.788 3.511 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccccc1O ZINC000775500900 1122629993 /nfs/dbraw/zinc/62/99/93/1122629993.db2.gz MEVMGYNDPFVXMK-MRXNPFEDSA-N 1 0 283.371 3.568 20 10 CHCDRO CC[C@@H]([NH2+]C1CCC(C)(O)CC1)c1cc(Cl)ccc1O ZINC000775512909 1122634313 /nfs/dbraw/zinc/63/43/13/1122634313.db2.gz SCOZMCYCJLEBIO-CXOJTPOUSA-N 1 0 297.826 3.780 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](C)c1ccncc1)c1ccccc1O ZINC000775512919 1122634943 /nfs/dbraw/zinc/63/49/43/1122634943.db2.gz SMQFKGPFSHXQFH-BBRMVZONSA-N 1 0 270.376 3.632 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)C[C@@H]1CCOC1)c1cc(Cl)ccc1O ZINC000775514446 1122635875 /nfs/dbraw/zinc/63/58/75/1122635875.db2.gz VYIXVVXBXNGFON-XUJVJEKNSA-N 1 0 297.826 3.901 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)C[C@H]1CCOC1)c1cc(Cl)ccc1O ZINC000775514447 1122635941 /nfs/dbraw/zinc/63/59/41/1122635941.db2.gz VYIXVVXBXNGFON-ZOWXZIJZSA-N 1 0 297.826 3.901 20 10 CHCDRO Cc1cc(C[N@H+]2CC[C@H](C)[C@@H](C)C2)ccc1N(C)C ZINC001192261696 1122636687 /nfs/dbraw/zinc/63/66/87/1122636687.db2.gz FYJMTLGRARWPNT-ZFWWWQNUSA-N 1 0 260.425 3.539 20 10 CHCDRO CC[C@H]([NH2+]CC(C)(C)CCCO)c1cc(Cl)ccc1O ZINC000775518678 1122637468 /nfs/dbraw/zinc/63/74/68/1122637468.db2.gz FYBPXSLTEVHDDL-AWEZNQCLSA-N 1 0 299.842 3.885 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccnc(SC)c1)c1ccccc1O ZINC000775519186 1122637713 /nfs/dbraw/zinc/63/77/13/1122637713.db2.gz JDVBDVDQFJPQHP-AWEZNQCLSA-N 1 0 288.416 3.750 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCO[C@H](C)C1)c1cc(Cl)ccc1O ZINC000775520200 1122638640 /nfs/dbraw/zinc/63/86/40/1122638640.db2.gz QPTMGIICLCGWGA-JMSVASOKSA-N 1 0 297.826 3.901 20 10 CHCDRO CC[C@H]([NH2+][C@@H](CO)CC(C)(C)C)c1cc(Cl)ccc1O ZINC000775522610 1122639593 /nfs/dbraw/zinc/63/95/93/1122639593.db2.gz VPWFPNUDJNTOBV-OCCSQVGLSA-N 1 0 299.842 3.883 20 10 CHCDRO CC[C@@H]1CC[N@H+](Cc2ccc(N(C)C)c(C)c2)[C@H]1C ZINC001193603176 1122704943 /nfs/dbraw/zinc/70/49/43/1122704943.db2.gz AOLPRNGGXBKFML-GOEBONIOSA-N 1 0 260.425 3.681 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1nc(C)cs1)c1ccccc1O ZINC000080274516 1129079944 /nfs/dbraw/zinc/07/99/44/1129079944.db2.gz KQAWFOGNMUGMMF-YPMHNXCESA-N 1 0 276.405 3.959 20 10 CHCDRO Cc1cc(C[N@H+]2C[C@H](C)[C@H]2C)ccc1N1CCCCC1 ZINC001194702082 1122789169 /nfs/dbraw/zinc/78/91/69/1122789169.db2.gz OTGQCBLHNGTCGM-JKSUJKDBSA-N 1 0 272.436 3.826 20 10 CHCDRO Cc1cc(C[N@H+]2C[C@H](C)[C@@H]2C)ccc1N1CCCCC1 ZINC001194702078 1122789610 /nfs/dbraw/zinc/78/96/10/1122789610.db2.gz OTGQCBLHNGTCGM-HOTGVXAUSA-N 1 0 272.436 3.826 20 10 CHCDRO Cc1csc([C@H](C)[NH2+][C@@H](C)c2cc(C)ccc2O)n1 ZINC000080270202 1129079753 /nfs/dbraw/zinc/07/97/53/1129079753.db2.gz DUMGTTJHONUXDT-RYUDHWBXSA-N 1 0 276.405 3.877 20 10 CHCDRO Cc1cccc(C[N@@H+]2CC[C@H]2c2ccccc2)c1O ZINC000775633288 1122837692 /nfs/dbraw/zinc/83/76/92/1122837692.db2.gz HQKQDDSJUDJYEW-INIZCTEOSA-N 1 0 253.345 3.648 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+]2CCCC[C@@H]2C)c1O ZINC000775639256 1122844580 /nfs/dbraw/zinc/84/45/80/1122844580.db2.gz RIQKRZJLUZXCID-NSHDSACASA-N 1 0 253.773 3.728 20 10 CHCDRO Cc1cccc(C[NH+]2CCC(c3ccc(O)cc3)CC2)c1O ZINC000775648820 1122861721 /nfs/dbraw/zinc/86/17/21/1122861721.db2.gz YPTAFJGLFUVBIY-UHFFFAOYSA-N 1 0 297.398 3.786 20 10 CHCDRO C[N@H+](Cc1ccccc1O)CC(C)(C)c1ccccc1 ZINC000775656513 1122867871 /nfs/dbraw/zinc/86/78/71/1122867871.db2.gz VSRCDPBLHMEUBV-UHFFFAOYSA-N 1 0 269.388 3.802 20 10 CHCDRO CC[N@H+](CCc1cccs1)Cc1cc(OC)ccc1O ZINC000775656803 1122871857 /nfs/dbraw/zinc/87/18/57/1122871857.db2.gz MWNUJJADOTVCCS-UHFFFAOYSA-N 1 0 291.416 3.527 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CC(C)(C)[C@@H]2c2ccccc2)c1 ZINC000775662347 1122875424 /nfs/dbraw/zinc/87/54/24/1122875424.db2.gz WJHGZBVENCJASB-SFHVURJKSA-N 1 0 297.398 3.984 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCC[C@H]2c2ccc(O)cc2)c1O ZINC000775661063 1122875859 /nfs/dbraw/zinc/87/58/59/1122875859.db2.gz ICPOPECHKCBYEK-KRWDZBQOSA-N 1 0 283.371 3.743 20 10 CHCDRO COc1ccc(O)c(C[N@H+](CC2CC2)C2CCCCC2)c1 ZINC000775674906 1122898704 /nfs/dbraw/zinc/89/87/04/1122898704.db2.gz ODWOGTDIBUWQCV-UHFFFAOYSA-N 1 0 289.419 3.946 20 10 CHCDRO CC[C@@H](C)[C@H](C)[N@H+](Cc1cc(OC)ccc1O)C1CC1 ZINC000775682507 1122902206 /nfs/dbraw/zinc/90/22/06/1122902206.db2.gz ZNJYCOGTWUHNEW-OLZOCXBDSA-N 1 0 277.408 3.800 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2C[C@@H](C)C[C@@H]2C)c1O ZINC000775716553 1122921161 /nfs/dbraw/zinc/92/11/61/1122921161.db2.gz XQOWBYHXVDIISE-ONGXEEELSA-N 1 0 253.773 3.584 20 10 CHCDRO CC[C@@H](Cc1ccccc1)[N@H+](C)Cc1cc(OC)ccc1O ZINC000775719624 1122924324 /nfs/dbraw/zinc/92/43/24/1122924324.db2.gz WJAYLAMPKOGXOK-KRWDZBQOSA-N 1 0 299.414 3.854 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCSC3(CCCCC3)C2)c1O ZINC000775724737 1122926007 /nfs/dbraw/zinc/92/60/07/1122926007.db2.gz HMYIZEMMJJZBMV-UHFFFAOYSA-N 1 0 291.460 3.952 20 10 CHCDRO CCN(CC)c1ccc(C[NH+]2CCC(C)(F)CC2)cc1 ZINC001203937391 1123033287 /nfs/dbraw/zinc/03/32/87/1123033287.db2.gz XYGKNRJQZZDKNJ-UHFFFAOYSA-N 1 0 278.415 3.857 20 10 CHCDRO C[C@H](c1ccccc1)[N@H+](CCF)Cc1ccccc1O ZINC000776004734 1123034693 /nfs/dbraw/zinc/03/46/93/1123034693.db2.gz WSZIBTXKOVQSTH-CQSZACIVSA-N 1 0 273.351 3.925 20 10 CHCDRO C[C@@H](CO)C[N@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000776002604 1123035058 /nfs/dbraw/zinc/03/50/58/1123035058.db2.gz GGWQZZKIGGHXHD-HZPDHXFCSA-N 1 0 299.414 3.584 20 10 CHCDRO CN(C)c1ccc(C[NH2+]Cc2ccc3[nH]ccc3c2)cc1F ZINC001199864429 1123043133 /nfs/dbraw/zinc/04/31/33/1123043133.db2.gz KRJKDAIIWBCUNQ-UHFFFAOYSA-N 1 0 297.377 3.663 20 10 CHCDRO CC1=CCC[C@H](C)[C@@H]1C[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC001199865680 1123045319 /nfs/dbraw/zinc/04/53/19/1123045319.db2.gz SXYSFGKKYMYNNG-GOEBONIOSA-N 1 0 290.426 3.974 20 10 CHCDRO Fc1c(Cl)cccc1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC001199934353 1123047797 /nfs/dbraw/zinc/04/77/97/1123047797.db2.gz UKCQTFDNSRJHRD-UHFFFAOYSA-N 1 0 291.753 3.704 20 10 CHCDRO COc1cc(C[NH2+]Cc2cccc(Cl)c2[O-])ccc1C ZINC000776076160 1123053433 /nfs/dbraw/zinc/05/34/33/1123053433.db2.gz KOWYHWNQXUTRKV-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO Cc1cccc(C[NH2+]CCc2c[nH]c3cc(F)ccc23)c1O ZINC000776150135 1123083462 /nfs/dbraw/zinc/08/34/62/1123083462.db2.gz LZIKTPZJZUWQKE-UHFFFAOYSA-N 1 0 298.361 3.653 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+][C@@H]1C[C@H]1Cc1ccccc1 ZINC000776177305 1123102372 /nfs/dbraw/zinc/10/23/72/1123102372.db2.gz MJXVLHXGUCSQCG-CZUORRHYSA-N 1 0 287.790 3.766 20 10 CHCDRO CC[N@H+](CCc1ccccc1)Cc1ccc(N(C)C)cc1 ZINC001201606145 1123130930 /nfs/dbraw/zinc/13/09/30/1123130930.db2.gz LWHLICPWFPWVNW-UHFFFAOYSA-N 1 0 282.431 3.817 20 10 CHCDRO Cc1cccc(C[NH2+][C@H]2CSc3ccccc32)c1O ZINC000776208088 1123148287 /nfs/dbraw/zinc/14/82/87/1123148287.db2.gz VSVRFGDLKPGXJF-AWEZNQCLSA-N 1 0 271.385 3.637 20 10 CHCDRO C[C@H](C[NH2+]Cc1ccc2c(c1)CCCO2)c1ccccc1 ZINC001201929352 1123157480 /nfs/dbraw/zinc/15/74/80/1123157480.db2.gz LUSRVDMGVNERFK-OAHLLOKOSA-N 1 0 281.399 3.905 20 10 CHCDRO C[C@@H]1CC[C@@H](C[NH2+]Cc2cc(F)c(N(C)C)cc2F)C1 ZINC001202251578 1123190155 /nfs/dbraw/zinc/19/01/55/1123190155.db2.gz SINODEPRDJGXRD-VXGBXAGGSA-N 1 0 282.378 3.557 20 10 CHCDRO CCc1cccc(C[NH2+]CC(C)(C)C(C)(F)F)c1O ZINC000696599131 1123223272 /nfs/dbraw/zinc/22/32/72/1123223272.db2.gz NASQOVRSQOETJO-UHFFFAOYSA-N 1 0 271.351 3.726 20 10 CHCDRO COc1cc(C[NH2+]Cc2ccoc2)c(O)c(C(C)(C)C)c1 ZINC000850069952 1123240140 /nfs/dbraw/zinc/24/01/40/1123240140.db2.gz FXVNWCDLPKZDTA-UHFFFAOYSA-N 1 0 289.375 3.581 20 10 CHCDRO Cc1cccc2[nH]c(C[NH2+]Cc3ccc4c(c3)CCO4)cc21 ZINC000850111056 1123243311 /nfs/dbraw/zinc/24/33/11/1123243311.db2.gz DGYSIUVGTANZMC-UHFFFAOYSA-N 1 0 292.382 3.701 20 10 CHCDRO CCOc1cccc(C[NH2+]Cc2cc(C)cc(C)c2)c1O ZINC000850366655 1123257269 /nfs/dbraw/zinc/25/72/69/1123257269.db2.gz HOPINJSYNMEEEN-UHFFFAOYSA-N 1 0 285.387 3.698 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]CC[C@@]2(C)CC2(F)F)cc1 ZINC000850380527 1123260544 /nfs/dbraw/zinc/26/05/44/1123260544.db2.gz IGRBPJHTVNKFLP-APHBUQMISA-N 1 0 294.389 3.791 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+][C@@H](C)C2CCC(F)CC2)c1 ZINC000850396382 1123263105 /nfs/dbraw/zinc/26/31/05/1123263105.db2.gz UXARCZPTNNHYPJ-OPFPJEHXSA-N 1 0 295.398 3.797 20 10 CHCDRO COC1CC(CC[NH2+][C@H](C)c2cc(Cl)ccc2O)C1 ZINC000850482778 1123273491 /nfs/dbraw/zinc/27/34/91/1123273491.db2.gz RELDNBLJGDGVPB-XSRFYTQQSA-N 1 0 283.799 3.511 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@H](C)c2ccccn2)cc1 ZINC000850482405 1123273679 /nfs/dbraw/zinc/27/36/79/1123273679.db2.gz OYCSIDPQPLJWLE-JKSUJKDBSA-N 1 0 297.446 3.992 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CCN(C(C)(C)C)C1)c1ccc(C)cc1O ZINC000850492207 1123273899 /nfs/dbraw/zinc/27/38/99/1123273899.db2.gz BQKLXRZMJRZHAS-GDBMZVCRSA-N 1 0 290.451 3.614 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+][C@H]2CCN(C(C)(C)C)C2)c(O)c1 ZINC000850492635 1123274611 /nfs/dbraw/zinc/27/46/11/1123274611.db2.gz FOBSZEIAABTOSJ-CABCVRRESA-N 1 0 290.451 3.532 20 10 CHCDRO C[C@H]([NH2+][C@H]1C=CCC1)c1cc(Br)ccc1O ZINC000850507207 1123276770 /nfs/dbraw/zinc/27/67/70/1123276770.db2.gz DOONKBVDHDCJHK-ONGXEEELSA-N 1 0 282.181 3.524 20 10 CHCDRO Cc1cc(Br)cc([C@@H](C)[NH2+][C@@H]2C=CCC2)c1O ZINC000850510678 1123277944 /nfs/dbraw/zinc/27/79/44/1123277944.db2.gz WEXZPLARJXEVSE-ZYHUDNBSSA-N 1 0 296.208 3.832 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CCc2ccc(C)c(C)c2)c1O ZINC000850522155 1123279708 /nfs/dbraw/zinc/27/97/08/1123279708.db2.gz FTGIIYZUDZFQRE-OAHLLOKOSA-N 1 0 299.414 3.911 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1COC2(CCC2)C1)c1cc(Cl)ccc1O ZINC000850523338 1123279719 /nfs/dbraw/zinc/27/97/19/1123279719.db2.gz GRWJSSJMLZZKPN-JSGCOSHPSA-N 1 0 295.810 3.798 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2C[C@@H](O)c3ccccc32)c(O)c1 ZINC000850524203 1123280941 /nfs/dbraw/zinc/28/09/41/1123280941.db2.gz ANMOGKFIWPTVQA-IAOVAPTHSA-N 1 0 297.398 3.838 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2C[C@H](O)c3ccccc32)c(O)c1 ZINC000850524208 1123281364 /nfs/dbraw/zinc/28/13/64/1123281364.db2.gz ANMOGKFIWPTVQA-XKQJLSEDSA-N 1 0 297.398 3.838 20 10 CHCDRO C[C@@H]([NH2+]CCCOC(C)(C)C)c1cc(Cl)ccc1O ZINC000850526945 1123281677 /nfs/dbraw/zinc/28/16/77/1123281677.db2.gz UBQVJZQBVBYWDX-LLVKDONJSA-N 1 0 285.815 3.901 20 10 CHCDRO C[C@H]([NH2+][C@H]1C[C@@H](O)c2ccccc21)c1ccc(N(C)C)cc1 ZINC000850527623 1123283249 /nfs/dbraw/zinc/28/32/49/1123283249.db2.gz AYPSYUFURNHUMF-FASAQXTFSA-N 1 0 296.414 3.582 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccoc1)c1cc(Cl)ccc1O ZINC000850531003 1123285299 /nfs/dbraw/zinc/28/52/99/1123285299.db2.gz GBIBCWHTNKNOAV-CQSZACIVSA-N 1 0 279.767 3.922 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCC(C)(C)F)cc1 ZINC000850532254 1123285425 /nfs/dbraw/zinc/28/54/25/1123285425.db2.gz RKXJWBSJGGUNKU-CYBMUJFWSA-N 1 0 266.404 3.932 20 10 CHCDRO C[C@H]([NH2+]CCC(C)(C)F)c1cc(Cl)ccc1O ZINC000850532601 1123286245 /nfs/dbraw/zinc/28/62/45/1123286245.db2.gz UVOMWFYLFFOSJM-VIFPVBQESA-N 1 0 259.752 3.834 20 10 CHCDRO C[C@@H]([NH2+]C[C@]1(C)CC1(F)F)c1cc2c(cc1O)CCCC2 ZINC000850536625 1123287241 /nfs/dbraw/zinc/28/72/41/1123287241.db2.gz MCSXFIKLQBGFPJ-BZNIZROVSA-N 1 0 295.373 3.967 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1C(C)(C)C1(F)F)c1cc(Cl)ccc1O ZINC000850551330 1123290153 /nfs/dbraw/zinc/29/01/53/1123290153.db2.gz GWKBBFGIHAMHIO-QPUJVOFHSA-N 1 0 289.753 3.988 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2C(C)(C)C2(F)F)c(O)c1C ZINC000850553648 1123290224 /nfs/dbraw/zinc/29/02/24/1123290224.db2.gz ZXVTWRPJMSVAST-AAEUAGOBSA-N 1 0 283.362 3.951 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)C1CCC(F)CC1)c1ccccc1O ZINC000850553988 1123290792 /nfs/dbraw/zinc/29/07/92/1123290792.db2.gz GBPFMNUOKWOELP-MRFVTOPCSA-N 1 0 265.372 3.960 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)C2CCC(F)CC2)c1 ZINC000850554378 1123290880 /nfs/dbraw/zinc/29/08/80/1123290880.db2.gz JHDARAQTTOUJGP-IWMBGFJWSA-N 1 0 295.398 3.968 20 10 CHCDRO CC[C@H]([NH2+]CCCc1ccco1)c1ccccc1O ZINC000850569421 1123294489 /nfs/dbraw/zinc/29/44/89/1123294489.db2.gz DAUJCEQZNYSXTH-HNNXBMFYSA-N 1 0 259.349 3.659 20 10 CHCDRO C=C/C=C\CC[NH2+]Cc1ccc(N(CC)CC)cc1 ZINC000713456044 1123295410 /nfs/dbraw/zinc/29/54/10/1123295410.db2.gz LBHVNOFMJAUDQD-FPLPWBNLSA-N 1 0 258.409 3.755 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@H]2CCOC2(C)C)cc1 ZINC000850571727 1123295687 /nfs/dbraw/zinc/29/56/87/1123295687.db2.gz VEBBUZBTHJPTRE-GDBMZVCRSA-N 1 0 290.451 3.608 20 10 CHCDRO C[C@H](O)[C@@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1ccccc1 ZINC000850585148 1123296493 /nfs/dbraw/zinc/29/64/93/1123296493.db2.gz VXACVHRXNBQBFJ-YZVOILCLSA-N 1 0 298.430 3.525 20 10 CHCDRO C[N@H+](Cc1ccccc1O)Cc1ccccc1Cl ZINC000109773262 1123326713 /nfs/dbraw/zinc/32/67/13/1123326713.db2.gz DGFJRKVJJZUEDX-UHFFFAOYSA-N 1 0 261.752 3.678 20 10 CHCDRO CCCC[N@H+](Cc1ccccc1O)[C@H]1CC[C@H](OC)C1 ZINC000852019037 1123393452 /nfs/dbraw/zinc/39/34/52/1123393452.db2.gz TUFNGHSRZSHVSR-HOTGVXAUSA-N 1 0 277.408 3.562 20 10 CHCDRO C[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(N(C)C)cc2)[C@H]1C ZINC000252113853 1123406878 /nfs/dbraw/zinc/40/68/78/1123406878.db2.gz IEZVUZMFJTVTHC-JKIFEVAISA-N 1 0 260.425 3.667 20 10 CHCDRO C[C@@H]1SCC[N@H+](C/C=C/c2ccc(N(C)C)cc2)[C@H]1C ZINC001204768500 1123419964 /nfs/dbraw/zinc/41/99/64/1123419964.db2.gz JTMQJDLPADYMKL-WHJWBVKISA-N 1 0 290.476 3.592 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CC2(O)CCC(C)CC2)c(O)c1 ZINC000853237613 1123429166 /nfs/dbraw/zinc/42/91/66/1123429166.db2.gz NLSXZBALVVURBU-KVIBHRHWSA-N 1 0 291.435 3.601 20 10 CHCDRO CC(C)(C)c1cc(O)c(O)c(C[N@@H+]2CCC[C@](C)(F)C2)c1 ZINC000840098890 1123460093 /nfs/dbraw/zinc/46/00/93/1123460093.db2.gz FJHANOXPUDDIBA-KRWDZBQOSA-N 1 0 295.398 3.719 20 10 CHCDRO CC[C@@H]1COCC[N@@H+]1Cc1cc(C)cc(C(C)(C)C)c1O ZINC000738084052 1123518064 /nfs/dbraw/zinc/51/80/64/1123518064.db2.gz JTGDMTKJTTWKLK-OAHLLOKOSA-N 1 0 291.435 3.609 20 10 CHCDRO Oc1c(C[N@@H+]2CC[C@@H]([C@H]3CCCO3)C2)ccc2ccccc21 ZINC000895848593 1123521319 /nfs/dbraw/zinc/52/13/19/1123521319.db2.gz SEKLUKUBRXQVRZ-CRAIPNDOSA-N 1 0 297.398 3.546 20 10 CHCDRO CN(C)c1ccc(C[NH2+]Cc2cc3ccccc3[nH]2)cc1F ZINC000113330881 1123521340 /nfs/dbraw/zinc/52/13/40/1123521340.db2.gz RXLRGFMJZHTGCY-UHFFFAOYSA-N 1 0 297.377 3.663 20 10 CHCDRO CSC1CCC(C[NH2+]Cc2ccc(C)cc2O)CC1 ZINC000896253635 1123565708 /nfs/dbraw/zinc/56/57/08/1123565708.db2.gz COCKNYMNBDGWFX-UHFFFAOYSA-N 1 0 279.449 3.712 20 10 CHCDRO CSC1CCC(C[NH2+]Cc2c(C)cccc2O)CC1 ZINC000896255591 1123566460 /nfs/dbraw/zinc/56/64/60/1123566460.db2.gz PURLGBRSBDWSRX-UHFFFAOYSA-N 1 0 279.449 3.712 20 10 CHCDRO CC[C@@H]([NH2+]CC[C@@H]1CCCOC1)c1ccc(N(C)C)cc1 ZINC000858446290 1123655341 /nfs/dbraw/zinc/65/53/41/1123655341.db2.gz WTUVQTYQJGDRIC-MAUKXSAKSA-N 1 0 290.451 3.610 20 10 CHCDRO CC[C@H]([NH2+][C@@H](CO)CCC(C)C)c1ccc(C)cc1O ZINC000858486633 1123657461 /nfs/dbraw/zinc/65/74/61/1123657461.db2.gz XSCFBRHRYDUKDG-ZBFHGGJFSA-N 1 0 279.424 3.538 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CO)CCC(C)C)c1ccc(C)cc1O ZINC000858486630 1123657504 /nfs/dbraw/zinc/65/75/04/1123657504.db2.gz XSCFBRHRYDUKDG-GDBMZVCRSA-N 1 0 279.424 3.538 20 10 CHCDRO CC[C@H]([NH2+][C@H](CO)CCC(C)C)c1ccc(C)cc1O ZINC000858486632 1123657638 /nfs/dbraw/zinc/65/76/38/1123657638.db2.gz XSCFBRHRYDUKDG-HOCLYGCPSA-N 1 0 279.424 3.538 20 10 CHCDRO Cc1ccc(C(C)(C)C[NH2+][C@H]2CCc3cccc(O)c32)nc1 ZINC000858487795 1123657697 /nfs/dbraw/zinc/65/76/97/1123657697.db2.gz IPCSARFWOPTALP-HNNXBMFYSA-N 1 0 296.414 3.650 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1ccns1)c1ccc(C)cc1O ZINC000858578292 1123664928 /nfs/dbraw/zinc/66/49/28/1123664928.db2.gz YEPHYHGAYADSFR-YPMHNXCESA-N 1 0 276.405 3.959 20 10 CHCDRO Cc1csc(C(C)(C)[NH2+]Cc2cc(Cl)ccc2O)n1 ZINC000116382818 1123674371 /nfs/dbraw/zinc/67/43/71/1123674371.db2.gz FQQDLIYMAXRLOF-UHFFFAOYSA-N 1 0 296.823 3.835 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCC(F)(F)C1)c1ccc(N(C)C)cc1 ZINC000281207783 1123687387 /nfs/dbraw/zinc/68/73/87/1123687387.db2.gz UBIGTTOLGCUXSO-QWHCGFSZSA-N 1 0 282.378 3.839 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C2Cc3ccccc3C2)c(O)c1 ZINC000184005898 1129145233 /nfs/dbraw/zinc/14/52/33/1129145233.db2.gz LEQIITBBBNKGMR-CYBMUJFWSA-N 1 0 267.372 3.519 20 10 CHCDRO CCOc1ccc(O)c(C[NH+]2C[C@@H](C)C(F)(F)[C@H](C)C2)c1 ZINC000862444038 1123810678 /nfs/dbraw/zinc/81/06/78/1123810678.db2.gz SLSZHPNOLXRHOO-VXGBXAGGSA-N 1 0 299.361 3.514 20 10 CHCDRO Cc1cc(O)c(C[NH+]2C[C@H](C)C(F)(F)[C@@H](C)C2)cc1C ZINC000862444495 1123811555 /nfs/dbraw/zinc/81/15/55/1123811555.db2.gz XGDYLZWKZDRFCD-STQMWFEESA-N 1 0 283.362 3.732 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000862473452 1123812357 /nfs/dbraw/zinc/81/23/57/1123812357.db2.gz RDWNTFMXLGVCIZ-MNOVXSKESA-N 1 0 283.824 3.516 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCCC(F)(F)CC1 ZINC000862467463 1123812783 /nfs/dbraw/zinc/81/27/83/1123812783.db2.gz WDJARTABODYCIO-UHFFFAOYSA-N 1 0 282.378 3.682 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccc2ccccc2c1O)c1ccn(C)n1 ZINC000840818792 1123828034 /nfs/dbraw/zinc/82/80/34/1123828034.db2.gz ZQLLANPEGMAJGC-QWHCGFSZSA-N 1 0 295.386 3.691 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@@H+]2C[C@@H](C)C(F)(F)[C@@H](C)C2)c1 ZINC000863274023 1123857129 /nfs/dbraw/zinc/85/71/29/1123857129.db2.gz GYNJFEUEYLVXCA-BETUJISGSA-N 1 0 283.362 3.732 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H]2CS[C@H](C)C2)cc1 ZINC000840855587 1123858632 /nfs/dbraw/zinc/85/86/32/1123858632.db2.gz MQYSWOWUGPGSLQ-VNHYZAJKSA-N 1 0 278.465 3.687 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+][C@@H]1CCc2ccccc2C1 ZINC000083551415 1129150642 /nfs/dbraw/zinc/15/06/42/1129150642.db2.gz PTQGOEVBKFMUSP-CQSZACIVSA-N 1 0 287.790 3.693 20 10 CHCDRO C[C@H]([NH2+]CC(C)(C)OCC1CC1)c1ccc(N(C)C)cc1 ZINC000840874287 1123877776 /nfs/dbraw/zinc/87/77/76/1123877776.db2.gz YQGDASHVXSRUCV-AWEZNQCLSA-N 1 0 290.451 3.608 20 10 CHCDRO CC[N@H+](Cc1ccccn1)Cc1c(O)ccc2ccccc21 ZINC000084481334 1129153462 /nfs/dbraw/zinc/15/34/62/1129153462.db2.gz BFDKCQYNYHEWPT-UHFFFAOYSA-N 1 0 292.382 3.963 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccc(C)o1)c1ccc(C)cc1O ZINC000794797837 1123950283 /nfs/dbraw/zinc/95/02/83/1123950283.db2.gz PXUVFRSFQANKBJ-MRXNPFEDSA-N 1 0 273.376 3.885 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](C)N1CCCCC1)c1ccc(C)cc1O ZINC000794798640 1123950810 /nfs/dbraw/zinc/95/08/10/1123950810.db2.gz XNKVGSIDHHKRGE-NVXWUHKLSA-N 1 0 290.451 3.616 20 10 CHCDRO CC[C@@H]([NH2+]CCCOCC(C)C)c1ccc(C)cc1O ZINC000794794002 1123951285 /nfs/dbraw/zinc/95/12/85/1123951285.db2.gz PAOWLDLICYGFIG-MRXNPFEDSA-N 1 0 279.424 3.804 20 10 CHCDRO CCCCOCC[NH2+][C@H](CC)c1ccc(C)cc1O ZINC000794803526 1123952306 /nfs/dbraw/zinc/95/23/06/1123952306.db2.gz JNZDPMZFIVSKST-OAHLLOKOSA-N 1 0 265.397 3.558 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](O)CC(C)(C)C)c1ccc(C)cc1O ZINC000794805587 1123954034 /nfs/dbraw/zinc/95/40/34/1123954034.db2.gz XTEHFXKUPWJUST-HIFRSBDPSA-N 1 0 279.424 3.538 20 10 CHCDRO CC[C@H]([NH2+]CC(C)(C)[C@H](O)C(C)C)c1ccc(C)cc1O ZINC000794816501 1123957984 /nfs/dbraw/zinc/95/79/84/1123957984.db2.gz NQLWQKSLRPYPTE-DOTOQJQBSA-N 1 0 293.451 3.784 20 10 CHCDRO COC1(C[NH2+][C@H](C)c2cc(F)ccc2O)CCC(C)CC1 ZINC000794836547 1123971654 /nfs/dbraw/zinc/97/16/54/1123971654.db2.gz UAHNAWPDOACYFL-UIORMTCPSA-N 1 0 295.398 3.777 20 10 CHCDRO Cc1ncc([C@@H](C)[NH2+][C@H](C)c2cc(F)ccc2O)s1 ZINC000866455467 1124068415 /nfs/dbraw/zinc/06/84/15/1124068415.db2.gz LUNYBMCKXYSGAN-RKDXNWHRSA-N 1 0 280.368 3.708 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(C)o1)c1ccc(C)cc1O ZINC000866479204 1124070958 /nfs/dbraw/zinc/07/09/58/1124070958.db2.gz RPYUAYPJCVLDII-HNNXBMFYSA-N 1 0 259.349 3.843 20 10 CHCDRO Cc1ccc(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)o1 ZINC000866479099 1124070980 /nfs/dbraw/zinc/07/09/80/1124070980.db2.gz PSMYDFVTNXTZJQ-ZANVPECISA-N 1 0 275.323 3.771 20 10 CHCDRO C[C@@H]([NH2+]CC1([C@H]2CCCCO2)CCC1)c1ccccc1O ZINC000866480625 1124071103 /nfs/dbraw/zinc/07/11/03/1124071103.db2.gz GNJYAKDBQHCUQL-RHSMWYFYSA-N 1 0 289.419 3.782 20 10 CHCDRO C[C@@H]([NH2+]CC1(O)CCCC1)c1ccc2ccccc2c1O ZINC000087015804 1129171767 /nfs/dbraw/zinc/17/17/67/1129171767.db2.gz WURMSLNZWMMHDI-CYBMUJFWSA-N 1 0 285.387 3.501 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@@H](C)c2cc3ccccc3o2)c1 ZINC000122074403 1124464639 /nfs/dbraw/zinc/46/46/39/1124464639.db2.gz PDUNECOICNXOGJ-LBPRGKRZSA-N 1 0 297.354 3.998 20 10 CHCDRO CC(C)CCC[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1 ZINC000122130259 1124470299 /nfs/dbraw/zinc/47/02/99/1124470299.db2.gz KGUCMADHNPCWHI-MRXNPFEDSA-N 1 0 290.451 3.610 20 10 CHCDRO C[C@H]1[C@@H](c2ccccc2)CC[N@@H+]1Cc1ccc(N)cc1 ZINC001120370824 1131274812 /nfs/dbraw/zinc/27/48/12/1131274812.db2.gz GOGFBAGOKGDEHO-KSSFIOAISA-N 1 0 266.388 3.647 20 10 CHCDRO COc1ccc(CC[NH2+][C@@H](C)c2ccc(N(C)C)cc2)cc1 ZINC000123727572 1124625443 /nfs/dbraw/zinc/62/54/43/1124625443.db2.gz CTDAUESDIPSDER-HNNXBMFYSA-N 1 0 298.430 3.655 20 10 CHCDRO CCC[N@H+](Cc1ccccc1O)Cc1ncccc1Cl ZINC000528391159 1124651247 /nfs/dbraw/zinc/65/12/47/1124651247.db2.gz DTNJGQUBQKVRAR-UHFFFAOYSA-N 1 0 290.794 3.853 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2C[C@H]3CCC[C@@H]3O2)c(O)c1C ZINC000872109331 1124686068 /nfs/dbraw/zinc/68/60/68/1124686068.db2.gz LMEUYRBBZIUGSL-IVSAIRAKSA-N 1 0 289.419 3.617 20 10 CHCDRO CC(C)OC1(C[NH2+][C@H](C)c2cc(F)ccc2O)CCC1 ZINC000872114945 1124686928 /nfs/dbraw/zinc/68/69/28/1124686928.db2.gz FGOJBEQQOOSILA-GFCCVEGCSA-N 1 0 281.371 3.530 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+]1CCC[C@@H](OC2CCC2)CC1 ZINC000872259636 1124699634 /nfs/dbraw/zinc/69/96/34/1124699634.db2.gz ZLCPRBVJJWNQQC-MRXNPFEDSA-N 1 0 289.419 3.624 20 10 CHCDRO CCCOc1ccc(C[NH2+]Cc2cccc(O)c2)cc1C ZINC000873036207 1124733712 /nfs/dbraw/zinc/73/37/12/1124733712.db2.gz PJODXOXJSVPHOT-UHFFFAOYSA-N 1 0 285.387 3.779 20 10 CHCDRO CCCOc1ccc(C[NH2+][C@@H](CO)c2ccccc2)cc1C ZINC000873051842 1124736568 /nfs/dbraw/zinc/73/65/68/1124736568.db2.gz IETPLCYUDOBJGA-SFHVURJKSA-N 1 0 299.414 3.607 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]CC[C@@H]1CNc3ccccc31)CC2 ZINC000873238271 1124754834 /nfs/dbraw/zinc/75/48/34/1124754834.db2.gz YWYXDRDEDIKEOW-PBHICJAKSA-N 1 0 294.398 3.569 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]CCc1ccc(F)cc1 ZINC000019904126 1124767005 /nfs/dbraw/zinc/76/70/05/1124767005.db2.gz LEPNBPPSOJSSIE-UHFFFAOYSA-N 1 0 279.742 3.517 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCc2ccccc2F)c(O)c1 ZINC000020088795 1124805667 /nfs/dbraw/zinc/80/56/67/1124805667.db2.gz SPJMPBMDTWKRNC-CYBMUJFWSA-N 1 0 273.351 3.733 20 10 CHCDRO CCOc1cccc(C[NH2+]CCCc2ccccc2)c1O ZINC000020122719 1124806625 /nfs/dbraw/zinc/80/66/25/1124806625.db2.gz NKZKLJDAEMDVMT-UHFFFAOYSA-N 1 0 285.387 3.513 20 10 CHCDRO CCC(CC)[C@H](C[NH2+][C@@H](CC)c1ccccc1O)N(C)C ZINC000021036363 1124892055 /nfs/dbraw/zinc/89/20/55/1124892055.db2.gz WHNCVMAIPKREHR-IRXDYDNUSA-N 1 0 292.467 3.799 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(C)cc1O)c1ccccc1OC ZINC000876927957 1124991115 /nfs/dbraw/zinc/99/11/15/1124991115.db2.gz POFAQZJVMOORSJ-INIZCTEOSA-N 1 0 285.387 3.950 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(C)cc1O)c1nc(C)cs1 ZINC000877025515 1125000057 /nfs/dbraw/zinc/00/00/57/1125000057.db2.gz MTSWGHOKPBJINF-CYBMUJFWSA-N 1 0 276.405 3.706 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]Cc1ccccc1OCC1CC1 ZINC000877052541 1125003638 /nfs/dbraw/zinc/00/36/38/1125003638.db2.gz SWITUIKEIMAWRW-UHFFFAOYSA-N 1 0 297.398 3.779 20 10 CHCDRO COc1ccc([C@H](C)[NH2+]Cc2c(C)cccc2O)cc1F ZINC000877077116 1125006955 /nfs/dbraw/zinc/00/69/55/1125006955.db2.gz XRPQWBAAGIMBJJ-LBPRGKRZSA-N 1 0 289.350 3.699 20 10 CHCDRO CC(C)c1csc(C[NH2+]Cc2ccc(F)c(F)c2[O-])n1 ZINC000877107280 1125009508 /nfs/dbraw/zinc/00/95/08/1125009508.db2.gz BNLWWWSRSZQNIX-UHFFFAOYSA-N 1 0 298.358 3.540 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC(F)(F)[C@H](C)C2)cc1Cl ZINC000825943687 1125016903 /nfs/dbraw/zinc/01/69/03/1125016903.db2.gz ICNAORPGZAGYCI-SNVBAGLBSA-N 1 0 289.753 3.831 20 10 CHCDRO Cc1cccc(O)c1C[NH2+][C@@H]1CCO[C@@H](c2ccccc2)C1 ZINC000877376543 1125024404 /nfs/dbraw/zinc/02/44/04/1125024404.db2.gz JLMJIBWXKHVIMQ-VQIMIIECSA-N 1 0 297.398 3.711 20 10 CHCDRO Cc1nc([C@H]2CCC[N@@H+]2Cc2c(C)cccc2O)cs1 ZINC000877409197 1125026978 /nfs/dbraw/zinc/02/69/78/1125026978.db2.gz ZDTHFHSWUWIOIN-OAHLLOKOSA-N 1 0 288.416 3.803 20 10 CHCDRO COc1cccc(C[NH2+][C@@H](C)[C@@H]2C[C@H]2c2ccccc2)c1O ZINC000877525983 1125038991 /nfs/dbraw/zinc/03/89/91/1125038991.db2.gz NNTBXQATAYOMPV-JQFCIGGWSA-N 1 0 297.398 3.683 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+]1CC(C)(C)[C@@H]1c1ccncc1 ZINC000877548693 1125042886 /nfs/dbraw/zinc/04/28/86/1125042886.db2.gz RIUVIMCIOMSHFK-KRWDZBQOSA-N 1 0 282.387 3.679 20 10 CHCDRO Cc1ccc(C[N@@H+](Cc2c(C)cccc2O)CC2CC2)cn1 ZINC000877605630 1125051509 /nfs/dbraw/zinc/05/15/09/1125051509.db2.gz UNBQITPKTHVYDW-UHFFFAOYSA-N 1 0 296.414 3.816 20 10 CHCDRO CO[C@H](c1ccccc1)[C@H](C)[NH2+]Cc1cc(C)ccc1O ZINC000877652328 1125057856 /nfs/dbraw/zinc/05/78/56/1125057856.db2.gz GLCMQPHYJMOYFA-KSSFIOAISA-N 1 0 285.387 3.566 20 10 CHCDRO CCO[P@@](C)(=O)CC[C@@H](C)[NH2+]Cc1cc(C)ccc1O ZINC000877652774 1125058498 /nfs/dbraw/zinc/05/84/98/1125058498.db2.gz NSZHHIUXAPXQMZ-ZUOKHONESA-N 1 0 299.351 3.513 20 10 CHCDRO Oc1cccc2c1C[N@H+](C[C@H]1C[C@H]1c1ccccc1)C2 ZINC000877702919 1125066638 /nfs/dbraw/zinc/06/66/38/1125066638.db2.gz JZXKFAAQDQFZOF-CVEARBPZSA-N 1 0 265.356 3.512 20 10 CHCDRO C[C@@H]([NH2+]Cc1scnc1C1CC1)c1ccccc1O ZINC000877755417 1125072317 /nfs/dbraw/zinc/07/23/17/1125072317.db2.gz AJLDYQCNPOHARR-SNVBAGLBSA-N 1 0 274.389 3.577 20 10 CHCDRO Cc1cccc(C[NH2+][C@H](C)c2ccccc2O)c1C ZINC000877756359 1125072537 /nfs/dbraw/zinc/07/25/37/1125072537.db2.gz IILBCEIPBFBBOT-CQSZACIVSA-N 1 0 255.361 3.860 20 10 CHCDRO CCOc1cc(F)cc(C[NH2+][C@H](C)c2ccccc2O)c1 ZINC000877756861 1125074700 /nfs/dbraw/zinc/07/47/00/1125074700.db2.gz BFQJRACPDINWSM-GFCCVEGCSA-N 1 0 289.350 3.781 20 10 CHCDRO CCc1cccc(C[NH2+][C@H](C)c2cc3cnccc3o2)c1O ZINC000877768359 1125078020 /nfs/dbraw/zinc/07/80/20/1125078020.db2.gz PMILOVPGFJSWRM-GFCCVEGCSA-N 1 0 296.370 3.947 20 10 CHCDRO COCC(C)(C)CC[NH2+]Cc1ccc2ccccc2c1O ZINC000877805670 1125079740 /nfs/dbraw/zinc/07/97/40/1125079740.db2.gz PJIKXYGJKLYNKK-UHFFFAOYSA-N 1 0 287.403 3.698 20 10 CHCDRO CC(C)(O)[C@@H]1CCC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC000877795430 1125081351 /nfs/dbraw/zinc/08/13/51/1125081351.db2.gz KPERXHWFRBECDX-MRXNPFEDSA-N 1 0 299.414 3.528 20 10 CHCDRO CCc1noc(C)c1C[NH2+]Cc1cc(Cl)c(C)cc1O ZINC000826012356 1125113583 /nfs/dbraw/zinc/11/35/83/1125113583.db2.gz NFCNPWZJYDSAMC-UHFFFAOYSA-N 1 0 294.782 3.503 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)c2ccccc2O)nc1Cl ZINC000879650177 1125223680 /nfs/dbraw/zinc/22/36/80/1125223680.db2.gz NDHGPXVLXSGCOB-NSHDSACASA-N 1 0 276.767 3.600 20 10 CHCDRO CO[C@@](C)([C@H](C)[NH2+]Cc1cc(Cl)c(C)cc1O)C1CC1 ZINC000826120898 1125225386 /nfs/dbraw/zinc/22/53/86/1125225386.db2.gz LAHXFNZIENBLQA-ZBEGNZNMSA-N 1 0 297.826 3.647 20 10 CHCDRO Cc1csc(C[N@@H+](C)Cc2ccc(N(C)C)cc2)c1 ZINC001137160458 1125291968 /nfs/dbraw/zinc/29/19/68/1125291968.db2.gz ZLJCPNDBCNGCGU-UHFFFAOYSA-N 1 0 274.433 3.755 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H](C)c2ccc3c(c2)CCO3)cc1C ZINC000897419588 1125325606 /nfs/dbraw/zinc/32/56/06/1125325606.db2.gz MZWHFRDNVXWVSS-CQSZACIVSA-N 1 0 297.398 3.795 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C2CCC(OC(C)C)CC2)cc1C ZINC000130081019 1125356501 /nfs/dbraw/zinc/35/65/01/1125356501.db2.gz QBLCDIOLEUPCBC-UHFFFAOYSA-N 1 0 291.435 3.835 20 10 CHCDRO CCOc1ccc(C[NH2+]CC(C)(C)CC(F)F)c(O)c1 ZINC000883252037 1125385224 /nfs/dbraw/zinc/38/52/24/1125385224.db2.gz ONKPFECCACYCQA-UHFFFAOYSA-N 1 0 287.350 3.562 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CC2(CC3CC3)CC2)c1O ZINC000883254200 1125385228 /nfs/dbraw/zinc/38/52/28/1125385228.db2.gz MKVRBPLMDGCDBD-GFCCVEGCSA-N 1 0 275.392 3.632 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CC(C)(C)CC(F)F)c1O ZINC000883260310 1125387198 /nfs/dbraw/zinc/38/71/98/1125387198.db2.gz QEBFHPJVALPWER-SNVBAGLBSA-N 1 0 287.350 3.733 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]CC[C@@H]1CCCC1(F)F)CC2 ZINC000883274704 1125390737 /nfs/dbraw/zinc/39/07/37/1125390737.db2.gz RYQUPEPIWQVJBW-QWHCGFSZSA-N 1 0 281.346 3.795 20 10 CHCDRO CO[C@H](C[NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1ccccc1 ZINC000131428861 1125391387 /nfs/dbraw/zinc/39/13/87/1125391387.db2.gz MJCZRAPEGVJQPD-HNAYVOBHSA-N 1 0 298.430 3.791 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CC)c1ccc(C)cc1O)[C@H]1CCCOC1 ZINC000883353280 1125400402 /nfs/dbraw/zinc/40/04/02/1125400402.db2.gz RNIGAGAPSNQZEG-UAGQMJEPSA-N 1 0 291.435 3.947 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCC2(CCC2)O1)c1ccc(Cl)cc1O ZINC000883357469 1125401224 /nfs/dbraw/zinc/40/12/24/1125401224.db2.gz LYMJEQPSAJQNRW-YPMHNXCESA-N 1 0 295.810 3.798 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2c(C)cccc2C)c1 ZINC000132152859 1125414819 /nfs/dbraw/zinc/41/48/19/1125414819.db2.gz HAANKDGCBVWOED-UHFFFAOYSA-N 1 0 255.361 3.607 20 10 CHCDRO CCSCC[C@H](C)[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000132242106 1125416200 /nfs/dbraw/zinc/41/62/00/1125416200.db2.gz SPYVYFGMLXAJML-UONOGXRCSA-N 1 0 280.481 3.935 20 10 CHCDRO CC[C@@H]([NH2+]Cc1scnc1C)c1ccc(N(C)C)cc1 ZINC000132427540 1125418151 /nfs/dbraw/zinc/41/81/51/1125418151.db2.gz JDTPNTQNUUCBBC-OAHLLOKOSA-N 1 0 289.448 3.758 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCCSC)cc1 ZINC000132465599 1125418397 /nfs/dbraw/zinc/41/83/97/1125418397.db2.gz IVGHHLVYMJNZNO-CYBMUJFWSA-N 1 0 266.454 3.546 20 10 CHCDRO Cc1cc(C)c(C[NH2+][C@H]2CCc3cccc(F)c3C2)c(O)c1 ZINC001170972746 1131354369 /nfs/dbraw/zinc/35/43/69/1131354369.db2.gz QXWPFSKSCCJCQT-HNNXBMFYSA-N 1 0 299.389 3.795 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCS[C@H]3CCCC[C@H]32)c1O ZINC000245638991 1129215589 /nfs/dbraw/zinc/21/55/89/1129215589.db2.gz CXDJOSOZUFFGEP-CABCVRRESA-N 1 0 277.433 3.561 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]Cc1ccc(Cl)cc1)CC2 ZINC000295829080 1129219847 /nfs/dbraw/zinc/21/98/47/1129219847.db2.gz DWCXKQCCKUSZHF-CQSZACIVSA-N 1 0 273.763 3.823 20 10 CHCDRO Cc1cccc(C[N@H+]2C[C@@H](C)O[C@@H](c3ccccc3)C2)c1O ZINC000245871435 1129230473 /nfs/dbraw/zinc/23/04/73/1129230473.db2.gz RQYPLEIQMWUURB-CRAIPNDOSA-N 1 0 297.398 3.663 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]CC2(c3ccccc3)CC2)c1 ZINC000184957547 1129265727 /nfs/dbraw/zinc/26/57/27/1129265727.db2.gz YYZRYURYALRFOG-CQSZACIVSA-N 1 0 297.398 3.783 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2ccccc2F)c1 ZINC000037764025 1129266916 /nfs/dbraw/zinc/26/69/16/1129266916.db2.gz AAZYFEFHCYGLKS-VXGBXAGGSA-N 1 0 289.350 3.952 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CC)c1ccc(N(C)C)cc1)[C@H]1CCCO1 ZINC000246289422 1129267402 /nfs/dbraw/zinc/26/74/02/1129267402.db2.gz CCZJSDJPHXIYKG-RCCFBDPRSA-N 1 0 290.451 3.751 20 10 CHCDRO Oc1ccccc1C[N@H+](CCc1cccnc1)C1CCCC1 ZINC000734149814 1129296494 /nfs/dbraw/zinc/29/64/94/1129296494.db2.gz SWEBXCUIPPXHBG-UHFFFAOYSA-N 1 0 296.414 3.775 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]C/C=C\c1ccccc1 ZINC000734510164 1129310913 /nfs/dbraw/zinc/31/09/13/1129310913.db2.gz RYUVGQYCWCZMGD-YFHOEESVSA-N 1 0 280.415 3.864 20 10 CHCDRO COc1ccc(C[NH2+][C@H]2CSc3ccccc32)cc1C ZINC000735509125 1129348648 /nfs/dbraw/zinc/34/86/48/1129348648.db2.gz VHMCWXYNHYVQCX-HNNXBMFYSA-N 1 0 285.412 3.940 20 10 CHCDRO CC(C)(C[NH2+]Cc1ccc2c(c1)CCO2)c1cccc(F)c1 ZINC000735678764 1129356373 /nfs/dbraw/zinc/35/63/73/1129356373.db2.gz YYWSQVPPWLHPMI-UHFFFAOYSA-N 1 0 299.389 3.828 20 10 CHCDRO C[N@H+](Cc1ccc(Cl)c(F)c1)Cc1ccccc1O ZINC000091974686 1129376487 /nfs/dbraw/zinc/37/64/87/1129376487.db2.gz HJMQYROXQWGUDI-UHFFFAOYSA-N 1 0 279.742 3.817 20 10 CHCDRO C[C@@H]1CCCCC[N@@H+]1Cc1c(O)ccc2ccncc21 ZINC000738221146 1129390516 /nfs/dbraw/zinc/39/05/16/1129390516.db2.gz CDYZYDKNRGLPGN-CYBMUJFWSA-N 1 0 270.376 3.705 20 10 CHCDRO COc1ccc(C[N@H+](C)Cc2cc(C)ccc2O)cc1C ZINC000092787134 1129407533 /nfs/dbraw/zinc/40/75/33/1129407533.db2.gz SZULSDSPAXVUHO-UHFFFAOYSA-N 1 0 285.387 3.650 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]Cc2ccoc2C)cc1F ZINC000740003974 1129409058 /nfs/dbraw/zinc/40/90/58/1129409058.db2.gz GLRIMJCUMVJVHZ-UHFFFAOYSA-N 1 0 290.382 3.863 20 10 CHCDRO CC[N@H+](CCc1nccs1)Cc1cc(Cl)ccc1O ZINC000093764536 1129427854 /nfs/dbraw/zinc/42/78/54/1129427854.db2.gz BVRWRATUEGJBEP-UHFFFAOYSA-N 1 0 296.823 3.567 20 10 CHCDRO C[C@@H](CCc1ccco1)[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000094616933 1129448615 /nfs/dbraw/zinc/44/86/15/1129448615.db2.gz LAPWQKLJMSSDPI-RYUDHWBXSA-N 1 0 277.339 3.796 20 10 CHCDRO CCN(C)c1ccc(C[N@H+](C)Cc2cccc(OC)c2)cc1 ZINC000741753106 1129451094 /nfs/dbraw/zinc/45/10/94/1129451094.db2.gz NIMPAOGTVMKMBM-UHFFFAOYSA-N 1 0 298.430 3.783 20 10 CHCDRO CCSCC[N@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000741807236 1129453913 /nfs/dbraw/zinc/45/39/13/1129453913.db2.gz XQFDVHOCHCUDJT-UHFFFAOYSA-N 1 0 280.481 3.716 20 10 CHCDRO C[C@]1(c2ccc(F)cc2)CC[N@H+](Cc2ccccc2O)C1 ZINC000796048052 1129465164 /nfs/dbraw/zinc/46/51/64/1129465164.db2.gz VQFDGAYZDHHQFM-SFHVURJKSA-N 1 0 285.362 3.695 20 10 CHCDRO COc1ccc2ccc(O)c(C[N@H+]3C[C@@H]4[C@H](C3)C4(C)C)c2c1 ZINC000742166384 1129468613 /nfs/dbraw/zinc/46/86/13/1129468613.db2.gz MMBXONCPOFOWBZ-CALCHBBNSA-N 1 0 297.398 3.642 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H]2CSc3ccccc32)cc1C ZINC000742371808 1129475394 /nfs/dbraw/zinc/47/53/94/1129475394.db2.gz FABOYFVIKUHSIB-HNNXBMFYSA-N 1 0 285.412 3.946 20 10 CHCDRO CC[C@H](C)C[C@H](C)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000742379881 1129476084 /nfs/dbraw/zinc/47/60/84/1129476084.db2.gz CDBHMAHYCYLTFI-STQMWFEESA-N 1 0 266.404 3.806 20 10 CHCDRO CC[N@H+](Cc1cc(C)cc(F)c1)Cc1ccccc1O ZINC001143619612 1129482642 /nfs/dbraw/zinc/48/26/42/1129482642.db2.gz WKJUJDRZIYUDIC-UHFFFAOYSA-N 1 0 273.351 3.862 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)COc2ccccc2)cc1C ZINC000742724191 1129497029 /nfs/dbraw/zinc/49/70/29/1129497029.db2.gz PWZCPRGBFUWKAJ-OAHLLOKOSA-N 1 0 285.387 3.561 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CCC[C@H](C)[C@H]2C)cc1C ZINC000250881796 1129501449 /nfs/dbraw/zinc/50/14/49/1129501449.db2.gz VBMMRQLUASPYOH-JGGQBBKZSA-N 1 0 261.409 3.918 20 10 CHCDRO CC(C)(C)c1cc(O)c(O)c(C[N@@H+]2CCC(C)(C)C2)c1 ZINC000743390564 1129521977 /nfs/dbraw/zinc/52/19/77/1129521977.db2.gz GBAHBXOTJSZJRU-UHFFFAOYSA-N 1 0 277.408 3.627 20 10 CHCDRO CSCCC[N@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000743841456 1129537698 /nfs/dbraw/zinc/53/76/98/1129537698.db2.gz MZXGLTHESYXOMK-UHFFFAOYSA-N 1 0 280.481 3.716 20 10 CHCDRO CC[C@H](C[C@@H](C)CO)[NH2+][C@H](CC)c1ccc(N(C)C)cc1 ZINC000766360155 1129658799 /nfs/dbraw/zinc/65/87/99/1129658799.db2.gz JARQZCPJJWGHTJ-QGPMSJSTSA-N 1 0 292.467 3.590 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1ccc(N(C)C)cc1)C1CCOCC1 ZINC000766387786 1129663624 /nfs/dbraw/zinc/66/36/24/1129663624.db2.gz HZSYELASHQEISW-KDOFPFPSSA-N 1 0 290.451 3.608 20 10 CHCDRO COc1cccc(O)c1C[NH2+]CCC1=CCCCCC1 ZINC000766467199 1129669301 /nfs/dbraw/zinc/66/93/01/1129669301.db2.gz GFKGADWUIVQGKT-UHFFFAOYSA-N 1 0 275.392 3.771 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1C[C@@H](OC)C1(C)C)c1ccc(N(C)C)cc1 ZINC000766529444 1129684208 /nfs/dbraw/zinc/68/42/08/1129684208.db2.gz PVWVQYDPWGEOKR-GVDBMIGSSA-N 1 0 290.451 3.607 20 10 CHCDRO C[C@@H]([NH2+]CC1(C)CC(F)(F)C1)c1ccc(N(C)C)cc1 ZINC000720898510 1129718119 /nfs/dbraw/zinc/71/81/19/1129718119.db2.gz AFZBEWXQVSWLMB-GFCCVEGCSA-N 1 0 282.378 3.839 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C(C)(C)c2ccc(F)cc2)cc1 ZINC000103173348 1129719159 /nfs/dbraw/zinc/71/91/59/1129719159.db2.gz AZUORBSCXSOGBX-UHFFFAOYSA-N 1 0 286.394 3.917 20 10 CHCDRO C[C@H]1SCC[C@H]1[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000380317770 1129728484 /nfs/dbraw/zinc/72/84/84/1129728484.db2.gz MUZAAWIRWFSXJD-RHSMWYFYSA-N 1 0 290.476 3.661 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)Cc1cccc(C)c1F ZINC001137678581 1131399060 /nfs/dbraw/zinc/39/90/60/1131399060.db2.gz ORSGQEOZHAXNCC-UHFFFAOYSA-N 1 0 273.351 3.862 20 10 CHCDRO CCC[C@H](C)[C@H]1CCC[N@@H+]1Cc1cc2c(cc1O)OCO2 ZINC000767763300 1129812953 /nfs/dbraw/zinc/81/29/53/1129812953.db2.gz LKDVNYCTUQFQIN-GXTWGEPZSA-N 1 0 291.391 3.522 20 10 CHCDRO CCc1ccc(C[N@H+](C)Cc2c(O)cccc2OC)cc1 ZINC000768162764 1129838389 /nfs/dbraw/zinc/83/83/89/1129838389.db2.gz IBFQEFNMXFVCNU-UHFFFAOYSA-N 1 0 285.387 3.595 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)Cc2cccnc2C)cc1 ZINC000768208150 1129840300 /nfs/dbraw/zinc/84/03/00/1129840300.db2.gz ODIFRDRFGJLFSV-UHFFFAOYSA-N 1 0 297.446 3.868 20 10 CHCDRO CN(C)c1ccc(C[N@H+](Cc2ccc(O)cc2)C2CC2)cc1 ZINC000768258192 1129847285 /nfs/dbraw/zinc/84/72/85/1129847285.db2.gz SVFIVXWJGWKUGI-UHFFFAOYSA-N 1 0 296.414 3.623 20 10 CHCDRO CO[C@H](C[NH2+][C@H](C)c1ccc2ccccc2c1O)C(C)C ZINC000381772512 1129849772 /nfs/dbraw/zinc/84/97/72/1129849772.db2.gz JSJFABCDZQQAGY-CXAGYDPISA-N 1 0 287.403 3.867 20 10 CHCDRO C[C@@H](Cc1ccsc1)[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000382062169 1129854780 /nfs/dbraw/zinc/85/47/80/1129854780.db2.gz YGSKIYYXGBJKMU-SMDDNHRTSA-N 1 0 273.401 3.662 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)[C@H]2CC3CCC2CC3)c(O)c1 ZINC000382067726 1129854834 /nfs/dbraw/zinc/85/48/34/1129854834.db2.gz GVUSFELGDQJPSM-VBRUCIBASA-N 1 0 289.419 3.705 20 10 CHCDRO C[C@H](Cc1ccsc1)[NH2+][C@H]1CCc2cccc(O)c21 ZINC000382062166 1129854947 /nfs/dbraw/zinc/85/49/47/1129854947.db2.gz YGSKIYYXGBJKMU-RISCZKNCSA-N 1 0 273.401 3.662 20 10 CHCDRO CCC(CC)[N@H+](Cc1cc(OC)c(C)cc1O)C1CC1 ZINC000768441519 1129856809 /nfs/dbraw/zinc/85/68/09/1129856809.db2.gz DANWJFBDVZCFIU-UHFFFAOYSA-N 1 0 277.408 3.862 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)[C@@H](C)C2CC2)cc1 ZINC000768421640 1129856881 /nfs/dbraw/zinc/85/68/81/1129856881.db2.gz NHCCJGAIRPEGTC-AWEZNQCLSA-N 1 0 260.425 3.763 20 10 CHCDRO COc1cc(C[N@H+](C)C2CCC(C)CC2)c(O)cc1C ZINC000768439105 1129857013 /nfs/dbraw/zinc/85/70/13/1129857013.db2.gz HPQDRIVSWTUMAA-UHFFFAOYSA-N 1 0 277.408 3.720 20 10 CHCDRO COc1cc(C[N@@H+]2CCC[C@H]2CC(C)C)c(O)cc1C ZINC000768446667 1129857309 /nfs/dbraw/zinc/85/73/09/1129857309.db2.gz ZOHAFGQMLYJRDB-HNNXBMFYSA-N 1 0 277.408 3.720 20 10 CHCDRO COc1cc(C[N@@H+]2Cc3ccccc3[C@H]2C)c(O)cc1C ZINC000768465631 1129859488 /nfs/dbraw/zinc/85/94/88/1129859488.db2.gz JQMBQFNXQVEJOF-CYBMUJFWSA-N 1 0 283.371 3.786 20 10 CHCDRO FC1(F)CCC[C@H](C[NH2+]Cc2ccc3c(c2)CCO3)C1 ZINC000800278017 1129862360 /nfs/dbraw/zinc/86/23/60/1129862360.db2.gz YXEAPQXWOKWUPA-ZDUSSCGKSA-N 1 0 281.346 3.537 20 10 CHCDRO C[N@H+](Cc1ccccc1O)Cc1cncc2ccccc21 ZINC000768873535 1129878100 /nfs/dbraw/zinc/87/81/00/1129878100.db2.gz PJGXDHZZQCHEHJ-UHFFFAOYSA-N 1 0 278.355 3.572 20 10 CHCDRO CCSCCC[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000800492520 1129879057 /nfs/dbraw/zinc/87/90/57/1129879057.db2.gz KBWYKVULAHMKAB-ZDUSSCGKSA-N 1 0 267.438 3.803 20 10 CHCDRO Cc1cccc(C[NH2+]C[C@@H]2CCCC(F)(F)C2)c1O ZINC000800526576 1129882879 /nfs/dbraw/zinc/88/28/79/1129882879.db2.gz NALGWXMXPQEIAN-GFCCVEGCSA-N 1 0 269.335 3.616 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H]3CCC[C@@H]32)cc1 ZINC000769101753 1129889871 /nfs/dbraw/zinc/88/98/71/1129889871.db2.gz GDGFQFJFZKAEAN-RDJZCZTQSA-N 1 0 258.409 3.517 20 10 CHCDRO COc1cccc(C[N@@H+]2CCC[C@@H]2CC(C)(C)C)c1O ZINC000769164682 1129893236 /nfs/dbraw/zinc/89/32/36/1129893236.db2.gz KDKJBTWMFLMHOE-CQSZACIVSA-N 1 0 277.408 3.801 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H]2CC[C@@H]2C2CCC2)cc1F ZINC000800969647 1129900777 /nfs/dbraw/zinc/90/07/77/1129900777.db2.gz SSBIJHMTWIKVPA-ZBFHGGJFSA-N 1 0 276.399 3.560 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[NH2+][C@H]1CC[C@@H]1C1CCC1 ZINC000800967806 1129900799 /nfs/dbraw/zinc/90/07/99/1129900799.db2.gz RZEFBHMRMYWPGD-MOPGFXCFSA-N 1 0 284.447 3.955 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CCc2ccccc2OC1)c1ccccc1O ZINC000800987123 1129902921 /nfs/dbraw/zinc/90/29/21/1129902921.db2.gz QBNLTTZVCNTCEL-DOTOQJQBSA-N 1 0 297.398 3.827 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)Cc2cc3ccccc3[nH]2)cc1 ZINC000769484905 1129909850 /nfs/dbraw/zinc/90/98/50/1129909850.db2.gz ZMYWQJRQQKFTPV-UHFFFAOYSA-N 1 0 293.414 3.866 20 10 CHCDRO CC[C@H]1CCCCC[N@@H+]1Cc1c(O)cccc1OC ZINC000769456432 1129911955 /nfs/dbraw/zinc/91/19/55/1129911955.db2.gz JUYMAMRIFNPXCQ-ZDUSSCGKSA-N 1 0 263.381 3.555 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CCS[C@H]2CCCC[C@H]21 ZINC000769497430 1129914003 /nfs/dbraw/zinc/91/40/03/1129914003.db2.gz DOGRWRZGNSYTNB-HIFRSBDPSA-N 1 0 297.851 3.906 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CCS[C@H]2CCCC[C@@H]21 ZINC000769497895 1129914022 /nfs/dbraw/zinc/91/40/22/1129914022.db2.gz HBWDNDVRDNFYOZ-ZFWWWQNUSA-N 1 0 297.851 3.906 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CC[C@H]2Cc2ccccc2)c(O)c1 ZINC000769506168 1129914029 /nfs/dbraw/zinc/91/40/29/1129914029.db2.gz NIYWPBHKUWHWGZ-KRWDZBQOSA-N 1 0 297.398 3.608 20 10 CHCDRO CC(C)[C@@H]1C[N@H+](Cc2cc(Cl)ccc2O)CCS1 ZINC000769547219 1129916951 /nfs/dbraw/zinc/91/69/51/1129916951.db2.gz BPLANXWSTXNJHE-AWEZNQCLSA-N 1 0 285.840 3.619 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccccc1N(C)C ZINC000769686895 1129920203 /nfs/dbraw/zinc/92/02/03/1129920203.db2.gz KKTLOWHXGFVDSU-AWEZNQCLSA-N 1 0 296.414 3.538 20 10 CHCDRO CCCC[N@@H+](Cc1ccccc1O)C[C@@H]1CC[C@H](C)O1 ZINC000801594585 1129930795 /nfs/dbraw/zinc/93/07/95/1129930795.db2.gz GUKJFJLTGAGNIT-HOCLYGCPSA-N 1 0 277.408 3.562 20 10 CHCDRO CCCC[N@@H+](Cc1ccccc1O)C[C@H]1CCO[C@@H](C)C1 ZINC000801594987 1129931385 /nfs/dbraw/zinc/93/13/85/1129931385.db2.gz TVTPTSJYNJEVCU-HOTGVXAUSA-N 1 0 291.435 3.809 20 10 CHCDRO C[C@H]([N@H+](C)Cc1ccc(N(C)C)c(F)c1)C1(C)CC1 ZINC000770288239 1129943867 /nfs/dbraw/zinc/94/38/67/1129943867.db2.gz ICIWAIMEELLQOH-LBPRGKRZSA-N 1 0 264.388 3.512 20 10 CHCDRO C[C@@H]([N@H+](C)Cc1c(O)cccc1Cl)C1(C)CC1 ZINC000770288334 1129943920 /nfs/dbraw/zinc/94/39/20/1129943920.db2.gz IHMSFNQCBHQKBS-SNVBAGLBSA-N 1 0 253.773 3.666 20 10 CHCDRO CCCCC[C@@H]1CCC[N@@H+]1Cc1cccc(OC)c1O ZINC000770353288 1129945662 /nfs/dbraw/zinc/94/56/62/1129945662.db2.gz ZFIDMXFZTVZCMY-OAHLLOKOSA-N 1 0 277.408 3.946 20 10 CHCDRO CS[C@H]1CCCC[N@H+](Cc2ccc(N(C)C)c(F)c2)C1 ZINC000770348832 1129945960 /nfs/dbraw/zinc/94/59/60/1129945960.db2.gz LOCKKZMHRSPZBU-AWEZNQCLSA-N 1 0 296.455 3.609 20 10 CHCDRO C[C@H]1c2c(F)cccc2CC[N@H+]1Cc1ccccc1O ZINC000770509491 1129948960 /nfs/dbraw/zinc/94/89/60/1129948960.db2.gz AZDAJFLUMDAOOX-LBPRGKRZSA-N 1 0 271.335 3.651 20 10 CHCDRO CCc1cccc(C[NH2+]Cc2csc(C)c2C)c1O ZINC000691484795 1129974453 /nfs/dbraw/zinc/97/44/53/1129974453.db2.gz WNAPZLAYWLJBLZ-UHFFFAOYSA-N 1 0 275.417 3.923 20 10 CHCDRO CCC(CC)[C@@H](CC[NH2+]Cc1ccc(N(C)C)cc1)OC ZINC000746762078 1129981817 /nfs/dbraw/zinc/98/18/17/1129981817.db2.gz UTGFNONAAYAXHH-GOSISDBHSA-N 1 0 292.467 3.684 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC[C@H]2c2ccccc2)c1 ZINC000771939250 1129996876 /nfs/dbraw/zinc/99/68/76/1129996876.db2.gz ORMGQRYMUUBTBY-INIZCTEOSA-N 1 0 253.345 3.648 20 10 CHCDRO CCc1cccc(C[NH2+]Cc2cccc(C)c2)c1O ZINC000691505656 1130020872 /nfs/dbraw/zinc/02/08/72/1130020872.db2.gz MXBXQOICKPAOBE-UHFFFAOYSA-N 1 0 255.361 3.553 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CC[C@](F)(c2ccccc2)C1 ZINC000802657255 1130028061 /nfs/dbraw/zinc/02/80/61/1130028061.db2.gz XNYIVBKDJDPANW-QGZVFWFLSA-N 1 0 289.325 3.602 20 10 CHCDRO Cc1cccc(C[NH2+]CC2CC(c3ccccc3)C2)c1O ZINC000802659559 1130028395 /nfs/dbraw/zinc/02/83/95/1130028395.db2.gz KUTATNCSWZWCGV-UHFFFAOYSA-N 1 0 281.399 3.984 20 10 CHCDRO CC1=CCC[C@@H](C)[C@@H]1C[N@H+](C)Cc1ccccc1O ZINC000785978259 1130070638 /nfs/dbraw/zinc/07/06/38/1130070638.db2.gz SNTRQCPGVUVARL-GDBMZVCRSA-N 1 0 259.393 3.816 20 10 CHCDRO Cc1cccc(C[N@@H+]2CC3(CCCC3)OC(C)(C)C2)c1O ZINC000785987912 1130072897 /nfs/dbraw/zinc/07/28/97/1130072897.db2.gz JWAZECQKOLCPAY-UHFFFAOYSA-N 1 0 289.419 3.624 20 10 CHCDRO COc1ccc2c(c1)[nH+]ccc2N(C)Cc1ccccc1O ZINC000786796901 1130118205 /nfs/dbraw/zinc/11/82/05/1130118205.db2.gz LWRXJHYYVSNEKU-UHFFFAOYSA-N 1 0 294.354 3.585 20 10 CHCDRO CC(C)c1ccc(O)c(C[N@@H+]2CCOC(C)(C)[C@@H]2C)c1 ZINC001461960126 1130139562 /nfs/dbraw/zinc/13/95/62/1130139562.db2.gz OFDUVOAMXURAGW-ZDUSSCGKSA-N 1 0 277.408 3.515 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2cncs2)c(O)c1C ZINC000903309945 1130151079 /nfs/dbraw/zinc/15/10/79/1130151079.db2.gz HNIHGTNVKLSOBR-NEPJUHHUSA-N 1 0 276.405 3.877 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1cncs1)c1ccc(Cl)cc1O ZINC000903312135 1130151901 /nfs/dbraw/zinc/15/19/01/1130151901.db2.gz SORDFAGHZXGCKT-BDAKNGLRSA-N 1 0 282.796 3.914 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]CC[C@@H]1CCC(F)(F)C1)CC2 ZINC000903339763 1130162237 /nfs/dbraw/zinc/16/22/37/1130162237.db2.gz CWZILQKZPLDUNX-WCQYABFASA-N 1 0 281.346 3.795 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1O)c1cnn(CC2CCC2)c1 ZINC000903403629 1130171147 /nfs/dbraw/zinc/17/11/47/1130171147.db2.gz DJDDPKZESQFBKW-KGLIPLIRSA-N 1 0 299.418 3.801 20 10 CHCDRO CC[N@H+](Cc1cc(C)ns1)Cc1ccc(N(C)C)cc1 ZINC000788443741 1130186713 /nfs/dbraw/zinc/18/67/13/1130186713.db2.gz SNSWMPKEEFUAPU-UHFFFAOYSA-N 1 0 289.448 3.540 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H](CC(C)C)N(C)C)c(O)c1 ZINC000788505294 1130191432 /nfs/dbraw/zinc/19/14/32/1130191432.db2.gz FYARVPHKFOICRS-JKSUJKDBSA-N 1 0 292.467 3.636 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@H](CCO)CC(C)C)c(O)c1 ZINC000788611369 1130195484 /nfs/dbraw/zinc/19/54/84/1130195484.db2.gz NAPGUYPMMZKJDE-HZPDHXFCSA-N 1 0 293.451 3.704 20 10 CHCDRO CC[C@@H]1[C@@H](C)CC[N@@H+]1Cc1c([O-])ccc(Cl)c1F ZINC001462123251 1130198395 /nfs/dbraw/zinc/19/83/95/1130198395.db2.gz ATGXFJBSBPHUES-JOYOIKCWSA-N 1 0 271.763 3.805 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H]2c3ccccc3NC2(C)C)cc1 ZINC000903948574 1130211866 /nfs/dbraw/zinc/21/18/66/1130211866.db2.gz RPKXQOUWBJBRML-SFHVURJKSA-N 1 0 295.430 3.788 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H](C)CC(F)(F)F)c1ccc(N(C)C)cc1 ZINC000397035356 1130215961 /nfs/dbraw/zinc/21/59/61/1130215961.db2.gz ZRVGBYZJPIIRMK-NWDGAFQWSA-N 1 0 288.357 3.992 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2cnc(C)cc2C)c1 ZINC000396974441 1130216795 /nfs/dbraw/zinc/21/67/95/1130216795.db2.gz IVSATCLMGLLVLF-AWEZNQCLSA-N 1 0 270.376 3.563 20 10 CHCDRO CCn1ccc(C[N@H+](C)Cc2cc3c(cc2O)CCCC3)c1 ZINC000790446694 1130314313 /nfs/dbraw/zinc/31/43/13/1130314313.db2.gz LOXFZKSBJKLOET-UHFFFAOYSA-N 1 0 298.430 3.724 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1N(C)CCCC1(C)C)c1ccccc1O ZINC000790499423 1130315068 /nfs/dbraw/zinc/31/50/68/1130315068.db2.gz WVOWPGKHRUNDJJ-RDJZCZTQSA-N 1 0 290.451 3.553 20 10 CHCDRO C[C@H]([NH2+]CCCCCF)c1ccc(N(C)C)cc1 ZINC000792879991 1130503911 /nfs/dbraw/zinc/50/39/11/1130503911.db2.gz NJRWTPZIFDPNMB-ZDUSSCGKSA-N 1 0 252.377 3.543 20 10 CHCDRO CC[C@H](C)[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000792888619 1130504593 /nfs/dbraw/zinc/50/45/93/1130504593.db2.gz HXMMOXOAZQTWBO-JTQLQIEISA-N 1 0 274.330 3.660 20 10 CHCDRO COc1ccc([C@H](C)[C@H](C)[NH2+]Cc2ccccc2O)cc1 ZINC000747100306 1130517425 /nfs/dbraw/zinc/51/74/25/1130517425.db2.gz VOLYREUNBJAAIZ-KGLIPLIRSA-N 1 0 285.387 3.683 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+]CC[C@@]2(C)CC2(F)F)c1O ZINC000827251412 1130529912 /nfs/dbraw/zinc/52/99/12/1130529912.db2.gz HJTNRXTVJGBOET-ZDUSSCGKSA-N 1 0 289.753 3.879 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]CCCc1ccccc1F ZINC000793345456 1130541233 /nfs/dbraw/zinc/54/12/33/1130541233.db2.gz CMMKRPGGKLPAPE-UHFFFAOYSA-N 1 0 293.769 3.907 20 10 CHCDRO Cc1ccncc1C[N@@H+](C)Cc1cc(Cl)cc(C)c1O ZINC000793342085 1130541610 /nfs/dbraw/zinc/54/16/10/1130541610.db2.gz WKBACKLIOIGHGB-UHFFFAOYSA-N 1 0 290.794 3.689 20 10 CHCDRO C[N@H+](Cc1cc(F)ccc1O)[C@@H]1CCC(C)(C)C1 ZINC000793353339 1130543225 /nfs/dbraw/zinc/54/32/25/1130543225.db2.gz SAAIMCSGRBKDPU-CYBMUJFWSA-N 1 0 251.345 3.542 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccc2c[nH]nc2c1)c1ccccc1O ZINC000793576109 1130571724 /nfs/dbraw/zinc/57/17/24/1130571724.db2.gz XTTDBGIYBHOFPU-MRXNPFEDSA-N 1 0 295.386 3.552 20 10 CHCDRO CC1(C)C[N@H+](Cc2cc(Cl)ccc2O)[C@@H]1C1CC1 ZINC000811513274 1130618874 /nfs/dbraw/zinc/61/88/74/1130618874.db2.gz FMPVQCNIMXDUCT-CQSZACIVSA-N 1 0 265.784 3.666 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2cc3c(cc2O)CCCC3)CCC1(F)F ZINC000811778427 1130643983 /nfs/dbraw/zinc/64/39/83/1130643983.db2.gz KFOGTLURXVVDDV-GFCCVEGCSA-N 1 0 295.373 3.748 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)[C@@H]1CCCOC1)c1ccc(N(C)C)cc1 ZINC000780743978 1130689852 /nfs/dbraw/zinc/68/98/52/1130689852.db2.gz CHZVOSWWZXFFLV-KYJSFNMBSA-N 1 0 290.451 3.608 20 10 CHCDRO C[C@@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1cc(F)ccc1O ZINC000780792577 1130692830 /nfs/dbraw/zinc/69/28/30/1130692830.db2.gz HPAIRVOVCTYCRM-KOLCDFICSA-N 1 0 291.288 3.694 20 10 CHCDRO C[C@@H]1C[C@@H](F)C[N@@H+]1Cc1cccc(-c2ccccc2)c1O ZINC001234993263 1130699804 /nfs/dbraw/zinc/69/98/04/1130699804.db2.gz XTWRXJSWMLJGLI-CZUORRHYSA-N 1 0 285.362 3.992 20 10 CHCDRO CO[C@@H](C)C1C[NH+](Cc2cccc(-c3ccccc3)c2O)C1 ZINC001234999648 1130701011 /nfs/dbraw/zinc/70/10/11/1130701011.db2.gz XRBMWTHZMYHZJM-AWEZNQCLSA-N 1 0 297.398 3.526 20 10 CHCDRO C[C@H]1CC(=O)CC[N@@H+]1Cc1cccc(-c2ccccc2)c1O ZINC001234996611 1130701551 /nfs/dbraw/zinc/70/15/51/1130701551.db2.gz JKLAHKYFYOACQB-AWEZNQCLSA-N 1 0 295.382 3.613 20 10 CHCDRO CO[C@@H]1CCC[N@H+](Cc2cccc(-c3ccccc3)c2O)C1 ZINC001234992840 1130701695 /nfs/dbraw/zinc/70/16/95/1130701695.db2.gz SEPUBESNDHNNEO-QGZVFWFLSA-N 1 0 297.398 3.670 20 10 CHCDRO CO[C@](C)(C[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O)C1CC1 ZINC000812734887 1130710139 /nfs/dbraw/zinc/71/01/39/1130710139.db2.gz UIXVXDAJTBWKFK-MEDUHNTESA-N 1 0 297.826 3.820 20 10 CHCDRO CCOc1cccc(CNc2cc3c(c[nH+]2)CCCC3)c1O ZINC000812782041 1130713722 /nfs/dbraw/zinc/71/37/22/1130713722.db2.gz MXSIAIBDTXHLKG-UHFFFAOYSA-N 1 0 298.386 3.677 20 10 CHCDRO COc1cc(C)cc(C[N@@H+]2CC[C@]3(CC[C@@H](C)C3)C2)c1O ZINC000781585430 1130728410 /nfs/dbraw/zinc/72/84/10/1130728410.db2.gz FTNSDNQVCLYOME-ACJLOTCBSA-N 1 0 289.419 3.721 20 10 CHCDRO COc1cc(C[N@@H+]2CC[C@]3(CC[C@@H](C)C3)C2)c(O)cc1C ZINC000781587662 1130728451 /nfs/dbraw/zinc/72/84/51/1130728451.db2.gz RANHMXZFQDTQKD-ACJLOTCBSA-N 1 0 289.419 3.721 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]C[C@H](C)Cc2ccccc2)c1 ZINC000813330614 1130759722 /nfs/dbraw/zinc/75/97/22/1130759722.db2.gz BAXZZHBDXORZKR-HUUCEWRRSA-N 1 0 299.414 3.930 20 10 CHCDRO COc1ccc(C2CC[NH+](Cc3ccc(N)cc3)CC2)cc1 ZINC001235673420 1130764673 /nfs/dbraw/zinc/76/46/73/1130764673.db2.gz GTBRFWSKLUSGCT-UHFFFAOYSA-N 1 0 296.414 3.657 20 10 CHCDRO CC(C)(C)c1ccc(C[N@@H+]2CC[C@](C)(F)[C@H](F)C2)c(O)c1 ZINC001235673848 1130765959 /nfs/dbraw/zinc/76/59/59/1130765959.db2.gz AJIOQVFEGCBEHZ-WBVHZDCISA-N 1 0 297.389 3.962 20 10 CHCDRO C[C@@H]1C[C@H](F)C[N@@H+]1Cc1ccc(C(C)(C)C)cc1O ZINC001235676061 1130766459 /nfs/dbraw/zinc/76/64/59/1130766459.db2.gz OXDFVNSYQCLSLY-RISCZKNCSA-N 1 0 265.372 3.622 20 10 CHCDRO CC(C)(C)c1ccc(C[N@@H+]2C[C@H]3CC[C@@H]2C3)c(O)c1 ZINC001235679684 1130767148 /nfs/dbraw/zinc/76/71/48/1130767148.db2.gz QOCLJTPXWUMCJR-SWLSCSKDSA-N 1 0 259.393 3.674 20 10 CHCDRO CC(=O)[C@@H]1CCCC[N@@H+]1Cc1ccc(C(C)(C)C)cc1O ZINC001235678104 1130767102 /nfs/dbraw/zinc/76/71/02/1130767102.db2.gz JJQWGIZLJXDQRX-INIZCTEOSA-N 1 0 289.419 3.633 20 10 CHCDRO Cc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(N)cc2)cc1 ZINC001235679165 1130767425 /nfs/dbraw/zinc/76/74/25/1130767425.db2.gz PMOHAWAKDQXSPA-GOSISDBHSA-N 1 0 266.388 3.914 20 10 CHCDRO Nc1ccc(C[NH+]2CCC(Cc3ccc(F)cc3)CC2)cc1 ZINC001235864855 1130788834 /nfs/dbraw/zinc/78/88/34/1130788834.db2.gz WSFLRYGBRBRCOU-UHFFFAOYSA-N 1 0 298.405 3.863 20 10 CHCDRO CCCc1nc(C)c(C[NH2+][C@H](CC)c2ccccc2O)o1 ZINC000813886102 1130795154 /nfs/dbraw/zinc/79/51/54/1130795154.db2.gz VXUMVAPCMZBZLD-CQSZACIVSA-N 1 0 288.391 3.882 20 10 CHCDRO Cc1ccc(CC[C@H](C)[NH2+][C@@H](C)c2ccccc2O)o1 ZINC000783516057 1130833346 /nfs/dbraw/zinc/83/33/46/1130833346.db2.gz DHMWUFMIEKZNIB-JSGCOSHPSA-N 1 0 273.376 3.966 20 10 CHCDRO Cc1cccc(OCCC[NH2+][C@@H](C)c2ccccc2O)c1 ZINC000783518728 1130833740 /nfs/dbraw/zinc/83/37/40/1130833740.db2.gz ROLKVEJARFJERX-HNNXBMFYSA-N 1 0 285.387 3.820 20 10 CHCDRO C[C@H]([NH2+]C1(c2ccc(F)cc2)CC1)c1ccccc1O ZINC000783524566 1130833830 /nfs/dbraw/zinc/83/38/30/1130833830.db2.gz OUFAVTLIXIZHSY-LBPRGKRZSA-N 1 0 271.335 3.871 20 10 CHCDRO C[C@H]([NH2+]CCC1Cc2ccccc2C1)c1ccccc1O ZINC000783520291 1130833892 /nfs/dbraw/zinc/83/38/92/1130833892.db2.gz ZYPLSBGVDGIJJN-AWEZNQCLSA-N 1 0 281.399 3.848 20 10 CHCDRO C[C@@H]([NH2+][C@H]1COc2ccc(Cl)cc21)c1ccccc1O ZINC000783518830 1130834066 /nfs/dbraw/zinc/83/40/66/1130834066.db2.gz PBJKIDLPSJJQCH-YGRLFVJLSA-N 1 0 289.762 3.830 20 10 CHCDRO CSC[C@H]1CCC[N@H+](Cc2c(O)cccc2Cl)C1 ZINC000814178879 1130834186 /nfs/dbraw/zinc/83/41/86/1130834186.db2.gz HAOUNACJIWYFHY-NSHDSACASA-N 1 0 285.840 3.621 20 10 CHCDRO CC[C@@H]1CC[N@@H+]1Cc1ccc(OCc2ccccc2)cc1O ZINC000814178765 1130835014 /nfs/dbraw/zinc/83/50/14/1130835014.db2.gz CKGWFPKXNVKITP-QGZVFWFLSA-N 1 0 297.398 3.956 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2c(O)ccc3ccncc32)CC(C)(C)C1 ZINC000784007600 1130867404 /nfs/dbraw/zinc/86/74/04/1130867404.db2.gz JNGZJHQAXZVBAE-ZDUSSCGKSA-N 1 0 284.403 3.808 20 10 CHCDRO CCSCC[C@@H](C)[NH2+][C@H](C)c1cc(C)ccc1O ZINC000168807124 1130900857 /nfs/dbraw/zinc/90/08/57/1130900857.db2.gz QELWRDOQPAUSOK-CHWSQXEVSA-N 1 0 267.438 3.883 20 10 CHCDRO CS[C@@H](C[NH2+]Cc1cc(Cl)ccc1O)C(C)(C)C ZINC000784625807 1130913640 /nfs/dbraw/zinc/91/36/40/1130913640.db2.gz IECSDRFIDDPGFN-ZDUSSCGKSA-N 1 0 287.856 3.913 20 10 CHCDRO Cc1cc(C[N@H+](C)Cc2cccs2)ccc1N(C)C ZINC000815012275 1130950897 /nfs/dbraw/zinc/95/08/97/1130950897.db2.gz KCXUJSYZTPEIMN-UHFFFAOYSA-N 1 0 274.433 3.755 20 10 CHCDRO Cc1csc([C@H](C)[NH2+]Cc2ccc(N(C)C)c(C)c2)n1 ZINC000815088073 1130957629 /nfs/dbraw/zinc/95/76/29/1130957629.db2.gz ALGIOLZVTBTWAK-ZDUSSCGKSA-N 1 0 289.448 3.677 20 10 CHCDRO C[C@H]([NH2+]CC1(C(F)(F)F)CC1)c1ccc(N(C)C)cc1 ZINC000797072948 1130958352 /nfs/dbraw/zinc/95/83/52/1130958352.db2.gz OCQJDJIHMIVWIY-NSHDSACASA-N 1 0 286.341 3.746 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CCCC[C@H]2c2cc[nH]n2)cc1 ZINC000815116432 1130958390 /nfs/dbraw/zinc/95/83/90/1130958390.db2.gz MUSASQHUCVRZSH-SFHVURJKSA-N 1 0 298.434 3.593 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CCC[C@H](CSC)C2)cc1 ZINC000815121209 1130959835 /nfs/dbraw/zinc/95/98/35/1130959835.db2.gz SLFIXNXMXCZGJO-INIZCTEOSA-N 1 0 292.492 3.718 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CCC[C@@](C)(OC)CC2)cc1 ZINC000815105914 1130962156 /nfs/dbraw/zinc/96/21/56/1130962156.db2.gz MJMYPXUXRIEADW-GOSISDBHSA-N 1 0 290.451 3.534 20 10 CHCDRO CCCN1CCC[C@H]1C[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000797116703 1130963142 /nfs/dbraw/zinc/96/31/42/1130963142.db2.gz WWFYGGFMDZTSJF-CVEARBPZSA-N 1 0 290.451 3.534 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CC[C@H]1C)c1cc(Cl)ccc1O ZINC000797126896 1130964058 /nfs/dbraw/zinc/96/40/58/1130964058.db2.gz BTXXVDMZSOTDGK-JIMOISOXSA-N 1 0 253.773 3.885 20 10 CHCDRO CC(=O)c1cc(Cl)cc(C[N@@H+]2CC(C)=C[C@H](C)C2)c1O ZINC000797526113 1130990444 /nfs/dbraw/zinc/99/04/44/1130990444.db2.gz INOSNYCCELINCX-JTQLQIEISA-N 1 0 293.794 3.646 20 10 CHCDRO CC[NH2+][C@@H](CCc1ccccc1)c1ccccc1O ZINC000815555289 1130998116 /nfs/dbraw/zinc/99/81/16/1130998116.db2.gz VNXPDLHOQVSEEI-INIZCTEOSA-N 1 0 255.361 3.676 20 10 CHCDRO Cc1occc1C[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000815568903 1131000596 /nfs/dbraw/zinc/00/05/96/1131000596.db2.gz YGOYSQFZZCQMBL-GFCCVEGCSA-N 1 0 259.349 3.761 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@H](O)c2ccccc2C)c(O)c1 ZINC000815579939 1131003123 /nfs/dbraw/zinc/00/31/23/1131003123.db2.gz YUHKBMZNYAWOCO-YJBOKZPZSA-N 1 0 299.414 3.702 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CC2(CO)CCCCC2)c(O)c1 ZINC000815595780 1131006207 /nfs/dbraw/zinc/00/62/07/1131006207.db2.gz BFHZAMZFFVISNS-OAHLLOKOSA-N 1 0 291.435 3.602 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CC2(CO)CCCCC2)c(O)c1 ZINC000815595779 1131006502 /nfs/dbraw/zinc/00/65/02/1131006502.db2.gz BFHZAMZFFVISNS-HNNXBMFYSA-N 1 0 291.435 3.602 20 10 CHCDRO CCc1ccc(C[N@@H+]2Cc3ccccc3C[C@H]2C)c(O)c1 ZINC001236789661 1131006510 /nfs/dbraw/zinc/00/65/10/1131006510.db2.gz CUELXOFGMMWPTP-CQSZACIVSA-N 1 0 281.399 3.901 20 10 CHCDRO CCc1ccc(C[NH+]2CCC(c3ccccn3)CC2)c(O)c1 ZINC001236789640 1131006578 /nfs/dbraw/zinc/00/65/78/1131006578.db2.gz BXOWRAOGAUSMFJ-UHFFFAOYSA-N 1 0 296.414 3.729 20 10 CHCDRO CCc1ccc(C[N@@H+]2CCCC3(CCC3)C2)c(O)c1 ZINC001236789593 1131007321 /nfs/dbraw/zinc/00/73/21/1131007321.db2.gz ZOPDQARNOSMSEY-UHFFFAOYSA-N 1 0 259.393 3.721 20 10 CHCDRO CO[C@@H](C)C[NH2+][C@@H](CCc1ccccc1)c1ccccc1O ZINC000815619641 1131009884 /nfs/dbraw/zinc/00/98/84/1131009884.db2.gz TXXYXUAQACIEGS-YJBOKZPZSA-N 1 0 299.414 3.691 20 10 CHCDRO CCC[N@@H+](Cc1c(O)cc(OC)cc1Cl)CC1CC1 ZINC001236804449 1131011568 /nfs/dbraw/zinc/01/15/68/1131011568.db2.gz TWNPIOKFVDNEQY-UHFFFAOYSA-N 1 0 283.799 3.676 20 10 CHCDRO COc1cc(C)c(C[N@@H+]2CC[C@H](c3ccccc3)C2)c(O)c1 ZINC001236806787 1131011618 /nfs/dbraw/zinc/01/16/18/1131011618.db2.gz BDMXJBCVYZOSEM-INIZCTEOSA-N 1 0 297.398 3.699 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@H]2COc3ccccc32)c(O)c1 ZINC000815626727 1131011946 /nfs/dbraw/zinc/01/19/46/1131011946.db2.gz KQPQXRXGVCQNCC-GJZGRUSLSA-N 1 0 297.398 3.836 20 10 CHCDRO COc1cc(C)c(C[N@@H+]2CCC[C@H](C)[C@H](C)C2)c(O)c1 ZINC001236808419 1131012353 /nfs/dbraw/zinc/01/23/53/1131012353.db2.gz PHWPBLZZCYKVMW-GXTWGEPZSA-N 1 0 277.408 3.577 20 10 CHCDRO COc1cc(C)c(C[N@@H+]2CCC[C@@H]3CCCC[C@H]32)c(O)c1 ZINC001236811647 1131012808 /nfs/dbraw/zinc/01/28/08/1131012808.db2.gz UQHPHSDXTQZLPG-WMLDXEAASA-N 1 0 289.419 3.864 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1cc[nH]c(=O)c1)c1ccc(N(C)C)cc1 ZINC000815642651 1131015544 /nfs/dbraw/zinc/01/55/44/1131015544.db2.gz IRCAFAWERXVAEY-SUMWQHHRSA-N 1 0 299.418 3.655 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)ccc1O)c1cc[nH]c(=O)c1 ZINC000815642680 1131015628 /nfs/dbraw/zinc/01/56/28/1131015628.db2.gz JNIFLKSUTSFHHO-ZJUUUORDSA-N 1 0 292.766 3.558 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2c(F)cc(F)cc2F)c1 ZINC000815650047 1131016479 /nfs/dbraw/zinc/01/64/79/1131016479.db2.gz HAFDFPABEZXLBT-SNVBAGLBSA-N 1 0 295.304 3.969 20 10 CHCDRO Oc1cc2ccccc2cc1C[NH+]1CCC2(CC2)CC1 ZINC001236825687 1131017527 /nfs/dbraw/zinc/01/75/27/1131017527.db2.gz CHJDWMHOKJRSQV-UHFFFAOYSA-N 1 0 267.372 3.921 20 10 CHCDRO Oc1cc2ccccc2cc1C[N@@H+]1CC[C@@H](C(F)(F)F)C1 ZINC001236834375 1131019522 /nfs/dbraw/zinc/01/95/22/1131019522.db2.gz XQAMHBNALUZDSD-CQSZACIVSA-N 1 0 295.304 3.930 20 10 CHCDRO CO[C@H]1CC[N@H+](Cc2cc3ccccc3cc2O)[C@H](C)C1 ZINC001236834595 1131019980 /nfs/dbraw/zinc/01/99/80/1131019980.db2.gz BWPNZEOVYJUOCV-DYVFJYSZSA-N 1 0 285.387 3.545 20 10 CHCDRO Oc1cc2ccccc2cc1C[N@@H+]1C[C@H]2CC[C@@H]1C2 ZINC001236834105 1131020055 /nfs/dbraw/zinc/02/00/55/1131020055.db2.gz UQECNDFLVOZKBJ-BLLLJJGKSA-N 1 0 253.345 3.530 20 10 CHCDRO CCC[N@H+](Cc1ccc(OCC)cc1O)[C@H](C)CC ZINC001237044700 1131038914 /nfs/dbraw/zinc/03/89/14/1131038914.db2.gz MIVOXZCEGIAVPL-CYBMUJFWSA-N 1 0 265.397 3.801 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CCCC3(CCCC3)C2)c(O)c1 ZINC001237049791 1131040435 /nfs/dbraw/zinc/04/04/35/1131040435.db2.gz JNTJKXZHEWAFBM-UHFFFAOYSA-N 1 0 289.419 3.947 20 10 CHCDRO CC(C)c1ccc(C[N@@H+]2CC[C@H]3O[C@@H](C)C[C@H]3C2)c(O)c1 ZINC001237051476 1131040512 /nfs/dbraw/zinc/04/05/12/1131040512.db2.gz LEXYVGOHQVJUQY-QANKJYHBSA-N 1 0 289.419 3.515 20 10 CHCDRO CCOCC1CC[NH+](Cc2ccc(C(C)C)cc2O)CC1 ZINC001237050228 1131041071 /nfs/dbraw/zinc/04/10/71/1131041071.db2.gz ZNTRGCBRVRPANI-UHFFFAOYSA-N 1 0 291.435 3.764 20 10 CHCDRO Oc1ccc(C(F)(F)F)cc1CN1CCc2occc2C1 ZINC001237146362 1131058898 /nfs/dbraw/zinc/05/88/98/1131058898.db2.gz UKAHIXNCDFPREQ-UHFFFAOYSA-N 1 0 297.276 3.562 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@H]2C[C@H](c3ccccc3C)C2)c1 ZINC000798959702 1131065113 /nfs/dbraw/zinc/06/51/13/1131065113.db2.gz OEKGWGPHUWZWHQ-KOMQPUFPSA-N 1 0 297.398 3.745 20 10 CHCDRO Cc1cccc(O)c1C[NH+]1CCC(C(C)(C)C)CC1 ZINC001237483606 1131103908 /nfs/dbraw/zinc/10/39/08/1131103908.db2.gz QFRAVTCTCWBGND-UHFFFAOYSA-N 1 0 261.409 3.959 20 10 CHCDRO CCc1ccc(C[N@H+](C)Cc2c(C)cccc2O)cc1 ZINC001237488095 1131104592 /nfs/dbraw/zinc/10/45/92/1131104592.db2.gz QRAZDRQWWGOALQ-UHFFFAOYSA-N 1 0 269.388 3.895 20 10 CHCDRO Cc1csc(CC[NH2+]Cc2ccc3ccccc3c2O)n1 ZINC000816535540 1131106100 /nfs/dbraw/zinc/10/61/00/1131106100.db2.gz RSFMCIKSLPCWIU-UHFFFAOYSA-N 1 0 298.411 3.643 20 10 CHCDRO Oc1c(C[NH2+][C@@H]2CC=CCC2)ccc2ccccc21 ZINC000816552646 1131109501 /nfs/dbraw/zinc/10/95/01/1131109501.db2.gz RVKXUNLNSAPZQM-OAHLLOKOSA-N 1 0 253.345 3.744 20 10 CHCDRO C[C@@H]1C[C@@H]([NH2+]Cc2ccc3ccccc3c2O)C[C@H](C)O1 ZINC000816559555 1131111137 /nfs/dbraw/zinc/11/11/37/1131111137.db2.gz NLJTUGVYZXFQBJ-YWVIFJGQSA-N 1 0 285.387 3.591 20 10 CHCDRO Oc1c(C[NH2+]CC2(C3CC3)CC2)ccc2ccccc21 ZINC000816558293 1131111180 /nfs/dbraw/zinc/11/11/80/1131111180.db2.gz SQWMLRUHDGSUMT-UHFFFAOYSA-N 1 0 267.372 3.825 20 10 CHCDRO CCC1(O)CCC([NH2+]Cc2ccc3ccccc3c2O)CC1 ZINC000816560645 1131111355 /nfs/dbraw/zinc/11/13/55/1131111355.db2.gz VZZOMCLEIPTJTN-UHFFFAOYSA-N 1 0 299.414 3.719 20 10 CHCDRO Oc1c(C[N@@H+]2CC[C@]3(C2)CCCOC3)ccc2ccccc21 ZINC000816603182 1131114148 /nfs/dbraw/zinc/11/41/48/1131114148.db2.gz BQVGWEUDZBZLAO-IBGZPJMESA-N 1 0 297.398 3.548 20 10 CHCDRO CCOCC(C)(C)C[NH2+]Cc1ccc2ccccc2c1O ZINC000816613075 1131115945 /nfs/dbraw/zinc/11/59/45/1131115945.db2.gz IIJOCSBSDSBFIM-UHFFFAOYSA-N 1 0 287.403 3.698 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+]C2(C(C)C)CC2)c1O ZINC000816644134 1131117443 /nfs/dbraw/zinc/11/74/43/1131117443.db2.gz DDNRRCKJHWIBKV-UHFFFAOYSA-N 1 0 253.773 3.632 20 10 CHCDRO C[C@@H]1[C@@H](C)C[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000816648342 1131119478 /nfs/dbraw/zinc/11/94/78/1131119478.db2.gz IZCHZJKZDGFWOI-LSDHHAIUSA-N 1 0 258.409 3.517 20 10 CHCDRO C[C@@H]1CC[N@@H+]1Cc1cc(-c2ccc(F)cc2)ccc1O ZINC001237641530 1131123156 /nfs/dbraw/zinc/12/31/56/1131123156.db2.gz SXSLBYITZNHRTB-GFCCVEGCSA-N 1 0 271.335 3.793 20 10 CHCDRO CCCCC[N@H+](C)Cc1cc(F)cc(Cl)c1[O-] ZINC001237807856 1131141954 /nfs/dbraw/zinc/14/19/54/1131141954.db2.gz NHVNVOKGKWUXOV-UHFFFAOYSA-N 1 0 259.752 3.807 20 10 CHCDRO C[C@H]1CCCC[N@H+](Cc2cc(F)cc(Cl)c2[O-])C1 ZINC001237807806 1131142872 /nfs/dbraw/zinc/14/28/72/1131142872.db2.gz MJQJDTBDFPSJIM-JTQLQIEISA-N 1 0 271.763 3.807 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[NH+]1C[C@H]2CCCC[C@@H]2C1 ZINC001116442910 1131147084 /nfs/dbraw/zinc/14/70/84/1131147084.db2.gz WRPDXNRXZGIYHS-QZTJIDSGSA-N 1 0 284.447 3.909 20 10 CHCDRO Cc1occc1C[N@@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001116442374 1131147134 /nfs/dbraw/zinc/14/71/34/1131147134.db2.gz TXTCXUWXDLKPJI-UHFFFAOYSA-N 1 0 284.403 3.820 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc(C)nc(C)c1)c1ccccc1O ZINC000817410351 1131160557 /nfs/dbraw/zinc/16/05/57/1131160557.db2.gz LTAPFEFXZNIEHZ-MRXNPFEDSA-N 1 0 270.376 3.645 20 10 CHCDRO Cc1cc(C[NH2+]Cc2cc(Cl)cc(C)c2O)cc(C)n1 ZINC000817411369 1131160725 /nfs/dbraw/zinc/16/07/25/1131160725.db2.gz QNOFPXLBWIWNPS-UHFFFAOYSA-N 1 0 290.794 3.656 20 10 CHCDRO Cc1cc(F)cc(C[N@H+]2CC[C@H](C)C(F)(F)CC2)c1O ZINC001238057406 1131165189 /nfs/dbraw/zinc/16/51/89/1131165189.db2.gz KPJKTCICHCTCAT-NSHDSACASA-N 1 0 287.325 3.707 20 10 CHCDRO Cc1cc(F)cc(C[N@@H+]2CC[C@H]3CCCC[C@H]3C2)c1O ZINC001238061904 1131166131 /nfs/dbraw/zinc/16/61/31/1131166131.db2.gz LEZXYWNNGPPJNO-KGLIPLIRSA-N 1 0 277.383 3.852 20 10 CHCDRO CCC(CC)[N@H+](CC)Cc1cc(F)cc(C)c1O ZINC001238069511 1131167784 /nfs/dbraw/zinc/16/77/84/1131167784.db2.gz IZUZVMQNLMREMQ-UHFFFAOYSA-N 1 0 253.361 3.850 20 10 CHCDRO Cc1cc(F)cc(C[N@H+](C)Cc2ccc(Cl)nc2)c1O ZINC001238069976 1131168477 /nfs/dbraw/zinc/16/84/77/1131168477.db2.gz LSUSDSVURGWIDB-UHFFFAOYSA-N 1 0 294.757 3.520 20 10 CHCDRO CO[C@H]1CCCC[C@@H]1[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC001116925143 1131170927 /nfs/dbraw/zinc/17/09/27/1131170927.db2.gz MIFZBAZGBKFMTC-CTASWTNQSA-N 1 0 289.419 3.796 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCO[C@H](CC)C1)c1ccc(F)cc1[O-] ZINC000817587428 1131174305 /nfs/dbraw/zinc/17/43/05/1131174305.db2.gz WYIRKVURXMFWSX-GUTXKFCHSA-N 1 0 281.371 3.530 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CCO[C@H](CC)C1)c1ccc(F)cc1[O-] ZINC000817587431 1131174388 /nfs/dbraw/zinc/17/43/88/1131174388.db2.gz WYIRKVURXMFWSX-UMVBOHGHSA-N 1 0 281.371 3.530 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2cc(C)nc(C)c2)c1 ZINC000817588676 1131175259 /nfs/dbraw/zinc/17/52/59/1131175259.db2.gz IKGHQRAOKZTNFD-AWEZNQCLSA-N 1 0 270.376 3.563 20 10 CHCDRO C[C@@H](CCC(C)(C)C)[NH2+]C[C@@H](N)c1ccc(N(C)C)cc1 ZINC000817943901 1131187887 /nfs/dbraw/zinc/18/78/87/1131187887.db2.gz WMASLHBETVJXLO-WMLDXEAASA-N 1 0 291.483 3.557 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccc(N)cc1)c1cc(F)ccc1F ZINC000817955747 1131190155 /nfs/dbraw/zinc/19/01/55/1131190155.db2.gz GUQYOSLVJSXFCS-QGZVFWFLSA-N 1 0 290.357 3.830 20 10 CHCDRO Nc1ccc(CC[NH2+][C@@H]2CCCCC23CCCC3)cc1 ZINC000817956819 1131190428 /nfs/dbraw/zinc/19/04/28/1131190428.db2.gz DKURWRMPMZVAOP-QGZVFWFLSA-N 1 0 272.436 3.904 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccc(N)cc1)c1ccc(F)cc1Cl ZINC000817955417 1131190473 /nfs/dbraw/zinc/19/04/73/1131190473.db2.gz AIAXZPQKONVIPE-LLVKDONJSA-N 1 0 292.785 3.955 20 10 CHCDRO Cc1cc([C@@H](C)[NH2+]CCc2ccc(N)cc2)cc(C)c1F ZINC000817955868 1131190593 /nfs/dbraw/zinc/19/05/93/1131190593.db2.gz JPQOGFYWFPCFLM-CQSZACIVSA-N 1 0 286.394 3.918 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCc2ccc(N)cc2)cc1C ZINC000817955838 1131190612 /nfs/dbraw/zinc/19/06/12/1131190612.db2.gz JAUGRCBPOLXWNS-OAHLLOKOSA-N 1 0 268.404 3.779 20 10 CHCDRO CCCOc1ccc([C@H](C)[NH2+]CCc2ccc(N)cc2)cc1 ZINC000817955909 1131190706 /nfs/dbraw/zinc/19/07/06/1131190706.db2.gz KWIDXIGUVIVLDD-HNNXBMFYSA-N 1 0 298.430 3.951 20 10 CHCDRO Nc1ccc(CC[NH2+][C@H]2CC[C@@H](c3ccccc3)C2)cc1 ZINC000817958773 1131191220 /nfs/dbraw/zinc/19/12/20/1131191220.db2.gz YDCGOZYLOCROPV-MJGOQNOKSA-N 1 0 280.415 3.737 20 10 CHCDRO C[C@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccc2ccccc2c1O ZINC000817986852 1131195042 /nfs/dbraw/zinc/19/50/42/1131195042.db2.gz USPWNYRKEZYTMX-AWEZNQCLSA-N 1 0 296.414 3.506 20 10 CHCDRO C[C@@H]([NH2+][C@H](CN)C1CCCC1)c1ccc2ccccc2c1O ZINC000817981186 1131195333 /nfs/dbraw/zinc/19/53/33/1131195333.db2.gz HAIMYTFRIHNNFY-FZKQIMNGSA-N 1 0 298.430 3.714 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCCN2)c1ccccc1O ZINC000817977386 1131195447 /nfs/dbraw/zinc/19/54/47/1131195447.db2.gz JDONZAFMZMEZPZ-ZDUSSCGKSA-N 1 0 282.387 3.601 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H]2C[C@H]3C[C@H]3C2)cc1 ZINC000818361346 1131211430 /nfs/dbraw/zinc/21/14/30/1131211430.db2.gz WVHKZTZRGKEHST-DMRZNYOFSA-N 1 0 258.409 3.592 20 10 CHCDRO CC[N@H+](Cc1cnc(C2CC2)c(C)c1)Cc1ccccc1O ZINC001238626653 1131225425 /nfs/dbraw/zinc/22/54/25/1131225425.db2.gz YQUWZIDGNMQBOI-UHFFFAOYSA-N 1 0 296.414 3.995 20 10 CHCDRO COC1CC(CC[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)C1 ZINC001118428216 1131226126 /nfs/dbraw/zinc/22/61/26/1131226126.db2.gz RICSUYQLPXXSMM-XSCHDIRWSA-N 1 0 289.419 3.654 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1C[C@@H]2[C@H](C1)C2(F)F)c1ccc(N(C)C)cc1 ZINC001118489236 1131228690 /nfs/dbraw/zinc/22/86/90/1131228690.db2.gz HMVFJIUUERZUSN-SLBVQIDZSA-N 1 0 294.389 3.837 20 10 CHCDRO CC[C@H]1C[C@@H]([NH2+]Cc2ccc(N(CC)CC)cc2)CCO1 ZINC000823671942 1131436961 /nfs/dbraw/zinc/43/69/61/1131436961.db2.gz YGZAHGIYLQQDNZ-WMZOPIPTSA-N 1 0 290.451 3.580 20 10 CHCDRO CC[C@@H]([NH2+]CCCSc1nccs1)C1CCC1 ZINC000823937835 1131448469 /nfs/dbraw/zinc/44/84/69/1131448469.db2.gz LBDNAZMFVYGKKC-GFCCVEGCSA-N 1 0 270.467 3.794 20 10 CHCDRO Cc1cccc(C[NH2+]CCCSc2nccs2)c1F ZINC000823937644 1131448573 /nfs/dbraw/zinc/44/85/73/1131448573.db2.gz FFXUVQXCCPFSJZ-UHFFFAOYSA-N 1 0 296.436 3.863 20 10 CHCDRO CC(C)[N@H+](Cc1ccc(Br)cc1O)C1CC1 ZINC000824575621 1131474796 /nfs/dbraw/zinc/47/47/96/1131474796.db2.gz KXWLPNFULGOZJY-UHFFFAOYSA-N 1 0 284.197 3.528 20 10 CHCDRO Oc1ccccc1C[NH2+]CC[C@@H]1CCc2ccccc21 ZINC000824548435 1131475197 /nfs/dbraw/zinc/47/51/97/1131475197.db2.gz HOUXRVLLWJNSMK-HNNXBMFYSA-N 1 0 267.372 3.602 20 10 CHCDRO Cc1cc(O)c(C[NH+]2CCC(OC(C)C)CC2)cc1Cl ZINC000824606770 1131476693 /nfs/dbraw/zinc/47/66/93/1131476693.db2.gz XUEZGHRMWWOKEN-UHFFFAOYSA-N 1 0 297.826 3.743 20 10 CHCDRO C[C@@H]1CCC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC001138213896 1131477753 /nfs/dbraw/zinc/47/77/53/1131477753.db2.gz FGUSFPAGXDPUPU-MRXNPFEDSA-N 1 0 272.436 3.909 20 10 CHCDRO C[C@H]1CCC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC001138213895 1131478053 /nfs/dbraw/zinc/47/80/53/1131478053.db2.gz FGUSFPAGXDPUPU-INIZCTEOSA-N 1 0 272.436 3.909 20 10 CHCDRO Cc1ccc(O)c(C[N@H+]2CC[C@H](C(F)(F)F)C[C@@H]2C)c1 ZINC000824714791 1131480594 /nfs/dbraw/zinc/48/05/94/1131480594.db2.gz GIWFOCNJRMTSAU-AAEUAGOBSA-N 1 0 287.325 3.863 20 10 CHCDRO CCC[C@H]([NH2+]Cc1cc(OC)c(OC)cc1O)C(C)(C)C ZINC000824722519 1131480640 /nfs/dbraw/zinc/48/06/40/1131480640.db2.gz VAFLGMZFPQFACS-INIZCTEOSA-N 1 0 295.423 3.714 20 10 CHCDRO Cc1c(C[N@@H+](C)C2CC(C)C2)c2ccccc2n1C ZINC001138252764 1131482566 /nfs/dbraw/zinc/48/25/66/1131482566.db2.gz TVEGBNBSFCQWSL-UHFFFAOYSA-N 1 0 256.393 3.717 20 10 CHCDRO Cc1c(C[N@@H+]2CCc3occc3C2)c2ccccc2n1C ZINC001138258241 1131483039 /nfs/dbraw/zinc/48/30/39/1131483039.db2.gz NGMDUSKFYFUWCK-UHFFFAOYSA-N 1 0 280.371 3.638 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1CCOC2(CCC2)C1)c1ccccc1O ZINC000824750796 1131484205 /nfs/dbraw/zinc/48/42/05/1131484205.db2.gz PEXHFHLEFQIDMR-GOEBONIOSA-N 1 0 289.419 3.782 20 10 CHCDRO CC(C)[C@H]1C[C@H](C[NH2+]Cc2cc(Cl)ccc2O)CCO1 ZINC000824798547 1131484838 /nfs/dbraw/zinc/48/48/38/1131484838.db2.gz DRWMZJHQDZJLMG-MLGOLLRUSA-N 1 0 297.826 3.586 20 10 CHCDRO CCn1ccnc1[C@H](C)[NH2+]Cc1ccc2ccccc2c1O ZINC000825005556 1131491358 /nfs/dbraw/zinc/49/13/58/1131491358.db2.gz OUIPFDZBTAVNNB-ZDUSSCGKSA-N 1 0 295.386 3.613 20 10 CHCDRO CN1CCCc2cc(C[N@@H+]3CCCCC34CC4)ccc21 ZINC001138355723 1131494155 /nfs/dbraw/zinc/49/41/55/1131494155.db2.gz AHBLYBQJZTYACL-UHFFFAOYSA-N 1 0 270.420 3.588 20 10 CHCDRO CC(C)[C@@H]1CCC[N@@H+]1Cc1ccc2c(c1)CCCN2C ZINC001138359124 1131494267 /nfs/dbraw/zinc/49/42/67/1131494267.db2.gz LMLMQQLDTSHJQQ-KRWDZBQOSA-N 1 0 272.436 3.689 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCCC[C@H]2C)c(OC)c1 ZINC001138387788 1131496917 /nfs/dbraw/zinc/49/69/17/1131496917.db2.gz LGNUQCRVAICUNB-OAHLLOKOSA-N 1 0 290.451 3.916 20 10 CHCDRO Oc1ccccc1C[NH2+]C1(Cc2cccc(Cl)c2)CC1 ZINC000825130397 1131499818 /nfs/dbraw/zinc/49/98/18/1131499818.db2.gz XIHUBFONGSGRNR-UHFFFAOYSA-N 1 0 287.790 3.911 20 10 CHCDRO Cc1cc(C)c(C[NH2+]Cc2cc(Cl)cc(C)c2O)cn1 ZINC000825221739 1131501925 /nfs/dbraw/zinc/50/19/25/1131501925.db2.gz XPTJUKWVHLZEGI-UHFFFAOYSA-N 1 0 290.794 3.656 20 10 CHCDRO CCc1nc(C[NH2+]Cc2cc(Cl)c(C)cc2O)cs1 ZINC000825228261 1131503743 /nfs/dbraw/zinc/50/37/43/1131503743.db2.gz VONFOSVAQYESQO-UHFFFAOYSA-N 1 0 296.823 3.663 20 10 CHCDRO Cc1noc(C)c1[C@@H](C)[NH2+]Cc1cc(Cl)c(C)cc1O ZINC000825291486 1131505669 /nfs/dbraw/zinc/50/56/69/1131505669.db2.gz LWFDDXXDRNFFJI-SECBINFHSA-N 1 0 294.782 3.810 20 10 CHCDRO COC[C@H]1CCC[N@H+](Cc2ccc3ccccc3c2O)CC1 ZINC000825321960 1131506856 /nfs/dbraw/zinc/50/68/56/1131506856.db2.gz SSKBJBJMWOOMDQ-HNNXBMFYSA-N 1 0 299.414 3.794 20 10 CHCDRO Oc1cccc2c1C[N@H+](Cc1ccc3occc3c1)CC2 ZINC001138825736 1131553375 /nfs/dbraw/zinc/55/33/75/1131553375.db2.gz VDKUWZZWZYMZOF-UHFFFAOYSA-N 1 0 279.339 3.697 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CCC[C@@]3(CC3(F)F)C2)cc1 ZINC000844442463 1131566104 /nfs/dbraw/zinc/56/61/04/1131566104.db2.gz YJHXRWYUFPJVOA-MRXNPFEDSA-N 1 0 294.389 3.764 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@@H+]2CCC[C@@]3(CC3(F)F)C2)c1 ZINC000844747668 1131595510 /nfs/dbraw/zinc/59/55/10/1131595510.db2.gz XPMKQXHPUVVEEK-OAHLLOKOSA-N 1 0 281.346 3.630 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000844756319 1131595676 /nfs/dbraw/zinc/59/56/76/1131595676.db2.gz ABFDUQNQGXCRCP-MRXNPFEDSA-N 1 0 289.325 3.777 20 10 CHCDRO CC(C)=CCC[NH2+]Cc1cc(Cl)cc(C)c1O ZINC000792182942 1131624585 /nfs/dbraw/zinc/62/45/85/1131624585.db2.gz IDNHSVFFUITREY-UHFFFAOYSA-N 1 0 253.773 3.800 20 10 CHCDRO Cc1cc(C[N@@H+]2CCCCC23CC3)ccc1N(C)C ZINC001139673027 1131627535 /nfs/dbraw/zinc/62/75/35/1131627535.db2.gz OZKHQYFIYAHFQY-UHFFFAOYSA-N 1 0 258.409 3.580 20 10 CHCDRO CCC[N@H+](CCCc1ccc(C)nc1)Cc1ccccc1O ZINC000792797831 1131653255 /nfs/dbraw/zinc/65/32/55/1131653255.db2.gz ILYRQOHGXDNIIS-UHFFFAOYSA-N 1 0 298.430 3.940 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CCCC2(CC(F)C2)CC1 ZINC001140059203 1131660601 /nfs/dbraw/zinc/66/06/01/1131660601.db2.gz YSLPCVFZMWPSHS-UHFFFAOYSA-N 1 0 281.346 3.636 20 10 CHCDRO C[C@@H]([NH2+]Cc1cc2cnccc2o1)c1ccc(N(C)C)cc1 ZINC000845956124 1131670763 /nfs/dbraw/zinc/67/07/63/1131670763.db2.gz JIBHVAUIIYQLAX-CYBMUJFWSA-N 1 0 295.386 3.745 20 10 CHCDRO COc1ccc(C[NH2+]Cc2ccc(C)cc2Cl)c(O)c1 ZINC000845968293 1131672802 /nfs/dbraw/zinc/67/28/02/1131672802.db2.gz ULCZHVYXAYLEAS-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCC[C@H]2c2ccncc2)c1O ZINC001140178894 1131673009 /nfs/dbraw/zinc/67/30/09/1131673009.db2.gz BTONJEDMLMUIFU-KRWDZBQOSA-N 1 0 282.387 3.741 20 10 CHCDRO Cc1ccc(C)c(C[NH+]2C[C@H]3CCCC[C@@H]3C2)c1O ZINC001140178289 1131673038 /nfs/dbraw/zinc/67/30/38/1131673038.db2.gz HCCVGKJZBJLUGA-HUUCEWRRSA-N 1 0 259.393 3.631 20 10 CHCDRO Cc1ccc(C)c(C[N@H+](C)Cc2cccs2)c1O ZINC001140179772 1131673420 /nfs/dbraw/zinc/67/34/20/1131673420.db2.gz OWRJKARGBMDWGK-UHFFFAOYSA-N 1 0 261.390 3.703 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCCC[C@@](C)(F)C2)c1O ZINC001140178612 1131673489 /nfs/dbraw/zinc/67/34/89/1131673489.db2.gz QMFYZUZKSAZRFS-MRXNPFEDSA-N 1 0 265.372 3.723 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CC[C@@H](Oc3ccccc3)C2)c1O ZINC001140179084 1131673516 /nfs/dbraw/zinc/67/35/16/1131673516.db2.gz GPNDNQOCDSCIRY-QGZVFWFLSA-N 1 0 297.398 3.662 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2CC[C@H]2C2CCC2)c1 ZINC000845972184 1131673933 /nfs/dbraw/zinc/67/39/33/1131673933.db2.gz PILSNVXCPIQLEL-PJODQICGSA-N 1 0 275.392 3.630 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2CC[C@@H]2C2CCC2)c1 ZINC000845972182 1131674198 /nfs/dbraw/zinc/67/41/98/1131674198.db2.gz PILSNVXCPIQLEL-PEYYIBSZSA-N 1 0 275.392 3.630 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCC[C@@H]3CCC[C@H]32)c1O ZINC001140182552 1131674456 /nfs/dbraw/zinc/67/44/56/1131674456.db2.gz VDNOVTYOURTYFE-GOEBONIOSA-N 1 0 259.393 3.774 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CC=C(C)CC2)c1 ZINC000845973080 1131675014 /nfs/dbraw/zinc/67/50/14/1131675014.db2.gz WVUYISUIVBIQNV-CHWSQXEVSA-N 1 0 261.365 3.550 20 10 CHCDRO C[C@@H]1CCCC[C@H]1OCC[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000834522360 1131681213 /nfs/dbraw/zinc/68/12/13/1131681213.db2.gz AOKDFOJHLCEYBX-FRFSOERESA-N 1 0 289.419 3.564 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)[C@@](C)(O)c1ccccc1)c1ccccc1O ZINC000846044037 1131683648 /nfs/dbraw/zinc/68/36/48/1131683648.db2.gz NKUKJLGRTLLUSH-DKSSEZFCSA-N 1 0 299.414 3.729 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(F)ccc1O)c1ccccc1F ZINC000846045827 1131683965 /nfs/dbraw/zinc/68/39/65/1131683965.db2.gz RVQODMYVXZSAKK-HNNXBMFYSA-N 1 0 277.314 3.911 20 10 CHCDRO CC1=CC[C@@H]([NH2+]Cc2cc(Cl)ccc2O)CC1 ZINC000846055781 1131685821 /nfs/dbraw/zinc/68/58/21/1131685821.db2.gz NSKZBBLNXSRKHT-CYBMUJFWSA-N 1 0 251.757 3.634 20 10 CHCDRO CC[C@H]([NH2+]CCCSc1nccs1)c1ccncc1 ZINC000834595248 1131686490 /nfs/dbraw/zinc/68/64/90/1131686490.db2.gz WMHXLBJYZHBAGM-ZDUSSCGKSA-N 1 0 293.461 3.761 20 10 CHCDRO CCCc1cccc(C[NH2+]Cc2ccc(OC)cc2O)c1 ZINC000793387984 1131689635 /nfs/dbraw/zinc/68/96/35/1131689635.db2.gz DGGCSWYCAGYHJP-UHFFFAOYSA-N 1 0 285.387 3.643 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1cccc(OC)c1O)c1ccncc1 ZINC000846148605 1131691250 /nfs/dbraw/zinc/69/12/50/1131691250.db2.gz RQLGMIHBHIXEOG-IUODEOHRSA-N 1 0 286.375 3.598 20 10 CHCDRO CCO[C@@H](CC[NH2+][C@H](C)c1cccc(OC)c1O)C(C)C ZINC000846149190 1131691373 /nfs/dbraw/zinc/69/13/73/1131691373.db2.gz WXDQKIDUPITUKX-HIFRSBDPSA-N 1 0 295.423 3.503 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@@H]2CCCC2(C)C)c1O ZINC000846150505 1131692037 /nfs/dbraw/zinc/69/20/37/1131692037.db2.gz QNMHIUQBISUAEB-BXUZGUMPSA-N 1 0 263.381 3.630 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H]2CC[C@H](C)CC2)c1O ZINC000846150445 1131692388 /nfs/dbraw/zinc/69/23/88/1131692388.db2.gz HNJYBMFKQJQPRH-AVGNSLFASA-N 1 0 263.381 3.630 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@H]2CCCC(F)(F)C2)c1O ZINC000846157003 1131692406 /nfs/dbraw/zinc/69/24/06/1131692406.db2.gz RISDDHMSSRJNIS-MNOVXSKESA-N 1 0 285.334 3.629 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]C[C@@H](C)CC(F)(F)F)c1O ZINC000846172337 1131694095 /nfs/dbraw/zinc/69/40/95/1131694095.db2.gz LGFNNNKDFPIJRO-UWVGGRQHSA-N 1 0 291.313 3.640 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C2(C3CCC3)CC2)c(O)c1C ZINC000846206571 1131695588 /nfs/dbraw/zinc/69/55/88/1131695588.db2.gz FNUJGDWTLKVXFE-ZDUSSCGKSA-N 1 0 259.393 3.992 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)COCC1CC1)c1cc(Cl)ccc1O ZINC000846205529 1131695625 /nfs/dbraw/zinc/69/56/25/1131695625.db2.gz QFGJIBWYSSIKHO-IAQYHMDHSA-N 1 0 297.826 3.901 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+]CCC2(CO)CCC2)c1O ZINC000846211094 1131695946 /nfs/dbraw/zinc/69/59/46/1131695946.db2.gz SDVNJBSMTQWRDA-LBPRGKRZSA-N 1 0 297.826 3.557 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H](C)COCC2CC2)c1O ZINC000846205825 1131696066 /nfs/dbraw/zinc/69/60/66/1131696066.db2.gz UHRDEJMCPIAMKY-NWDGAFQWSA-N 1 0 297.826 3.820 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H](C2CC2)C2CCOCC2)c(O)c1 ZINC000846185472 1131697525 /nfs/dbraw/zinc/69/75/25/1131697525.db2.gz AERNYZFWRFXFRN-FZKQIMNGSA-N 1 0 289.419 3.556 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)COCC1CC1)c1cc(Cl)ccc1O ZINC000846204003 1131699374 /nfs/dbraw/zinc/69/93/74/1131699374.db2.gz JLQRXHLACZNORV-WDEREUQCSA-N 1 0 283.799 3.511 20 10 CHCDRO C[C@H](COCC1CC1)[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000846203996 1131699391 /nfs/dbraw/zinc/69/93/91/1131699391.db2.gz JLQRXHLACZNORV-GHMZBOCLSA-N 1 0 283.799 3.511 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)COCC1CC1)c1ccc(Cl)cc1O ZINC000846203776 1131699810 /nfs/dbraw/zinc/69/98/10/1131699810.db2.gz BDCYZPKMHMFSAV-WDEREUQCSA-N 1 0 283.799 3.511 20 10 CHCDRO CCC[C@@H](C[NH2+][C@@H](C)c1cc(Cl)ccc1O)OC ZINC000834841759 1131711282 /nfs/dbraw/zinc/71/12/82/1131711282.db2.gz ZVCAVGAIRICZDC-JQWIXIFHSA-N 1 0 271.788 3.511 20 10 CHCDRO Cc1cc(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)ccn1 ZINC000834859567 1131713377 /nfs/dbraw/zinc/71/33/77/1131713377.db2.gz DJLUSZGUABJCJP-IINYFYTJSA-N 1 0 286.350 3.573 20 10 CHCDRO CC[C@@](C)(C[NH2+][C@H](C)c1cc(Cl)cc(C)c1O)OC ZINC000834882547 1131716600 /nfs/dbraw/zinc/71/66/00/1131716600.db2.gz ROUOEGHWQHFCSU-ABAIWWIYSA-N 1 0 285.815 3.820 20 10 CHCDRO CC[C@@H]([NH2+]C[C@](C)(CC)OC)c1ccc(N(C)C)cc1 ZINC000834881957 1131717022 /nfs/dbraw/zinc/71/70/22/1131717022.db2.gz GVQKYSZTDJMOFO-SJORKVTESA-N 1 0 278.440 3.608 20 10 CHCDRO C[C@H]([NH2+]C[C@@]1(C)CC1(Cl)Cl)c1cc(F)ccc1O ZINC000834884573 1131717866 /nfs/dbraw/zinc/71/78/66/1131717866.db2.gz NQLDLTILOOTYFF-QPUJVOFHSA-N 1 0 292.181 3.766 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCCC[C@H]1O)c1ccc2ccccc2c1O ZINC000834901355 1131724926 /nfs/dbraw/zinc/72/49/26/1131724926.db2.gz SOOSBFKSEJGCJB-QIIPPGSGSA-N 1 0 299.414 3.747 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)[C@@H](OC)C1CC1)c1ccc(C)cc1O ZINC000834901924 1131725488 /nfs/dbraw/zinc/72/54/88/1131725488.db2.gz BSFOUGOWXTXEIJ-YLQAJVPDSA-N 1 0 277.408 3.555 20 10 CHCDRO CC[C@@H]([NH2+]CC(C)(C)C(C)(C)O)c1ccc(N(C)C)cc1 ZINC000834904604 1131727182 /nfs/dbraw/zinc/72/71/82/1131727182.db2.gz ZRPMMWDULKVXAN-MRXNPFEDSA-N 1 0 292.467 3.590 20 10 CHCDRO CCO[C@@H]1CCC[C@H]1[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000834914827 1131733607 /nfs/dbraw/zinc/73/36/07/1131733607.db2.gz WRJBXAFMAFJKPM-XTWPYSKKSA-N 1 0 293.382 3.627 20 10 CHCDRO Oc1cc(Cl)ccc1C[N@H+]1C[C@H]2CC[C@@H](C1)C2(F)F ZINC001140462244 1131748582 /nfs/dbraw/zinc/74/85/82/1131748582.db2.gz BWBLGFZBEVBREQ-PHIMTYICSA-N 1 0 287.737 3.523 20 10 CHCDRO CN(C)c1ccc(/C=C\C[N@H+](C)Cc2ccccc2O)cc1 ZINC000835024729 1131759510 /nfs/dbraw/zinc/75/95/10/1131759510.db2.gz BVEZSCZGUONWTB-SREVYHEPSA-N 1 0 296.414 3.603 20 10 CHCDRO C[C@@H](C[NH2+]C/C=C\c1ccc(N(C)C)cc1)c1ccncc1 ZINC000835043902 1131762937 /nfs/dbraw/zinc/76/29/37/1131762937.db2.gz VTIGGJCHXKKWDS-AWFCHZOYSA-N 1 0 295.430 3.554 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]CCC2(F)CCC2)cc1 ZINC000835054184 1131767054 /nfs/dbraw/zinc/76/70/54/1131767054.db2.gz RZIPLVMDNUYQTE-HYXAFXHYSA-N 1 0 276.399 3.638 20 10 CHCDRO CC1(C)C[C@H](C[NH2+]Cc2ccc3ccccc3c2O)CCO1 ZINC000835061418 1131767900 /nfs/dbraw/zinc/76/79/00/1131767900.db2.gz ZEBHSUBDGHQHEP-CQSZACIVSA-N 1 0 299.414 3.840 20 10 CHCDRO CCC(C)(C)OCC[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC000835085515 1131770896 /nfs/dbraw/zinc/77/08/96/1131770896.db2.gz WFXFBSAZJSGXCF-BQYQJAHWSA-N 1 0 290.451 3.561 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(OC)c(C)c1)[C@@H]1CC1(C)C ZINC001171285458 1131799240 /nfs/dbraw/zinc/79/92/40/1131799240.db2.gz AHICEYKJNGFTLC-GJZGRUSLSA-N 1 0 261.409 3.918 20 10 CHCDRO C[N@@H+]1CC[C@H](Oc2ccccc2NN=C2C=CC=CC2=O)C1 ZINC001228420289 1131879921 /nfs/dbraw/zinc/87/99/21/1131879921.db2.gz UIFTVWMMZMANHM-HVCBDAARSA-N 1 0 297.358 3.891 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)c(C)c1 ZINC000773051588 1131931351 /nfs/dbraw/zinc/93/13/51/1131931351.db2.gz KRWDIKFXYWQUGS-OAHLLOKOSA-N 1 0 298.430 3.920 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CO)CC(C)(C)C)c1ccc(N(C)C)cc1 ZINC000773076936 1131937069 /nfs/dbraw/zinc/93/70/69/1131937069.db2.gz PJEJCDHRNYVWOK-NVXWUHKLSA-N 1 0 292.467 3.590 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2cccc(F)n2)cc1 ZINC000773096013 1131944411 /nfs/dbraw/zinc/94/44/11/1131944411.db2.gz NJGMABCTZWXJTN-CYBMUJFWSA-N 1 0 287.382 3.528 20 10 CHCDRO CN(C)c1ccc(C[NH+]2C[C@@H]3CCC[C@H]3C2)c(Cl)c1 ZINC001140921898 1131964098 /nfs/dbraw/zinc/96/40/98/1131964098.db2.gz VCOHZFGNAVTAFS-STQMWFEESA-N 1 0 278.827 3.638 20 10 CHCDRO Cc1ccc(C[N@@H+]2CC[C@H](c3ccccc3)C2)c(O)c1 ZINC001140947986 1131969709 /nfs/dbraw/zinc/96/97/09/1131969709.db2.gz OKFVHVPMWVQRPC-INIZCTEOSA-N 1 0 267.372 3.690 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)Cc2ccco2)c(O)c1 ZINC000036993358 1131986297 /nfs/dbraw/zinc/98/62/97/1131986297.db2.gz MAGZFBCGIFBTTF-CHWSQXEVSA-N 1 0 259.349 3.575 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)c1ccc(N(C)C)cc1)c1ccns1 ZINC000715897693 1131994596 /nfs/dbraw/zinc/99/45/96/1131994596.db2.gz DAFCMDSWWVZZIF-VXGBXAGGSA-N 1 0 275.421 3.621 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1ccns1)c1ccccc1O ZINC000715968422 1132000832 /nfs/dbraw/zinc/00/08/32/1132000832.db2.gz VKPYEYKNWFLKFY-JQWIXIFHSA-N 1 0 262.378 3.651 20 10 CHCDRO Oc1ccc(O)c(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)c1 ZINC001141156601 1132029044 /nfs/dbraw/zinc/02/90/44/1132029044.db2.gz OIDZIKCGVWAMDJ-INIZCTEOSA-N 1 0 287.334 3.574 20 10 CHCDRO CC[N@H+](Cc1ccc(Cl)cc1)Cc1cc(O)ccc1O ZINC001141160803 1132030652 /nfs/dbraw/zinc/03/06/52/1132030652.db2.gz JDEPUWHAUWJSME-UHFFFAOYSA-N 1 0 291.778 3.773 20 10 CHCDRO Oc1ccc(O)c(C[N@H+](Cc2ccccc2)C2CCC2)c1 ZINC001141162373 1132031728 /nfs/dbraw/zinc/03/17/28/1132031728.db2.gz RHEYHIUCOKRWGA-UHFFFAOYSA-N 1 0 283.371 3.653 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H]2CCc3c(C)cccc3C2)c1O ZINC001171559781 1132055305 /nfs/dbraw/zinc/05/53/05/1132055305.db2.gz MYNIJVSBTVNENK-QGZVFWFLSA-N 1 0 281.399 3.656 20 10 CHCDRO Cc1ccc(CC[C@H](C)[NH2+]Cc2ccc(O)c(O)c2)cc1 ZINC001171660712 1132070110 /nfs/dbraw/zinc/07/01/10/1132070110.db2.gz OWVHJPNUIJOTDC-AWEZNQCLSA-N 1 0 285.387 3.517 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]C2(C3CCC3)CCC2)c1 ZINC000839186973 1132188234 /nfs/dbraw/zinc/18/82/34/1132188234.db2.gz RDRPPGDHLOFULT-LBPRGKRZSA-N 1 0 275.392 3.774 20 10 CHCDRO CO[C@H]1C[C@H]([NH2+]Cc2ccc3ccccc3c2O)C12CCC2 ZINC000839180775 1132188784 /nfs/dbraw/zinc/18/87/84/1132188784.db2.gz WRGXFFLBOFCVAZ-IRXDYDNUSA-N 1 0 297.398 3.593 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+][C@H]2CCC[C@@H]3C[C@@H]32)cc1 ZINC000839190608 1132189512 /nfs/dbraw/zinc/18/95/12/1132189512.db2.gz INGQBXQFWBVIHN-RPBGNJHWSA-N 1 0 270.420 3.544 20 10 CHCDRO Cc1cccc(CNc2ccc(C[NH+](C)C)c(C)c2)c1O ZINC000839188981 1132190037 /nfs/dbraw/zinc/19/00/37/1132190037.db2.gz OBDABGCKLGEATK-UHFFFAOYSA-N 1 0 284.403 3.683 20 10 CHCDRO Cc1cc(C)c(C[NH2+][C@@H]2CC[C@H](C)[C@H](C)C2)c(O)c1 ZINC001172368495 1132192745 /nfs/dbraw/zinc/19/27/45/1132192745.db2.gz PFELYSXSEYBARQ-GZBFAFLISA-N 1 0 261.409 3.923 20 10 CHCDRO CC(C)OCC[C@@H](C)[NH2+]Cc1cc2ccccc2cc1O ZINC001172439563 1132233305 /nfs/dbraw/zinc/23/33/05/1132233305.db2.gz BSBKYEWDPRKMCP-CQSZACIVSA-N 1 0 287.403 3.839 20 10 CHCDRO CO[C@H]1CC[N@H+](Cc2cc(C(C)C)c(C)cc2O)C[C@@H]1C ZINC000840127116 1132248062 /nfs/dbraw/zinc/24/80/62/1132248062.db2.gz RLPJDUTWEWZWHZ-KSSFIOAISA-N 1 0 291.435 3.681 20 10 CHCDRO CC[C@H]([NH2+]CCCSc1nccs1)[C@H]1C[C@H]1C ZINC000840720958 1132277340 /nfs/dbraw/zinc/27/73/40/1132277340.db2.gz BENSIGSOPMAWIN-WOPDTQHZSA-N 1 0 270.467 3.650 20 10 CHCDRO CC(C)O[C@H]1C[C@@H]([NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)C1 ZINC000840764140 1132283319 /nfs/dbraw/zinc/28/33/19/1132283319.db2.gz NMIJCNAAHVGEJC-NMKXLXIOSA-N 1 0 293.382 3.625 20 10 CHCDRO CO[C@H]1c2ccccc2C[C@H]1[NH2+][C@H](C)c1ccc(C)cc1O ZINC000840847416 1132293099 /nfs/dbraw/zinc/29/30/99/1132293099.db2.gz NGCMSZCYEJFCSS-XVSDVWIESA-N 1 0 297.398 3.664 20 10 CHCDRO CO[C@@](C)([C@@H](C)[NH2+][C@H](C)c1ccc(C)cc1O)C1CC1 ZINC000840859519 1132295295 /nfs/dbraw/zinc/29/52/95/1132295295.db2.gz MYFGNKCVMOHHKV-XNJGSVPQSA-N 1 0 277.408 3.555 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)CS1 ZINC000840860660 1132296015 /nfs/dbraw/zinc/29/60/15/1132296015.db2.gz VIIDBWXKGOGSER-MWGHHZFTSA-N 1 0 281.396 3.563 20 10 CHCDRO CO[C@@](C)([C@H](C)[NH2+][C@@H](C)c1ccc(C)cc1O)C1CC1 ZINC000840859517 1132296309 /nfs/dbraw/zinc/29/63/09/1132296309.db2.gz MYFGNKCVMOHHKV-DCGLDWPTSA-N 1 0 277.408 3.555 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)CS1 ZINC000840860662 1132296597 /nfs/dbraw/zinc/29/65/97/1132296597.db2.gz VIIDBWXKGOGSER-SVDPJWKOSA-N 1 0 281.396 3.563 20 10 CHCDRO CO[C@@](C)([C@H](C)[NH2+][C@H](C)c1ccc(N(C)C)cc1)C1CC1 ZINC000840861368 1132297030 /nfs/dbraw/zinc/29/70/30/1132297030.db2.gz VGHFJGGGKDGDEN-GLJUWKHASA-N 1 0 290.451 3.607 20 10 CHCDRO Oc1cccc2c1C[N@@H+]([C@@H]1Cc3ccc(Cl)cc3C1)CC2 ZINC001172726461 1132300114 /nfs/dbraw/zinc/30/01/14/1132300114.db2.gz WNVGSWFDVPSCKJ-MRXNPFEDSA-N 1 0 299.801 3.571 20 10 CHCDRO COCC1CCC([NH2+][C@H](C)c2ccc(C)c(C)c2O)CC1 ZINC000840882420 1132302141 /nfs/dbraw/zinc/30/21/41/1132302141.db2.gz VLBREYAHQRFQKH-QQFBHYJXSA-N 1 0 291.435 3.865 20 10 CHCDRO Cc1ccc(O)c(CNc2ccc(C[NH+](C)C)cc2F)c1 ZINC000840957521 1132313346 /nfs/dbraw/zinc/31/33/46/1132313346.db2.gz IUZNFCDXALTYJE-UHFFFAOYSA-N 1 0 288.366 3.513 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCSC3(CCC3)CC2)c1 ZINC000840955424 1132314304 /nfs/dbraw/zinc/31/43/04/1132314304.db2.gz WAWISCHVVHYLOB-UHFFFAOYSA-N 1 0 277.433 3.562 20 10 CHCDRO CCOc1ccc(C[N@H+](CC)Cc2occc2C)c(O)c1 ZINC000840970979 1132314799 /nfs/dbraw/zinc/31/47/99/1132314799.db2.gz YTNQZVZYMSIAMW-UHFFFAOYSA-N 1 0 289.375 3.714 20 10 CHCDRO C[C@H]1C[N@H+](Cc2c(O)ccc3ccccc32)CCC[C@]1(C)O ZINC001231586957 1132318939 /nfs/dbraw/zinc/31/89/39/1132318939.db2.gz NTLNOTIRAQHSDX-LIRRHRJNSA-N 1 0 299.414 3.528 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2c(O)ccc3ccccc32)CC[C@@]1(C)O ZINC001231587452 1132319662 /nfs/dbraw/zinc/31/96/62/1132319662.db2.gz CLLFOENVRJMTDX-AUUYWEPGSA-N 1 0 299.414 3.528 20 10 CHCDRO C[C@H]([NH3+])c1ccc(NC/C=C/c2ccc(N(C)C)cc2)cc1 ZINC000841031035 1132321093 /nfs/dbraw/zinc/32/10/93/1132321093.db2.gz OAJDXRJAYUJXLY-RGDDUWESSA-N 1 0 295.430 3.898 20 10 CHCDRO C[C@H]1C[N@H+](Cc2c(O)ccc3ccccc32)C2(CC2)C1 ZINC001231591248 1132321405 /nfs/dbraw/zinc/32/14/05/1132321405.db2.gz ZOXNHLOJIUJGHI-CYBMUJFWSA-N 1 0 267.372 3.920 20 10 CHCDRO C[C@H]1CC(C)(C)CC[C@@H]1[NH2+]CCc1ccc(N)cc1 ZINC000841033859 1132322091 /nfs/dbraw/zinc/32/20/91/1132322091.db2.gz CKEZWLVZQALQFX-BBRMVZONSA-N 1 0 260.425 3.616 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCCC(F)(F)CC2)c(O)c1 ZINC001231842888 1132376031 /nfs/dbraw/zinc/37/60/31/1132376031.db2.gz QCRJJLBYHPHTNT-UHFFFAOYSA-N 1 0 269.335 3.630 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCC[C@H]2c2cccnc2)c(O)c1 ZINC001231842986 1132376617 /nfs/dbraw/zinc/37/66/17/1132376617.db2.gz RFBNLABDPSBSBZ-KRWDZBQOSA-N 1 0 282.387 3.741 20 10 CHCDRO Cc1cc(C)c(C[N@H+]2CCC[C@H](C)[C@H](C)C2)c(O)c1 ZINC001231842454 1132377538 /nfs/dbraw/zinc/37/75/38/1132377538.db2.gz MKDSJJPWFXFLNU-DZGCQCFKSA-N 1 0 261.409 3.877 20 10 CHCDRO COc1cc(N(C)C)ccc1CN1Cc2cccc(C)c2C1 ZINC001231848021 1132377996 /nfs/dbraw/zinc/37/79/96/1132377996.db2.gz DRUPDOQTUNKLJC-UHFFFAOYSA-N 1 0 296.414 3.585 20 10 CHCDRO Cc1ccc(CC[N@@H+](C)Cc2c(C)cc(C)cc2O)cc1 ZINC001231847455 1132378992 /nfs/dbraw/zinc/37/89/92/1132378992.db2.gz YNTHHZLJGYKNIX-UHFFFAOYSA-N 1 0 283.415 3.992 20 10 CHCDRO COCCCC[N@H+](C)Cc1cc(C(C)C)c(C)cc1O ZINC000841691695 1132384966 /nfs/dbraw/zinc/38/49/66/1132384966.db2.gz RPHHOIHOOZQMGS-UHFFFAOYSA-N 1 0 279.424 3.682 20 10 CHCDRO C[C@H]([NH2+]CCC(F)(F)F)c1ccc(Cl)cc1O ZINC000841756983 1132393907 /nfs/dbraw/zinc/39/39/07/1132393907.db2.gz DISQXSDMPRUNMW-ZETCQYMHSA-N 1 0 267.678 3.649 20 10 CHCDRO Cc1ccc(CC[NH2+][C@H](C)c2ccc(Cl)cc2O)o1 ZINC000841743503 1132387254 /nfs/dbraw/zinc/38/72/54/1132387254.db2.gz AGJOVDLIKNUWBA-LLVKDONJSA-N 1 0 279.767 3.840 20 10 CHCDRO C[C@@H]([NH2+]CCN(C)C1CCCC1)c1ccc(Cl)cc1O ZINC000841747766 1132389557 /nfs/dbraw/zinc/38/95/57/1132389557.db2.gz SKIPVKNTXWLHCD-GFCCVEGCSA-N 1 0 296.842 3.571 20 10 CHCDRO COCC[C@@H]1CCCC[N@@H+]1Cc1ccc2ccccc2c1O ZINC001231881745 1132390173 /nfs/dbraw/zinc/39/01/73/1132390173.db2.gz HUXAVQQXMOLTRZ-KRWDZBQOSA-N 1 0 299.414 3.936 20 10 CHCDRO COC(C)(C)[C@@H]1CCC[N@@H+]1Cc1ccc2ccccc2c1O ZINC001231883122 1132390920 /nfs/dbraw/zinc/39/09/20/1132390920.db2.gz YQLATMWROJIXPO-KRWDZBQOSA-N 1 0 299.414 3.935 20 10 CHCDRO COC1([C@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2O)CCC1 ZINC000841755869 1132392000 /nfs/dbraw/zinc/39/20/00/1132392000.db2.gz MXMJHJIXPOTCIG-MNOVXSKESA-N 1 0 283.799 3.654 20 10 CHCDRO CCc1noc(C)c1C[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841757148 1132393234 /nfs/dbraw/zinc/39/32/34/1132393234.db2.gz MNARASLPASCGBO-SECBINFHSA-N 1 0 294.782 3.755 20 10 CHCDRO C[C@H]([NH2+]CCNc1ccccc1)c1ccc(Cl)cc1O ZINC000841757183 1132395096 /nfs/dbraw/zinc/39/50/96/1132395096.db2.gz FQVZXJGCFZCHSW-LBPRGKRZSA-N 1 0 290.794 3.808 20 10 CHCDRO C[C@H]([NH2+][C@H]1COCc2ccccc21)c1ccc(N(C)C)cc1 ZINC000841762358 1132396731 /nfs/dbraw/zinc/39/67/31/1132396731.db2.gz WNLZVJPYKYALCN-LIRRHRJNSA-N 1 0 296.414 3.675 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CCCCC[C@H]2C)cc1Cl ZINC001232264054 1132445047 /nfs/dbraw/zinc/44/50/47/1132445047.db2.gz DPFLEONZJDKBBX-LLVKDONJSA-N 1 0 283.799 3.819 20 10 CHCDRO CCC1CC[NH+](Cc2cc(Cl)c(OC)cc2O)CC1 ZINC001232266408 1132446277 /nfs/dbraw/zinc/44/62/77/1132446277.db2.gz NQRUXTIDFFEYOU-UHFFFAOYSA-N 1 0 283.799 3.676 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CCCC[C@H](C)C2)cc1Cl ZINC001232266213 1132446329 /nfs/dbraw/zinc/44/63/29/1132446329.db2.gz KNPSUARFZRQZRS-NSHDSACASA-N 1 0 283.799 3.676 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2CCS[C@@H]2C)c(O)c1 ZINC000842930947 1132478199 /nfs/dbraw/zinc/47/81/99/1132478199.db2.gz ZJZCTGSULKEBKM-YNEHKIRRSA-N 1 0 265.422 3.554 20 10 CHCDRO CC(C)[C@@H]1COCC[N@@H+]1Cc1cccc(C(C)(C)C)c1O ZINC001143111568 1132503334 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CO[C@@H]1CCC[N@H+](Cc2cc(C(C)(C)C)ccc2O)CC1 ZINC001233286427 1132595389 /nfs/dbraw/zinc/59/53/89/1132595389.db2.gz UAVFJLAGOQPRSM-MRXNPFEDSA-N 1 0 291.435 3.691 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2c(O)cccc2Cl)[C@H](C)C1 ZINC000133736489 1132604275 /nfs/dbraw/zinc/60/42/75/1132604275.db2.gz SGLNQFCQLWLWRT-GHMZBOCLSA-N 1 0 253.773 3.666 20 10 CHCDRO Oc1cc(C(F)(F)F)ccc1C[N@@H+]1CCCCC12CC2 ZINC001233454837 1132626506 /nfs/dbraw/zinc/62/65/06/1132626506.db2.gz LQBPUZOXQOWWMC-UHFFFAOYSA-N 1 0 285.309 3.930 20 10 CHCDRO CC1(C)CCC[N@@H+]1Cc1cccc(OC(F)(F)F)c1O ZINC001233726241 1132670542 /nfs/dbraw/zinc/67/05/42/1132670542.db2.gz BCTLHJSXHNTPCM-UHFFFAOYSA-N 1 0 289.297 3.665 20 10 CHCDRO Cc1cc2[nH]ccc2c(N(C)Cc2ccc(N(C)C)cc2)[nH+]1 ZINC001156920377 1132714802 /nfs/dbraw/zinc/71/48/02/1132714802.db2.gz BDFUDSCIOIUHQC-UHFFFAOYSA-N 1 0 294.402 3.574 20 10 CHCDRO CN(C)c1cccc(NCc2cc3ccccc3cc2O)[nH+]1 ZINC001160207181 1132945570 /nfs/dbraw/zinc/94/55/70/1132945570.db2.gz SPZYIYIIBOXOLC-UHFFFAOYSA-N 1 0 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COc1ccc(O)c(C[N@@H+]2CCc3cc(C)cc(C)c3C2)c1 ZINC001207862409 1133855461 /nfs/dbraw/zinc/85/54/61/1133855461.db2.gz XTAOPJHQCRPODQ-UHFFFAOYSA-N 1 0 297.398 3.576 20 10 CHCDRO CCOC(C)(C)C[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001209075560 1133972010 /nfs/dbraw/zinc/97/20/10/1133972010.db2.gz SPHQLZPKKGCSRF-UHFFFAOYSA-N 1 0 290.451 3.534 20 10 CHCDRO Cc1cccc2c(C[N@@H+]3CCc4cccc(O)c4C3)c[nH]c21 ZINC001209494413 1134030969 /nfs/dbraw/zinc/03/09/69/1134030969.db2.gz PVCQJODOKQMZSC-UHFFFAOYSA-N 1 0 292.382 3.740 20 10 CHCDRO C[N@H+](Cc1ccc2cc[nH]c2c1)Cc1ccccc1O ZINC001209515633 1134031840 /nfs/dbraw/zinc/03/18/40/1134031840.db2.gz XYWBYTYLEVSXBH-UHFFFAOYSA-N 1 0 266.344 3.506 20 10 CHCDRO CO[C@H](C)C1C[NH+](Cc2ccc(-n3c(C)ccc3C)cc2)C1 ZINC001209520248 1134034972 /nfs/dbraw/zinc/03/49/72/1134034972.db2.gz SFDUZXKTGUZVLV-MRXNPFEDSA-N 1 0 298.430 3.561 20 10 CHCDRO COc1ccc(C[NH2+]C2C[C@H]3CC[C@@H](C2)S3)cc1C ZINC000403534013 1134794808 /nfs/dbraw/zinc/79/48/08/1134794808.db2.gz ZKTOKMIPIPKQND-GOOCMWNKSA-N 1 0 277.433 3.520 20 10 CHCDRO F[C@H]1C[NH2+]C[C@@H]1Oc1ccc(/N=N/c2ccccc2)cc1 ZINC001218018698 1135043027 /nfs/dbraw/zinc/04/30/27/1135043027.db2.gz DAABMQYNNZTPFH-VHJGWARJSA-N 1 0 285.322 3.791 20 10 CHCDRO C[C@@H]1C[C@@H](Oc2ccccc2NN=C2C=CC=CC2=O)C[NH2+]1 ZINC001218038021 1135047988 /nfs/dbraw/zinc/04/79/88/1135047988.db2.gz XEEGFZZSPCPMHV-LKAPKGCMSA-N 1 0 297.358 3.937 20 10 CHCDRO CCC[C@@H](Oc1ccc(N2CC[NH2+]CC2)cc1)[C@H](C)CC ZINC001218290761 1135078660 /nfs/dbraw/zinc/07/86/60/1135078660.db2.gz CKXWFERNXVNGFM-CRAIPNDOSA-N 1 0 290.451 3.690 20 10 CHCDRO CCCC/C=C/[C@H](C)Oc1ccc(N2CC[NH2+]CC2)cc1 ZINC001218354741 1135093431 /nfs/dbraw/zinc/09/34/31/1135093431.db2.gz IRYHNQDDZOTCCC-MOEXGYKKSA-N 1 0 288.435 3.610 20 10 CHCDRO Cc1ccoc1C[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C ZINC000312869631 1135135558 /nfs/dbraw/zinc/13/55/58/1135135558.db2.gz UAMXUMWBHZQOBI-QWHCGFSZSA-N 1 0 271.360 3.940 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C2(C)CC(F)(F)C2)cc1 ZINC000720902551 1135426018 /nfs/dbraw/zinc/42/60/18/1135426018.db2.gz YCGGQSKBCCBQEQ-UHFFFAOYSA-N 1 0 282.378 3.810 20 10 CHCDRO C[C@@H]1CCCC[C@@H]1[NH2+]Cc1cc(Cl)ccc1O ZINC000019945606 170936480 /nfs/dbraw/zinc/93/64/80/170936480.db2.gz BERIKPHJWPKXJG-MFKMUULPSA-N 1 0 253.773 3.714 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H](C)c1ccccn1 ZINC000020123637 171004574 /nfs/dbraw/zinc/00/45/74/171004574.db2.gz VJCKLPAXBOICMR-IPYPFGDCSA-N 1 0 282.387 3.995 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCCc2occc21)c1ccccc1O ZINC000020204262 171069725 /nfs/dbraw/zinc/06/97/25/171069725.db2.gz YTLCKFNSHLBJDU-FZMZJTMJSA-N 1 0 257.333 3.713 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2cccnc2)c1 ZINC000035628820 172308148 /nfs/dbraw/zinc/30/81/48/172308148.db2.gz ZJIXYQGASNQNNS-STQMWFEESA-N 1 0 256.349 3.507 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2ccccn2)c1 ZINC000035628781 172308454 /nfs/dbraw/zinc/30/84/54/172308454.db2.gz JIVMJJFNBNQFQW-CHWSQXEVSA-N 1 0 256.349 3.507 20 10 CHCDRO C[C@H]([NH2+]CC1CCCCC1)c1ccc(N(C)C)cc1 ZINC000037255178 173066111 /nfs/dbraw/zinc/06/61/11/173066111.db2.gz OKXRATHNDRGMJH-AWEZNQCLSA-N 1 0 260.425 3.984 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(F)cc2)c1 ZINC000035628665 260030721 /nfs/dbraw/zinc/03/07/21/260030721.db2.gz JZAXHKDWNMYKLL-GFCCVEGCSA-N 1 0 259.324 3.691 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(F)cc2)c1 ZINC000035628666 260030729 /nfs/dbraw/zinc/03/07/29/260030729.db2.gz JZAXHKDWNMYKLL-LBPRGKRZSA-N 1 0 259.324 3.691 20 10 CHCDRO C[C@H]([NH2+]Cc1ccccc1O)c1cccc(OC(F)F)c1 ZINC000036935075 260053836 /nfs/dbraw/zinc/05/38/36/260053836.db2.gz CYXOSNWYTHFQGO-NSHDSACASA-N 1 0 293.313 3.844 20 10 CHCDRO COCC[C@H](C)[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000152694416 261068372 /nfs/dbraw/zinc/06/83/72/261068372.db2.gz UFZALAKKLDFOJL-JKSUJKDBSA-N 1 0 290.451 3.753 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C2(c3cccc(F)c3)CC2)c1 ZINC000152861803 261070829 /nfs/dbraw/zinc/07/08/29/261070829.db2.gz BETOWXIXYWKCLY-UHFFFAOYSA-N 1 0 271.335 3.619 20 10 CHCDRO COc1cccc(C[N@@H+]2CCC[C@H]2c2ccsc2)c1O ZINC000153552188 261080410 /nfs/dbraw/zinc/08/04/10/261080410.db2.gz NOLKLKGXDRVZDL-AWEZNQCLSA-N 1 0 289.400 3.799 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](OC)c1ccccc1)c1ccccc1O ZINC000155259355 261100101 /nfs/dbraw/zinc/10/01/01/261100101.db2.gz XFVTUFBZVOBTMR-AEFFLSMTSA-N 1 0 285.387 3.821 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)CC(C)(C)OC)c1ccccc1O ZINC000156052485 261112464 /nfs/dbraw/zinc/11/24/64/261112464.db2.gz SMOLYRDZQXHDDK-GXTWGEPZSA-N 1 0 265.397 3.637 20 10 CHCDRO CC[C@H]([NH2+][C@@H](COC)c1ccccc1)c1ccccc1O ZINC000156573279 261126322 /nfs/dbraw/zinc/12/63/22/261126322.db2.gz VCSHDHHASOZJRR-IRXDYDNUSA-N 1 0 285.387 3.821 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](COC)c1ccccc1)c1ccccc1O ZINC000156573392 261126489 /nfs/dbraw/zinc/12/64/89/261126489.db2.gz VCSHDHHASOZJRR-SJORKVTESA-N 1 0 285.387 3.821 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCO[C@H](C2CC2)C1)c1cc(Cl)ccc1O ZINC000157884522 261155071 /nfs/dbraw/zinc/15/50/71/261155071.db2.gz YIJYIBHAKFQSRF-NKFCBESUSA-N 1 0 295.810 3.654 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCO[C@H](c2ccccc2)C1)c1ccccc1O ZINC000158169251 261159832 /nfs/dbraw/zinc/15/98/32/261159832.db2.gz OYSGCKZZGIGBKB-QOKNQOGYSA-N 1 0 297.398 3.963 20 10 CHCDRO COCCCC[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000158312629 261163230 /nfs/dbraw/zinc/16/32/30/261163230.db2.gz YBWVMBGXMFIBEF-INIZCTEOSA-N 1 0 290.451 3.754 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1cccnc1)c1ccc(N(C)C)cc1 ZINC000158521738 261166657 /nfs/dbraw/zinc/16/66/57/261166657.db2.gz MDNDANHTOKLQGS-KDOFPFPSSA-N 1 0 283.419 3.950 20 10 CHCDRO COc1cc(Cl)cc(C[N@H+](C)[C@H](C)c2ccco2)c1O ZINC000184679048 262026171 /nfs/dbraw/zinc/02/61/71/262026171.db2.gz YKQRWCIZUFIMMM-SNVBAGLBSA-N 1 0 295.766 3.840 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)c1cc(Cl)ccc1O)c1cccnc1 ZINC000184882992 262032520 /nfs/dbraw/zinc/03/25/20/262032520.db2.gz ZQOOGRWAMSNWJC-GHMZBOCLSA-N 1 0 276.767 3.852 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)c2ccc(C)cc2O)cc1F ZINC000184927819 262034165 /nfs/dbraw/zinc/03/41/65/262034165.db2.gz RBNJLIOAUFBIJG-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(Cl)nc2)c(O)c1 ZINC000185074220 262039858 /nfs/dbraw/zinc/03/98/58/262039858.db2.gz VDTKTRXMVYQCRU-NSHDSACASA-N 1 0 276.767 3.600 20 10 CHCDRO COCCCCC[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000185232870 262047322 /nfs/dbraw/zinc/04/73/22/262047322.db2.gz PRLNVXRKZZFZTL-NSHDSACASA-N 1 0 271.788 3.513 20 10 CHCDRO CC[C@@H](C)[C@H](O)C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000185438867 262054081 /nfs/dbraw/zinc/05/40/81/262054081.db2.gz DDRSNLBTGONYTA-IIYDPXPESA-N 1 0 287.403 3.603 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](CCO)c2ccccc2)c(O)c1 ZINC000185525929 262058841 /nfs/dbraw/zinc/05/88/41/262058841.db2.gz OBQWECCVXJAJCL-NVXWUHKLSA-N 1 0 299.414 3.517 20 10 CHCDRO Cc1nc(CC[NH2+][C@H](C)c2ccc(C)cc2O)sc1C ZINC000185797878 262071726 /nfs/dbraw/zinc/07/17/26/262071726.db2.gz OHTKPXOAGAGNPR-GFCCVEGCSA-N 1 0 290.432 3.667 20 10 CHCDRO COc1cc(C)cc(C[NH2+][C@@H](C)c2cc(F)ccc2O)c1 ZINC000186156428 262081810 /nfs/dbraw/zinc/08/18/10/262081810.db2.gz JZDKYPJJFOGDDD-LBPRGKRZSA-N 1 0 289.350 3.699 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](CCO)c1ccccc1)c1ccccc1O ZINC000186207821 262084558 /nfs/dbraw/zinc/08/45/58/262084558.db2.gz HSXDEFPATSDSEA-WMZOPIPTSA-N 1 0 299.414 3.599 20 10 CHCDRO Cc1csc([C@@H](C)C[NH2+][C@@H](C)c2cc(C)ccc2O)n1 ZINC000186561793 262099198 /nfs/dbraw/zinc/09/91/98/262099198.db2.gz WVOIPWXVSNRTFL-AAEUAGOBSA-N 1 0 290.432 3.920 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@](C)(O)c2ccccc2)c(O)c1 ZINC000293922983 264988734 /nfs/dbraw/zinc/98/87/34/264988734.db2.gz XLNJZMOEKAGHBJ-HNAYVOBHSA-N 1 0 299.414 3.567 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(Cl)nc1 ZINC000179097083 327799524 /nfs/dbraw/zinc/79/95/24/327799524.db2.gz HYFSYWBMTTUKNR-GFCCVEGCSA-N 1 0 289.810 3.652 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1cc(OC)ccc1O)c1ccncc1 ZINC000185541137 327840472 /nfs/dbraw/zinc/84/04/72/327840472.db2.gz FAMWYAVPJXPNRK-LRDDRELGSA-N 1 0 286.375 3.598 20 10 CHCDRO COC(C)(C)C[C@H](C)[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000185564759 327841424 /nfs/dbraw/zinc/84/14/24/327841424.db2.gz BTCXRNYNKLCSOK-STQMWFEESA-N 1 0 265.397 3.555 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H](C)C[C@H](O)c2ccccc2)c1 ZINC000185833502 327847149 /nfs/dbraw/zinc/84/71/49/327847149.db2.gz BDCDYPLDPWECJA-CLCXKQKWSA-N 1 0 299.414 3.863 20 10 CHCDRO [O-]c1c(Cl)cccc1C[N@@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000271843424 328198180 /nfs/dbraw/zinc/19/81/80/328198180.db2.gz UHAJFIKNKHNQDO-AWEZNQCLSA-N 1 0 276.767 3.711 20 10 CHCDRO Cc1cccc2c1OCC[C@H]2[NH2+]Cc1ccc(N(C)C)cc1 ZINC000188880675 329374048 /nfs/dbraw/zinc/37/40/48/329374048.db2.gz XMSQCWUUZXGIQM-GOSISDBHSA-N 1 0 296.414 3.674 20 10 CHCDRO C[C@@H]1C[C@@H]([NH2+]CC2CC=CC2)c2c1c(F)ccc2O ZINC000527951666 330294433 /nfs/dbraw/zinc/29/44/33/330294433.db2.gz RJPQXFQEPAFKKM-ZWNOBZJWSA-N 1 0 261.340 3.635 20 10 CHCDRO COCCC1CC[NH+]([C@H](C)c2ccc(Cl)cc2O)CC1 ZINC000527935867 330297987 /nfs/dbraw/zinc/29/79/87/330297987.db2.gz MVFAFOWOGABDDX-GFCCVEGCSA-N 1 0 297.826 3.855 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]Cc2cccnc2C)c1O ZINC000527984696 330298540 /nfs/dbraw/zinc/29/85/40/330298540.db2.gz DCVAXLYDQRGQSM-GFCCVEGCSA-N 1 0 290.794 3.908 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2cccnc2C)c(O)c1C ZINC000527986742 330298681 /nfs/dbraw/zinc/29/86/81/330298681.db2.gz LXAONIPGQLXIKQ-CQSZACIVSA-N 1 0 270.376 3.563 20 10 CHCDRO Cc1c2ccccc2n(C)c1CNc1[nH+]ccn1CC(C)C ZINC000490005630 332076317 /nfs/dbraw/zinc/07/63/17/332076317.db2.gz PGWJHDCIVYJSEQ-UHFFFAOYSA-N 1 0 296.418 3.951 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccc2ccccc2c1O)c1cnn(C)c1 ZINC000273366855 334764807 /nfs/dbraw/zinc/76/48/07/334764807.db2.gz BRUFTYRQYWQBGO-OLZOCXBDSA-N 1 0 295.386 3.691 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H]2CCc3cccc(O)c32)c1 ZINC000295771522 533776701 /nfs/dbraw/zinc/77/67/01/533776701.db2.gz AJPRBUWNQQFBIZ-BLLLJJGKSA-N 1 0 283.371 3.739 20 10 CHCDRO CC(C)C[C@@H](CO)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000040773764 519224318 /nfs/dbraw/zinc/22/43/18/519224318.db2.gz XCUWEMABAVJCCA-HIFRSBDPSA-N 1 0 287.403 3.603 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](C)C2CCOCC2)cc1 ZINC000126132193 520290328 /nfs/dbraw/zinc/29/03/28/520290328.db2.gz IEZIQQURGLTHEC-GJZGRUSLSA-N 1 0 290.451 3.608 20 10 CHCDRO CC[NH+](CC)Cc1cccc(NCc2ccccc2O)c1 ZINC000037086813 520758064 /nfs/dbraw/zinc/75/80/64/520758064.db2.gz DUOFOUXSNYUULA-UHFFFAOYSA-N 1 0 284.403 3.846 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CCC(C)(F)F)cc1 ZINC000294126613 520906069 /nfs/dbraw/zinc/90/60/69/520906069.db2.gz FDKJNLWFNOGWDL-UHFFFAOYSA-N 1 0 270.367 3.668 20 10 CHCDRO CCc1nc(C)c(C[NH2+][C@@H](CC)c2ccc(C)cc2O)o1 ZINC000291935103 522209155 /nfs/dbraw/zinc/20/91/55/522209155.db2.gz PDSQDCJANNOEEI-AWEZNQCLSA-N 1 0 288.391 3.800 20 10 CHCDRO CC[C@H]([NH2+]CC1(CC)CCOCC1)c1ccc(C)cc1O ZINC000279968233 522569969 /nfs/dbraw/zinc/56/99/69/522569969.db2.gz CTZFCHGNWIOTTG-INIZCTEOSA-N 1 0 291.435 3.948 20 10 CHCDRO CC[C@H]([NH2+]CC1CCSCC1)c1ccccc1O ZINC000229222006 522576548 /nfs/dbraw/zinc/57/65/48/522576548.db2.gz GTSDKQUMWYZWMS-AWEZNQCLSA-N 1 0 265.422 3.576 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)[C@@H](O)c1ccccc1)c1ccc(C)cc1O ZINC000290161520 522692993 /nfs/dbraw/zinc/69/29/93/522692993.db2.gz DETHPXILTXEBIK-UCLAIMLFSA-N 1 0 299.414 3.863 20 10 CHCDRO CC[C@H]([NH2+][C@H](CCO)c1ccccc1)c1ccc(C)cc1O ZINC000279988778 522744788 /nfs/dbraw/zinc/74/47/88/522744788.db2.gz FFAIWBFHSOSJFY-ZWKOTPCHSA-N 1 0 299.414 3.865 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCO[C@H](C2CC2)C1)c1ccc(C)cc1O ZINC000280269179 522755471 /nfs/dbraw/zinc/75/54/71/522755471.db2.gz XTSJOZODXFZHLC-ZVZYQTTQSA-N 1 0 289.419 3.699 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCO[C@H](C(C)C)C1)c1ccc(C)cc1O ZINC000279977641 522757517 /nfs/dbraw/zinc/75/75/17/522757517.db2.gz DIQNVQYNVFHRMH-ZVZYQTTQSA-N 1 0 291.435 3.945 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1cn(C)nc1C)c1ccc(C)cc1O ZINC000280270948 522939826 /nfs/dbraw/zinc/93/98/26/522939826.db2.gz XWYAPMVQVFOAPL-MLGOLLRUSA-N 1 0 287.407 3.544 20 10 CHCDRO C[N@H+](Cc1ccncc1)Cc1ccc(N2CCCCC2)cc1 ZINC000248133070 523461710 /nfs/dbraw/zinc/46/17/10/523461710.db2.gz QZBYORWDCAKWJE-UHFFFAOYSA-N 1 0 295.430 3.704 20 10 CHCDRO CO[C@@](C)(C[NH2+][C@H](C)c1cc(Cl)ccc1O)C1CC1 ZINC000291207752 523799265 /nfs/dbraw/zinc/79/92/65/523799265.db2.gz MNQLGYFJAMPGGB-BMIGLBTASA-N 1 0 283.799 3.511 20 10 CHCDRO CO[C@H](C)[C@H](C)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000276071222 523899385 /nfs/dbraw/zinc/89/93/85/523899385.db2.gz LYSYHVWGEXLREU-UONOGXRCSA-N 1 0 285.387 3.572 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H](C)c2cc(F)ccc2O)c1 ZINC000094617665 524153078 /nfs/dbraw/zinc/15/30/78/524153078.db2.gz GSNCQJDQDNJLDY-RYUDHWBXSA-N 1 0 289.350 3.952 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2cccs2)c(O)c1 ZINC000283880776 524332785 /nfs/dbraw/zinc/33/27/85/524332785.db2.gz CDIHLMSYCKKFEK-LBPRGKRZSA-N 1 0 261.390 3.921 20 10 CHCDRO COc1ccc(F)cc1[C@H](C)[NH2+][C@H](C)c1ccccc1O ZINC000037089974 524333917 /nfs/dbraw/zinc/33/39/17/524333917.db2.gz FGUOKRHABNFKMW-NEPJUHHUSA-N 1 0 289.350 3.952 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+](C)C2CCC(F)(F)CC2)c1 ZINC000290095771 525338204 /nfs/dbraw/zinc/33/82/04/525338204.db2.gz HKZYJLZUMYLIOL-UHFFFAOYSA-N 1 0 269.335 3.710 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H]2CCCc3sccc32)c1 ZINC000071409282 525351180 /nfs/dbraw/zinc/35/11/80/525351180.db2.gz RGKNLHBUGJNLBE-CQSZACIVSA-N 1 0 273.401 3.929 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H]2CCCc3ccccc32)c1 ZINC000071406523 525354970 /nfs/dbraw/zinc/35/49/70/525354970.db2.gz XRKMCKLCZSOTES-KRWDZBQOSA-N 1 0 267.372 3.868 20 10 CHCDRO C[C@H]([NH2+]Cc1ccccc1O)c1ccccc1OC(F)F ZINC000037084591 525461935 /nfs/dbraw/zinc/46/19/35/525461935.db2.gz MZZDWMIYGUIYOS-NSHDSACASA-N 1 0 293.313 3.844 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)c1ccccc1O)c1cccc([N+](=O)[O-])c1 ZINC000037775500 525534794 /nfs/dbraw/zinc/53/47/94/525534794.db2.gz RPFBFHMWJZKYGP-RYUDHWBXSA-N 1 0 286.331 3.712 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccsc1)c1ccc(N(C)C)cc1 ZINC000063152437 525547508 /nfs/dbraw/zinc/54/75/08/525547508.db2.gz AZORHGPKZSCQSK-GFCCVEGCSA-N 1 0 260.406 3.665 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1O)c1cccc([N+](=O)[O-])c1 ZINC000037775501 525614555 /nfs/dbraw/zinc/61/45/55/525614555.db2.gz RPFBFHMWJZKYGP-NEPJUHHUSA-N 1 0 286.331 3.712 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2COc3ccccc32)c(O)c1C ZINC000290334257 525730975 /nfs/dbraw/zinc/73/09/75/525730975.db2.gz OZYDGFKVKWKZBU-CABCVRRESA-N 1 0 297.398 3.836 20 10 CHCDRO COc1cccc(C[NH2+]C[C@H]2CCCCC(F)(F)C2)c1O ZINC000291755413 526020175 /nfs/dbraw/zinc/02/01/75/526020175.db2.gz QSMYXQHJCWSFES-LBPRGKRZSA-N 1 0 299.361 3.706 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+][C@@H]1CCc2ccccc21 ZINC000083551632 526365674 /nfs/dbraw/zinc/36/56/74/526365674.db2.gz URTDFRUKSAIXHN-OAHLLOKOSA-N 1 0 273.763 3.823 20 10 CHCDRO CCC(CC)(CCO)C[NH2+][C@H](C)c1cc(C)ccc1O ZINC000185620790 1117858222 /nfs/dbraw/zinc/85/82/22/1117858222.db2.gz URRYWCPAMFBOLZ-CQSZACIVSA-N 1 0 279.424 3.540 20 10 CHCDRO COc1ccc(O)c(C[NH+]2CCC(C(C)(C)C)CC2)c1 ZINC000133753431 1125489272 /nfs/dbraw/zinc/48/92/72/1125489272.db2.gz KFBCINPQQZMXBZ-UHFFFAOYSA-N 1 0 277.408 3.659 20 10 CHCDRO CC1(CC(F)F)C[NH+](Cc2ccc(Cl)cc2O)C1 ZINC001182554402 1122173104 /nfs/dbraw/zinc/17/31/04/1122173104.db2.gz JXHUQABGITXSIM-UHFFFAOYSA-N 1 0 275.726 3.523 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1CCCCO1)c1cc(Cl)ccc1O ZINC000775490815 1122619493 /nfs/dbraw/zinc/61/94/93/1122619493.db2.gz XHWIBMKHWXYHGP-TZMCWYRMSA-N 1 0 283.799 3.655 20 10 CHCDRO CC[C@H]([NH2+][C@H](COC)C(C)C)c1cc(Cl)ccc1O ZINC000775510285 1122630680 /nfs/dbraw/zinc/63/06/80/1122630680.db2.gz ZQZQDEKWBMMKBS-UONOGXRCSA-N 1 0 285.815 3.757 20 10 CHCDRO CC[C@@H]([NH2+]CCCCCCO)c1cc(Cl)ccc1O ZINC000775531412 1122649311 /nfs/dbraw/zinc/64/93/11/1122649311.db2.gz BYWVHUKVJCJFLA-CQSZACIVSA-N 1 0 285.815 3.639 20 10 CHCDRO CC[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(N(C)C)c(C)c1 ZINC001193402163 1122688797 /nfs/dbraw/zinc/68/87/97/1122688797.db2.gz QSAGDEJYOSLROK-HZPDHXFCSA-N 1 0 260.425 3.729 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1C(C)(C)C1(F)F)c1ccc(N(C)C)cc1 ZINC000850552667 1123289826 /nfs/dbraw/zinc/28/98/26/1123289826.db2.gz PHPNQAXRFJTJJG-RISCZKNCSA-N 1 0 282.378 3.695 20 10 CHCDRO C[C@H]([NH2+][C@@H]1C[C@H]1C(F)(F)F)c1ccc(Cl)cc1O ZINC000866499085 1124073451 /nfs/dbraw/zinc/07/34/51/1124073451.db2.gz FESCQKLXJXEPPK-WQGWLQIFSA-N 1 0 279.689 3.647 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CCSC(C)C)cc1Cl ZINC000825900808 1124974075 /nfs/dbraw/zinc/97/40/75/1124974075.db2.gz RYWWUNXXEJMVTE-UHFFFAOYSA-N 1 0 273.829 3.585 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CS[C@H](C)C1)c1ccc(N(C)C)cc1 ZINC000840857248 1132296539 /nfs/dbraw/zinc/29/65/39/1132296539.db2.gz WMUVALSSYNRJNQ-INWMFGNUSA-N 1 0 278.465 3.687 20 10 CHCDRO C[NH+](C)Cc1ccc(NCc2c(O)cccc2Cl)cc1 ZINC000148126968 1125551726 /nfs/dbraw/zinc/55/17/26/1125551726.db2.gz NXJDQTPHHDDBCV-UHFFFAOYSA-N 1 0 290.794 3.719 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCC[C@H]([NH+](C)C)C1)c1ccc(Cl)cc1[O-] ZINC000841756184 1125595449 /nfs/dbraw/zinc/59/54/49/1125595449.db2.gz UTTZCKQSJWDYEQ-YUTCNCBUSA-N 1 0 296.842 3.569 20 10 CHCDRO C[C@H]([NH2+][C@@H]1COCc2ccccc21)c1ccc(N(C)C)cc1 ZINC000841762355 1125602004 /nfs/dbraw/zinc/60/20/04/1125602004.db2.gz WNLZVJPYKYALCN-IFXJQAMLSA-N 1 0 296.414 3.675 20 10 CHCDRO COc1ccc(C[NH2+]CCCOc2ccccc2C)cc1C ZINC000729686655 1125613547 /nfs/dbraw/zinc/61/35/47/1125613547.db2.gz RLNGZDHWAPHTJL-UHFFFAOYSA-N 1 0 299.414 3.871 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]CC[C@@H]2CC[C@H]3C[C@H]32)c1O ZINC000717154697 1125615452 /nfs/dbraw/zinc/61/54/52/1125615452.db2.gz MEDABRMSTCUFKT-MJVIPROJSA-N 1 0 295.810 3.580 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C[C@@]2(C)CCOC3(CCC3)C2)c1 ZINC000886343533 1125671205 /nfs/dbraw/zinc/67/12/05/1125671205.db2.gz ZRGHCVFKFIYQBG-KRWDZBQOSA-N 1 0 289.419 3.530 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H]2CCc3c2cccc3F)cc1C ZINC000886362604 1125673298 /nfs/dbraw/zinc/67/32/98/1125673298.db2.gz FMJKKBPQXNDIOU-KRWDZBQOSA-N 1 0 285.362 3.925 20 10 CHCDRO COc1cccc(C[N@@H+]2C[C@@H](C)[C@H]2c2ccccc2)c1O ZINC000093867532 1125774605 /nfs/dbraw/zinc/77/46/05/1125774605.db2.gz ZBHAQJIOGXDSDZ-DYVFJYSZSA-N 1 0 283.371 3.594 20 10 CHCDRO Cc1ccc(C)c(C[NH2+]Cc2ccc3c(c2)CCO3)c1 ZINC001649004740 1126718120 /nfs/dbraw/zinc/71/81/20/1126718120.db2.gz IMBAQNDXBGPJKS-UHFFFAOYSA-N 1 0 267.372 3.528 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C2(c3ccccc3F)CC2)cc1C ZINC000174410200 1126770121 /nfs/dbraw/zinc/77/01/21/1126770121.db2.gz OETNOTINKQDYPB-UHFFFAOYSA-N 1 0 285.362 3.927 20 10 CHCDRO CC[C@](C)([NH2+]Cc1ccccc1O)c1nc(C)cs1 ZINC000174503539 1126770729 /nfs/dbraw/zinc/77/07/29/1126770729.db2.gz YEBKZYGYMXMULR-HNNXBMFYSA-N 1 0 276.405 3.572 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H]2CCCc3occc32)cc1C ZINC000174265286 1126768110 /nfs/dbraw/zinc/76/81/10/1126768110.db2.gz IZJLYZRCYXXYOC-OAHLLOKOSA-N 1 0 271.360 3.769 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCSC(C)(C)C1)c1ccccc1O ZINC000903285402 1126799064 /nfs/dbraw/zinc/79/90/64/1126799064.db2.gz ZILPDGBUEHMVCV-NEPJUHHUSA-N 1 0 265.422 3.717 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2ccoc2)cc1 ZINC000178474899 1126814350 /nfs/dbraw/zinc/81/43/50/1126814350.db2.gz GTTLRUWFADMZFF-ZDUSSCGKSA-N 1 0 258.365 3.587 20 10 CHCDRO CC1(C)C[N@H+](Cc2cc(Cl)ccc2O)[C@H]1C1CC1 ZINC000811513272 1130618208 /nfs/dbraw/zinc/61/82/08/1130618208.db2.gz FMPVQCNIMXDUCT-AWEZNQCLSA-N 1 0 265.784 3.666 20 10 CHCDRO CCc1nc([C@@H](C)[NH2+][C@@H](C)c2ccccc2O)cs1 ZINC000183508183 1126888031 /nfs/dbraw/zinc/88/80/31/1126888031.db2.gz SOSSSJKFSFMJQS-WDEREUQCSA-N 1 0 276.405 3.823 20 10 CHCDRO COc1cc(C)ccc1C[NH2+][C@@H](C)c1ccccc1O ZINC000183555805 1126888526 /nfs/dbraw/zinc/88/85/26/1126888526.db2.gz WGAPWPOBMIVFQF-ZDUSSCGKSA-N 1 0 271.360 3.560 20 10 CHCDRO CCOCCC1(C[NH2+][C@H](C)c2ccccc2O)CCC1 ZINC000183618972 1126889945 /nfs/dbraw/zinc/88/99/45/1126889945.db2.gz VMXILMKYMFPCNH-CQSZACIVSA-N 1 0 277.408 3.640 20 10 CHCDRO C[C@H](c1ccncc1)[N@H+](C)Cc1cccc(Cl)c1[O-] ZINC000183713572 1126890396 /nfs/dbraw/zinc/89/03/96/1126890396.db2.gz ACEJVXSPJVGJOP-LLVKDONJSA-N 1 0 276.767 3.634 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1cc(OC)ccc1O)c1ccncc1 ZINC000185541177 1126900176 /nfs/dbraw/zinc/90/01/76/1126900176.db2.gz FAMWYAVPJXPNRK-WBMJQRKESA-N 1 0 286.375 3.598 20 10 CHCDRO C[C@H]([NH2+][C@H]1CC[C@H](CO)CC1)c1ccc2ccccc2c1O ZINC000185736245 1126902510 /nfs/dbraw/zinc/90/25/10/1126902510.db2.gz SIQJWTDBYXEYML-OFQRWUPVSA-N 1 0 299.414 3.747 20 10 CHCDRO CC1([NH2+]Cc2cc(-c3ccccc3)ccc2O)CCOCC1 ZINC000269763132 1127046279 /nfs/dbraw/zinc/04/62/79/1127046279.db2.gz CSXHUWUPBUGRRS-UHFFFAOYSA-N 1 0 297.398 3.718 20 10 CHCDRO C[C@@H](CO)CCC[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000270248334 1127052146 /nfs/dbraw/zinc/05/21/46/1127052146.db2.gz FNIDJCNJBQKWRW-OAHLLOKOSA-N 1 0 299.414 3.557 20 10 CHCDRO CCc1ccc(C[NH2+]CCCSc2nccs2)o1 ZINC000150795993 1127105263 /nfs/dbraw/zinc/10/52/63/1127105263.db2.gz WMMXNSMNBQTIOJ-UHFFFAOYSA-N 1 0 282.434 3.571 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N2CCSCC2)cc1)C(C)(C)C ZINC000163623147 1127115165 /nfs/dbraw/zinc/11/51/65/1127115165.db2.gz MMEWJUXCFRWWTR-AWEZNQCLSA-N 1 0 292.492 3.764 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)CCSC)c1ccc(N(C)C)cc1 ZINC000151091433 1127122472 /nfs/dbraw/zinc/12/24/72/1127122472.db2.gz WFGXVHWLDOIMCJ-XJKSGUPXSA-N 1 0 280.481 3.935 20 10 CHCDRO CCCCC[N@H+](C)Cc1c(O)ccc(F)c1Cl ZINC001237121427 1131056163 /nfs/dbraw/zinc/05/61/63/1131056163.db2.gz NAMZGVGEPUDXOJ-UHFFFAOYSA-N 1 0 259.752 3.807 20 10 CHCDRO COc1cc(C)cc(C[N@@H+]2CC[C@H](c3ccccc3)C2)c1O ZINC000164226297 1127156933 /nfs/dbraw/zinc/15/69/33/1127156933.db2.gz LCCOBSTXBGEIGD-INIZCTEOSA-N 1 0 297.398 3.699 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+](CC2CC2)C2CC2)c1O ZINC001237687462 1131129000 /nfs/dbraw/zinc/12/90/00/1131129000.db2.gz CJCLDUHGYRYARA-UHFFFAOYSA-N 1 0 265.784 3.728 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C2(Cc3ccccc3)CCC2)c1 ZINC000760716800 1127208981 /nfs/dbraw/zinc/20/89/81/1127208981.db2.gz HUBZKTFIIFQNPI-UHFFFAOYSA-N 1 0 281.399 3.956 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CCCCOC(C)C)c(O)c1 ZINC000285165731 1127218571 /nfs/dbraw/zinc/21/85/71/1127218571.db2.gz MRYWZKHDMZGURD-HNNXBMFYSA-N 1 0 279.424 3.865 20 10 CHCDRO CCOCCC1(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)CC1 ZINC000285363965 1127224245 /nfs/dbraw/zinc/22/42/45/1127224245.db2.gz VTGLBXYTAIMYGX-HNNXBMFYSA-N 1 0 291.435 3.866 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccccc1O)c1ccccc1F ZINC000166044223 1127258585 /nfs/dbraw/zinc/25/85/85/1127258585.db2.gz OSLNBHVXFWTSAH-OAHLLOKOSA-N 1 0 259.324 3.772 20 10 CHCDRO Cc1cc(F)cc(C[N@H+]2[C@H](C)CCC[C@@H]2C)c1O ZINC001238059044 1131164650 /nfs/dbraw/zinc/16/46/50/1131164650.db2.gz ZCPRGHWEVAKWQB-TXEJJXNPSA-N 1 0 251.345 3.603 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+]Cc1cnn(C(C)C)c1 ZINC000355112020 1127317780 /nfs/dbraw/zinc/31/77/80/1127317780.db2.gz DQVLLALDYQNQOA-UHFFFAOYSA-N 1 0 296.418 3.554 20 10 CHCDRO COC[C@@H]([NH2+]Cc1ccccc1O)c1cccc(Cl)c1 ZINC000288570706 1127348190 /nfs/dbraw/zinc/34/81/90/1127348190.db2.gz NAYZACXIVROLTC-OAHLLOKOSA-N 1 0 291.778 3.523 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H]2c3ccccc3O[C@@H]2C)cc1C ZINC000288544450 1127346550 /nfs/dbraw/zinc/34/65/50/1127346550.db2.gz LBBSCHLLNYNZHH-ACJLOTCBSA-N 1 0 283.371 3.621 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CCC[C@H]1c1ccccc1 ZINC000226562066 1127411098 /nfs/dbraw/zinc/41/10/98/1127411098.db2.gz FGOZTPPCEIGIGN-INIZCTEOSA-N 1 0 271.335 3.868 20 10 CHCDRO CS[C@H](C)C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000168851983 1127472536 /nfs/dbraw/zinc/47/25/36/1127472536.db2.gz OEOPWUYMNOBXQQ-VXGBXAGGSA-N 1 0 275.417 3.948 20 10 CHCDRO COc1ccc(C[NH2+][C@H]2CCC[C@@H](SC)C2)cc1C ZINC000227377355 1127475134 /nfs/dbraw/zinc/47/51/34/1127475134.db2.gz XDOGEBVMUCLEHV-LSDHHAIUSA-N 1 0 279.449 3.767 20 10 CHCDRO Cc1cc(C[N@@H+](C)[C@H](C)c2cccnc2)ccc1N(C)C ZINC000293749624 1127517572 /nfs/dbraw/zinc/51/75/72/1127517572.db2.gz IOTFSXMOYJIPLC-OAHLLOKOSA-N 1 0 283.419 3.649 20 10 CHCDRO COCC1(CC[NH2+][C@H](C)c2cc(C)ccc2O)CCC1 ZINC000293773859 1127519475 /nfs/dbraw/zinc/51/94/75/1127519475.db2.gz SJLXDJGEARBEQU-CQSZACIVSA-N 1 0 277.408 3.558 20 10 CHCDRO CC[C@H]([NH2+]Cc1occc1C)c1ccc(N(C)C)cc1 ZINC000293877129 1127529028 /nfs/dbraw/zinc/52/90/28/1127529028.db2.gz YMOQKUURUXQWLE-INIZCTEOSA-N 1 0 272.392 3.895 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H]2CCCSC2)c(O)c1 ZINC000294008512 1127541819 /nfs/dbraw/zinc/54/18/19/1127541819.db2.gz DENOTHUTCZRINO-KGLIPLIRSA-N 1 0 279.449 3.803 20 10 CHCDRO CC[N@H+](CCC1CC1)Cc1cc(Cl)ccc1O ZINC000761226868 1127552044 /nfs/dbraw/zinc/55/20/44/1127552044.db2.gz WHADKXWPHODKHY-UHFFFAOYSA-N 1 0 253.773 3.668 20 10 CHCDRO COc1cc(Cl)cc(C[NH+]2CCCCCCC2)c1O ZINC000228562307 1127567638 /nfs/dbraw/zinc/56/76/38/1127567638.db2.gz JUSBPPLUHXFSFK-UHFFFAOYSA-N 1 0 283.799 3.820 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+][C@H]2CCC[C@H](C)C2)c1O ZINC000228670585 1127583026 /nfs/dbraw/zinc/58/30/26/1127583026.db2.gz LOAQSJXTHRIJCL-GWCFXTLKSA-N 1 0 283.799 3.723 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H]2CCc3cccc(O)c32)c(C)c1 ZINC000296129260 1127663547 /nfs/dbraw/zinc/66/35/47/1127663547.db2.gz VQLYDEIKDWQHOY-MRXNPFEDSA-N 1 0 267.372 3.786 20 10 CHCDRO Cc1cccnc1CC[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000296244411 1127666576 /nfs/dbraw/zinc/66/65/76/1127666576.db2.gz CQVZCWIOIUHDCS-LBPRGKRZSA-N 1 0 290.794 3.642 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCc2ncccc2C)c(O)c1C ZINC000296514405 1127674492 /nfs/dbraw/zinc/67/44/92/1127674492.db2.gz PPZIRCARODJRRA-HNNXBMFYSA-N 1 0 284.403 3.606 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H]2OCCc3ccccc32)c1 ZINC000371870658 1127782548 /nfs/dbraw/zinc/78/25/48/1127782548.db2.gz RRFLADLIBWVLFC-IFXJQAMLSA-N 1 0 297.398 3.665 20 10 CHCDRO Oc1ccccc1C[NH2+][C@@H]1CCCCC12CCCC2 ZINC000312010512 1127971949 /nfs/dbraw/zinc/97/19/49/1127971949.db2.gz WGPZCKMBMGVJHA-MRXNPFEDSA-N 1 0 259.393 3.985 20 10 CHCDRO CC1CC[NH+](Cc2cccc(OC(F)(F)F)c2O)CC1 ZINC001233726206 1128030907 /nfs/dbraw/zinc/03/09/07/1128030907.db2.gz ACXCWFPSKAQEJC-UHFFFAOYSA-N 1 0 289.297 3.523 20 10 CHCDRO CCc1ccccc1C[NH2+][C@H]1CCc2cccc(O)c21 ZINC000312843471 1128093883 /nfs/dbraw/zinc/09/38/83/1128093883.db2.gz PIPXMSCTTJTAOY-INIZCTEOSA-N 1 0 267.372 3.732 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2ccccc2)cc1 ZINC000152946078 1128158072 /nfs/dbraw/zinc/15/80/72/1128158072.db2.gz PLYWVAYMCOORCX-HNNXBMFYSA-N 1 0 268.404 3.994 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCS[C@H](C)C2)c(O)c1 ZINC000927032731 1128209477 /nfs/dbraw/zinc/20/94/77/1128209477.db2.gz OPYVQMQTQJJAPC-FRRDWIJNSA-N 1 0 265.422 3.635 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2cccc3c2OCC3)c(O)c1C ZINC000927090483 1128216722 /nfs/dbraw/zinc/21/67/22/1128216722.db2.gz MLKGEPPPEPFNEY-AWEZNQCLSA-N 1 0 297.398 3.795 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CC(C)(C)OC2(C)C)c(O)c1 ZINC000927101528 1128217542 /nfs/dbraw/zinc/21/75/42/1128217542.db2.gz NSYKZECQUGWPRC-KBPBESRZSA-N 1 0 291.435 3.945 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CC(C)(C)OC2(C)C)c1 ZINC000927099171 1128217627 /nfs/dbraw/zinc/21/76/27/1128217627.db2.gz ARHJSROEALQHRU-KBPBESRZSA-N 1 0 291.435 3.945 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CC[C@@H]2CCC3(CCC3)O2)c1 ZINC000927127197 1128220935 /nfs/dbraw/zinc/22/09/35/1128220935.db2.gz GKIJNRFDEBXIGL-GJZGRUSLSA-N 1 0 289.419 3.843 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC[C@@H]2CCC3(CCC3)O2)c(O)c1 ZINC000927128863 1128220945 /nfs/dbraw/zinc/22/09/45/1128220945.db2.gz MZUZQGZIZDTFIB-GJZGRUSLSA-N 1 0 289.419 3.843 20 10 CHCDRO C[C@@H]([NH2+]C1([C@@H]2CCCCO2)CC1)c1ccc(Cl)cc1O ZINC000927156688 1128223265 /nfs/dbraw/zinc/22/32/65/1128223265.db2.gz BETMHRSQWZUDCM-ABAIWWIYSA-N 1 0 295.810 3.798 20 10 CHCDRO Cc1ccccc1C[C@@H](C)[N@H+](C)Cc1ccccc1O ZINC000777825264 1128288263 /nfs/dbraw/zinc/28/82/63/1128288263.db2.gz RUONYXIEMLTNER-OAHLLOKOSA-N 1 0 269.388 3.764 20 10 CHCDRO CCC[N@H+](Cc1ccccc1O)[C@@H](C)c1snnc1C ZINC000929753967 1128285127 /nfs/dbraw/zinc/28/51/27/1128285127.db2.gz YYISCOIVNGOKDU-LBPRGKRZSA-N 1 0 291.420 3.525 20 10 CHCDRO CCC[N@H+](Cc1c(C)noc1CC)Cc1ccccc1O ZINC000929752686 1128285258 /nfs/dbraw/zinc/28/52/58/1128285258.db2.gz DNEIAISVOYMXMO-UHFFFAOYSA-N 1 0 288.391 3.663 20 10 CHCDRO COc1ccc(CC[NH2+][C@@H](C)c2cc(C)ccc2O)cc1 ZINC000035628566 1128319929 /nfs/dbraw/zinc/31/99/29/1128319929.db2.gz VIAMHNVYMJIGEW-AWEZNQCLSA-N 1 0 285.387 3.603 20 10 CHCDRO C[C@H]([NH2+]CCc1cccnc1)c1ccc2ccccc2c1O ZINC000193709801 1128333239 /nfs/dbraw/zinc/33/32/39/1128333239.db2.gz QHAHMBGKBWVZDZ-AWEZNQCLSA-N 1 0 292.382 3.834 20 10 CHCDRO COc1cc(C)cc(C[NH+](CC(C)C)CC(C)C)c1O ZINC000915788467 1128338138 /nfs/dbraw/zinc/33/81/38/1128338138.db2.gz PCDOHVRJWYONOM-UHFFFAOYSA-N 1 0 279.424 3.823 20 10 CHCDRO CC(C)(C)c1ccc(C[NH+]2CC3(CCC3)C2)c(O)c1 ZINC001235682867 1128348378 /nfs/dbraw/zinc/34/83/78/1128348378.db2.gz QVWSXCNISSLUSC-UHFFFAOYSA-N 1 0 259.393 3.676 20 10 CHCDRO COc1cc(C)cc(C[N@H+]2Cc3ccccc3[C@H](C)C2)c1O ZINC000915838551 1128351525 /nfs/dbraw/zinc/35/15/25/1128351525.db2.gz GJEMMTWYMKCEQK-CQSZACIVSA-N 1 0 297.398 3.829 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+](C)Cc2cccc(C)c2O)c1 ZINC000763379997 1128428943 /nfs/dbraw/zinc/42/89/43/1128428943.db2.gz LRPHDBKDPHWKFT-UHFFFAOYSA-N 1 0 269.388 3.949 20 10 CHCDRO CCC[N@H+](Cc1ccc(C)cn1)Cc1ccccc1O ZINC000154157061 1128453263 /nfs/dbraw/zinc/45/32/63/1128453263.db2.gz OICNGISILNTISZ-UHFFFAOYSA-N 1 0 270.376 3.508 20 10 CHCDRO c1ccc(CCCC[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC000917394102 1128497250 /nfs/dbraw/zinc/49/72/50/1128497250.db2.gz QCERJUBBTJRKJZ-UHFFFAOYSA-N 1 0 281.399 3.734 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)Cc1ccc(O)cc1)c1ccccc1O ZINC000155668496 1128610479 /nfs/dbraw/zinc/61/04/79/1128610479.db2.gz GVXNRXFZMBCYGZ-GUYCJALGSA-N 1 0 285.387 3.770 20 10 CHCDRO CN(C)c1ccc(C[NH2+]Cc2ccc(Cl)cc2F)cc1 ZINC000157301868 1128652370 /nfs/dbraw/zinc/65/23/70/1128652370.db2.gz VELYVWPZUCLLLQ-UHFFFAOYSA-N 1 0 292.785 3.835 20 10 CHCDRO CC(C)[C@@H](C)[N@H+](Cc1cc(F)ccc1O)C1CC1 ZINC000778988667 1128673775 /nfs/dbraw/zinc/67/37/75/1128673775.db2.gz KFRUNMOBAXHXBT-LLVKDONJSA-N 1 0 251.345 3.540 20 10 CHCDRO Cc1ccc2[nH]c3c(c2c1)C[N@H+](Cc1ccccc1O)CC3 ZINC000779000723 1128675290 /nfs/dbraw/zinc/67/52/90/1128675290.db2.gz ZUSOYWYHQWSNSA-UHFFFAOYSA-N 1 0 292.382 3.740 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2cc(F)ccc2O)Cc2ccccc21 ZINC000778995383 1128675295 /nfs/dbraw/zinc/67/52/95/1128675295.db2.gz RJLJRPFURCUAGD-GFCCVEGCSA-N 1 0 271.335 3.651 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCC[C@@H](Cc2ccccc2)C1 ZINC000779009704 1128677031 /nfs/dbraw/zinc/67/70/31/1128677031.db2.gz DMUOPRMSMMLTMV-KRWDZBQOSA-N 1 0 281.399 3.847 20 10 CHCDRO C[C@H]1c2c(F)cccc2CC[N@H+]1Cc1cc(F)ccc1O ZINC000779020214 1128683463 /nfs/dbraw/zinc/68/34/63/1128683463.db2.gz KEAFAGRMOGOHEB-NSHDSACASA-N 1 0 289.325 3.790 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)C1CCSCC1 ZINC000779023889 1128686385 /nfs/dbraw/zinc/68/63/85/1128686385.db2.gz JXWIEWLTFOKSKO-CQSZACIVSA-N 1 0 292.492 3.682 20 10 CHCDRO COc1cc(O)c(C[NH+](CC(C)C)CC(C)C)cc1OC ZINC000159453537 1128695904 /nfs/dbraw/zinc/69/59/04/1128695904.db2.gz STMJLJVRJVYALQ-UHFFFAOYSA-N 1 0 295.423 3.523 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@@H](Cc2ccccc2)C(C)C)c1 ZINC000779033112 1128693931 /nfs/dbraw/zinc/69/39/31/1128693931.db2.gz VVIFMJKSDWIAPB-SFHVURJKSA-N 1 0 299.414 3.758 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCCO3)o1 ZINC000921489477 1128710549 /nfs/dbraw/zinc/71/05/49/1128710549.db2.gz JDUUJBQKASSDRF-CYBMUJFWSA-N 1 0 271.360 3.764 20 10 CHCDRO Cc1ccc(CC[C@H](C)[NH2+]Cc2cc(F)ccc2O)o1 ZINC000779088571 1128727879 /nfs/dbraw/zinc/72/78/79/1128727879.db2.gz SAHJPAZNECPMCH-NSHDSACASA-N 1 0 277.339 3.544 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccc([C@@H](C)O)cc2)c1 ZINC000185119588 1117765962 /nfs/dbraw/zinc/76/59/62/1117765962.db2.gz VQCZIFUVEBYVPF-UONOGXRCSA-N 1 0 285.387 3.605 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCCc2ccccc2)c1 ZINC000035628773 1117810878 /nfs/dbraw/zinc/81/08/78/1117810878.db2.gz LSWDRJCHADMYDX-OAHLLOKOSA-N 1 0 269.388 3.984 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCOc3ccccc32)c(O)c1 ZINC000185405158 1117818455 /nfs/dbraw/zinc/81/84/55/1117818455.db2.gz NRMDKDGYETVXCZ-GJZGRUSLSA-N 1 0 297.398 3.918 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCOc3ccccc32)c(O)c1 ZINC000185405196 1117818992 /nfs/dbraw/zinc/81/89/92/1117818992.db2.gz NRMDKDGYETVXCZ-LSDHHAIUSA-N 1 0 297.398 3.918 20 10 CHCDRO Oc1cccc2c1C[N@H+](Cc1ccccc1Cl)CC2 ZINC001203385075 1117835701 /nfs/dbraw/zinc/83/57/01/1117835701.db2.gz IOCZPLLDQCYQQT-UHFFFAOYSA-N 1 0 273.763 3.604 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@](C)(O)CCC(C)C)c(O)c1 ZINC000185528155 1117838065 /nfs/dbraw/zinc/83/80/65/1117838065.db2.gz JCAVJRGASMXXER-YOEHRIQHSA-N 1 0 279.424 3.538 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1cc(OC)ccc1O)C1CCC1 ZINC000325046175 1117843579 /nfs/dbraw/zinc/84/35/79/1117843579.db2.gz NZGCRJSVGCZQQV-NHYWBVRUSA-N 1 0 263.381 3.630 20 10 CHCDRO Oc1cc2c(cc1C[N@@H+]1CCC[C@H]1C1CCC1)CCC2 ZINC000728198737 1117869005 /nfs/dbraw/zinc/86/90/05/1117869005.db2.gz FHAHQDVLZRXTGS-KRWDZBQOSA-N 1 0 271.404 3.645 20 10 CHCDRO CC(C)[C@H]1CCC[N@@H+]1Cc1c(O)ccc2ccncc21 ZINC000049099605 1128743189 /nfs/dbraw/zinc/74/31/89/1128743189.db2.gz WHQASOXOKWWEDV-MRXNPFEDSA-N 1 0 270.376 3.561 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H](CCO)C2CCCCC2)c(O)c1 ZINC000185829270 1117913985 /nfs/dbraw/zinc/91/39/85/1117913985.db2.gz ADJGUEVBYKQSQR-WMLDXEAASA-N 1 0 291.435 3.683 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCC(C)(C)CO1)c1ccc(N(C)C)cc1 ZINC001307695768 1117937469 /nfs/dbraw/zinc/93/74/69/1117937469.db2.gz PCKBIXMJNYPABP-YOEHRIQHSA-N 1 0 290.451 3.608 20 10 CHCDRO CO[C@@H](C[NH2+][C@H](C)c1cc(C)ccc1O)C1CCCC1 ZINC000692973474 1117938157 /nfs/dbraw/zinc/93/81/57/1117938157.db2.gz CAGUHXWXGDAEGL-DYVFJYSZSA-N 1 0 277.408 3.556 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1C[C@@H]1c1ccccc1)c1cc(F)ccc1O ZINC000186018094 1117968507 /nfs/dbraw/zinc/96/85/07/1117968507.db2.gz IQELHKGMOMHQTA-SUYBPPKGSA-N 1 0 285.362 3.986 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]C[C@H]2C[C@@H]2c2ccccc2)c1 ZINC000186017701 1117968889 /nfs/dbraw/zinc/96/88/89/1117968889.db2.gz ULOXNRDAIYBAJR-JCKWVBRZSA-N 1 0 297.398 3.855 20 10 CHCDRO C[C@H]1CCCC[N@H+](Cc2c(O)cccc2Cl)C1 ZINC000705476326 1117973332 /nfs/dbraw/zinc/97/33/32/1117973332.db2.gz IVWLSLRUMCCUNK-NSHDSACASA-N 1 0 253.773 3.668 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](C)Oc2ccccc2)c(O)c1 ZINC000186041045 1117974857 /nfs/dbraw/zinc/97/48/57/1117974857.db2.gz JJJJHWJPLZTNNC-HUUCEWRRSA-N 1 0 285.387 3.819 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCC[C@@H]1Cc1ccccc1 ZINC000179555485 1128747932 /nfs/dbraw/zinc/74/79/32/1128747932.db2.gz QAIAKOMVXIYADA-QGZVFWFLSA-N 1 0 267.372 3.599 20 10 CHCDRO COc1ccc(O)c(C[NH2+]C(C)(C)CC(C)(C)C)c1 ZINC000037100587 1118015944 /nfs/dbraw/zinc/01/59/44/1118015944.db2.gz VCOVFWGYEIJMIJ-UHFFFAOYSA-N 1 0 265.397 3.705 20 10 CHCDRO CC[C@H](O)C[N@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000179647538 1128752682 /nfs/dbraw/zinc/75/26/82/1128752682.db2.gz MJSQBUXBCPQAHC-YJBOKZPZSA-N 1 0 299.414 3.726 20 10 CHCDRO C[C@H]1CCC[N@H+](Cc2c(O)cccc2Cl)CC1 ZINC000211526962 1118072264 /nfs/dbraw/zinc/07/22/64/1118072264.db2.gz OUYJVIKGTWFAEU-NSHDSACASA-N 1 0 253.773 3.668 20 10 CHCDRO Oc1ccc2ccncc2c1C[NH+]1C[C@H]2CCCC[C@@H]2C1 ZINC000749976359 1118087426 /nfs/dbraw/zinc/08/74/26/1118087426.db2.gz LHCVHXPHDNPJKH-HUUCEWRRSA-N 1 0 282.387 3.562 20 10 CHCDRO Cc1cc(O)c(C[NH+]2C[C@H]3CCCC[C@@H]3C2)cc1C ZINC000749977869 1118090424 /nfs/dbraw/zinc/09/04/24/1118090424.db2.gz ROYKLJLNJXCUBR-HUUCEWRRSA-N 1 0 259.393 3.631 20 10 CHCDRO CCC[C@@H](C)[NH2+][C@H](C)c1ccc(N2CCOCC2)c(F)c1 ZINC000764435458 1118092398 /nfs/dbraw/zinc/09/23/98/1118092398.db2.gz NGHFHPFTYZHFQJ-ZIAGYGMSSA-N 1 0 294.414 3.502 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CC[C@](C)(O)c2ccccc2)c1 ZINC000187909907 1128757779 /nfs/dbraw/zinc/75/77/79/1128757779.db2.gz KSEWVJRSUBVAMU-BEFAXECRSA-N 1 0 299.414 3.649 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(N2CCSCC2)cc1)C(C)C ZINC000765081389 1118134107 /nfs/dbraw/zinc/13/41/07/1118134107.db2.gz QCUBWVHSHDCGFR-KRWDZBQOSA-N 1 0 292.492 3.764 20 10 CHCDRO C[C@@H]([NH2+]C/C=C\c1cccc(F)c1)c1ccccc1O ZINC001203536483 1118147819 /nfs/dbraw/zinc/14/78/19/1118147819.db2.gz VMHQPBZWZOZTPH-SCXUMTSISA-N 1 0 271.335 3.895 20 10 CHCDRO Cc1occc1C[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000765395384 1118148552 /nfs/dbraw/zinc/14/85/52/1118148552.db2.gz IJXASYYTFXXNHU-GFCCVEGCSA-N 1 0 258.365 3.505 20 10 CHCDRO C[C@H](COc1ccccc1)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000765438985 1118151447 /nfs/dbraw/zinc/15/14/47/1118151447.db2.gz OLVNGNAMTBVDGN-CVEARBPZSA-N 1 0 298.430 3.871 20 10 CHCDRO C[C@H](COc1ccccc1)[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000765438993 1118151641 /nfs/dbraw/zinc/15/16/41/1118151641.db2.gz OLVNGNAMTBVDGN-HZPDHXFCSA-N 1 0 298.430 3.871 20 10 CHCDRO COC[C@@H](C)[NH2+]Cc1ccc(N(C)C2CCCCC2)cc1 ZINC000765445126 1118152472 /nfs/dbraw/zinc/15/24/72/1118152472.db2.gz KUCKTYCVNBMTSN-OAHLLOKOSA-N 1 0 290.451 3.580 20 10 CHCDRO Cc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)CC2 ZINC000765474844 1118154299 /nfs/dbraw/zinc/15/42/99/1118154299.db2.gz QHJTXAUSBLZLDH-GOSISDBHSA-N 1 0 298.405 3.977 20 10 CHCDRO CC[C@@H]([NH2+]CCC1(COC)CC1)c1cc(Cl)ccc1O ZINC000842890507 1118157562 /nfs/dbraw/zinc/15/75/62/1118157562.db2.gz FZAGECVBBHYOKL-CQSZACIVSA-N 1 0 297.826 3.903 20 10 CHCDRO CC[C@@H]([NH2+]CCC1(COC)CC1)c1ccc(C)cc1O ZINC000842890568 1118157632 /nfs/dbraw/zinc/15/76/32/1118157632.db2.gz HSZYTMXRCBKSRJ-OAHLLOKOSA-N 1 0 277.408 3.558 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCS[C@H]1C)c1cc2c(cc1O)CCCC2 ZINC000842927862 1118171342 /nfs/dbraw/zinc/17/13/42/1118171342.db2.gz GEXHKSIDGOQYSA-MQIPJXDCSA-N 1 0 291.460 3.816 20 10 CHCDRO CC(C)=CCC[C@@H](C)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000765607349 1118181090 /nfs/dbraw/zinc/18/10/90/1118181090.db2.gz BKDJBUWPPVUGOC-CQSZACIVSA-N 1 0 259.393 3.846 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cccc(OC)c1 ZINC000765607345 1118181545 /nfs/dbraw/zinc/18/15/45/1118181545.db2.gz BHEJBQPHCMZRNB-SFHVURJKSA-N 1 0 297.398 3.871 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CCN(CC)C(C)C)cc1 ZINC000765626840 1118184498 /nfs/dbraw/zinc/18/44/98/1118184498.db2.gz DGNGROLLNDLBNP-INIZCTEOSA-N 1 0 291.483 3.524 20 10 CHCDRO C[C@H]([NH2+]CCOC1CCCCCC1)c1ccccc1O ZINC000179875630 1128763804 /nfs/dbraw/zinc/76/38/04/1128763804.db2.gz UIXGQWGMVQZBDZ-AWEZNQCLSA-N 1 0 277.408 3.782 20 10 CHCDRO Oc1ccccc1C[NH+]1CCC(c2ccsc2)CC1 ZINC000188692765 1128764378 /nfs/dbraw/zinc/76/43/78/1128764378.db2.gz JDBXKNQBWOUTAT-UHFFFAOYSA-N 1 0 273.401 3.833 20 10 CHCDRO C[C@H]([NH2+]CCO[C@H]1CCCC[C@@H]1C)c1ccccc1O ZINC000179899048 1128764526 /nfs/dbraw/zinc/76/45/26/1128764526.db2.gz NOAFLZSUMYVRFM-ZQIUZPCESA-N 1 0 277.408 3.638 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccc(F)c(F)c1)c1ccccc1O ZINC000179900521 1128765305 /nfs/dbraw/zinc/76/53/05/1128765305.db2.gz BKYPHZFACGNKFI-LLVKDONJSA-N 1 0 277.314 3.564 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@@H](C)CCC(C)(C)C)c1 ZINC000385986356 1118255874 /nfs/dbraw/zinc/25/58/74/1118255874.db2.gz ADMDQHSRFZEDHQ-LBPRGKRZSA-N 1 0 265.397 3.705 20 10 CHCDRO CCOc1cccc(C[N@H+](C)[C@@H]2CCc3ccccc32)c1O ZINC000179944244 1128768170 /nfs/dbraw/zinc/76/81/70/1128768170.db2.gz IAKYFJVGEZSPON-QGZVFWFLSA-N 1 0 297.398 3.910 20 10 CHCDRO C[C@H](c1ccco1)[N@H+](Cc1cc(F)ccc1O)C1CC1 ZINC000179984974 1128769968 /nfs/dbraw/zinc/76/99/68/1128769968.db2.gz LJKUWBRBKPLNPF-LLVKDONJSA-N 1 0 275.323 3.850 20 10 CHCDRO COc1cccc(C2CC[NH+](Cc3ccccc3O)CC2)c1 ZINC000180023350 1128771758 /nfs/dbraw/zinc/77/17/58/1128771758.db2.gz LNVYZSAYMCLUAK-UHFFFAOYSA-N 1 0 297.398 3.780 20 10 CHCDRO C[C@H](C[NH2+]Cc1c(O)cccc1Cl)c1ccccc1 ZINC000083551388 1118356465 /nfs/dbraw/zinc/35/64/65/1118356465.db2.gz QPXYQKCDVYLZEM-GFCCVEGCSA-N 1 0 275.779 3.939 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCC[C@@H]1c1ccccc1F ZINC001203556181 1118368685 /nfs/dbraw/zinc/36/86/85/1118368685.db2.gz MKPRKNMKCJCVOT-MRXNPFEDSA-N 1 0 271.335 3.868 20 10 CHCDRO CC[C@@H]1CCC[C@H]([NH2+]Cc2ccc3c(c2)CCO3)C1 ZINC000085064328 1118414303 /nfs/dbraw/zinc/41/43/03/1118414303.db2.gz HFNYRIQITCQIHP-CJNGLKHVSA-N 1 0 259.393 3.680 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CC[C@@](C)(O)c2ccccc2)c1 ZINC000187909967 1118438236 /nfs/dbraw/zinc/43/82/36/1118438236.db2.gz KSEWVJRSUBVAMU-DNVCBOLYSA-N 1 0 299.414 3.649 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2[C@H](C)C[C@H]3CCCC[C@@H]32)c1 ZINC000180234959 1128782484 /nfs/dbraw/zinc/78/24/84/1128782484.db2.gz PSEQHFQVZRPVKW-IOASZLSFSA-N 1 0 275.392 3.554 20 10 CHCDRO CC[C@H]([NH2+]CC[C@@H]1CCCCO1)c1ccc(N(C)C)cc1 ZINC000180255630 1128784702 /nfs/dbraw/zinc/78/47/02/1128784702.db2.gz SNDJBTSBLYVSLX-ROUUACIJSA-N 1 0 290.451 3.753 20 10 CHCDRO CSCC1CCC([NH2+][C@@H](C)c2ccccc2O)CC1 ZINC000296335476 1118574899 /nfs/dbraw/zinc/57/48/99/1118574899.db2.gz HNXKBHXAUUGBHZ-HSBZDZAISA-N 1 0 279.449 3.965 20 10 CHCDRO CCC[N@H+](Cc1csc(C)n1)Cc1ccccc1O ZINC000076724907 1128787632 /nfs/dbraw/zinc/78/76/32/1128787632.db2.gz LXFGTQROTLLXPP-UHFFFAOYSA-N 1 0 276.405 3.569 20 10 CHCDRO C[C@H]1CC[C@H](C)[N@H+](Cc2c(O)cccc2Br)C1 ZINC000707146235 1118648404 /nfs/dbraw/zinc/64/84/04/1118648404.db2.gz KLNFQHYYTWAKHP-QWRGUYRKSA-N 1 0 298.224 3.775 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N2CCSCC2)cc1)C1CCC1 ZINC000178204289 1118725517 /nfs/dbraw/zinc/72/55/17/1118725517.db2.gz LGTPLJKLKOAGFV-AWEZNQCLSA-N 1 0 290.476 3.518 20 10 CHCDRO CC1CCN(c2ccc(C[NH2+]Cc3ccncc3)cc2)CC1 ZINC000108423578 1119025736 /nfs/dbraw/zinc/02/57/36/1119025736.db2.gz OIZDJBOFMVKAMW-UHFFFAOYSA-N 1 0 295.430 3.608 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CCc2ccccc2C1)c1ccccc1O ZINC000051630634 1119059447 /nfs/dbraw/zinc/05/94/47/1119059447.db2.gz PDUOEDIFTXLFGN-FUHWJXTLSA-N 1 0 281.399 3.990 20 10 CHCDRO CCOCC[N@H+](Cc1ccccc1O)[C@H](C)c1ccccc1 ZINC000176673085 1119092607 /nfs/dbraw/zinc/09/26/07/1119092607.db2.gz CNGKRBQFXIGULQ-MRXNPFEDSA-N 1 0 299.414 3.992 20 10 CHCDRO C[C@H]1CCC[C@@H]([N@H+](C)Cc2cc(F)ccc2O)C1 ZINC000226562211 1119156836 /nfs/dbraw/zinc/15/68/36/1119156836.db2.gz AWELTMRVDQJAAH-SMDDNHRTSA-N 1 0 251.345 3.542 20 10 CHCDRO CSC1(C[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3C)CC1 ZINC000228024579 1119388854 /nfs/dbraw/zinc/38/88/54/1119388854.db2.gz ZGHPVUDLJPGZMS-NEPJUHHUSA-N 1 0 277.433 3.734 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CC[C@@H](C)CC1)c1ccc(F)cc1[O-] ZINC000252817226 1119467216 /nfs/dbraw/zinc/46/72/16/1119467216.db2.gz XTKDPJQCGFXZLM-NQBHXWOUSA-N 1 0 251.345 3.761 20 10 CHCDRO CC[N@H+](Cc1cc(C)c(C)cc1O)[C@H]1CCOC(C)(C)C1 ZINC000291536351 1119649189 /nfs/dbraw/zinc/64/91/89/1119649189.db2.gz KUZPRJBFPSPSHL-INIZCTEOSA-N 1 0 291.435 3.789 20 10 CHCDRO COc1cccc(C[NH2+]Cc2ccccc2C(C)C)c1O ZINC000782538989 1119649977 /nfs/dbraw/zinc/64/99/77/1119649977.db2.gz AZBQNAOGYLPQID-UHFFFAOYSA-N 1 0 285.387 3.814 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000179575787 1119751540 /nfs/dbraw/zinc/75/15/40/1119751540.db2.gz MTJPDPXSBOJCMI-KRWDZBQOSA-N 1 0 257.377 3.715 20 10 CHCDRO Cc1c(O)ccc(C[NH+]2CCC3(CC[C@@H](F)C3)CC2)c1O ZINC001140749404 1119795552 /nfs/dbraw/zinc/79/55/52/1119795552.db2.gz YHDYEQUDXUXWQG-CQSZACIVSA-N 1 0 293.382 3.510 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1cncc(F)c1 ZINC000177975196 1119893926 /nfs/dbraw/zinc/89/39/26/1119893926.db2.gz MNJQNGSFMHURNP-CQSZACIVSA-N 1 0 299.393 3.672 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]Cc1cc2ccccc2[nH]1 ZINC000725849930 1119915407 /nfs/dbraw/zinc/91/54/07/1119915407.db2.gz ADFNVAFLBQPDRT-UHFFFAOYSA-N 1 0 286.762 3.817 20 10 CHCDRO CC[C@@H]([NH2+]CCCOC(C)C)c1ccc(N(C)C)cc1 ZINC000178192504 1119944292 /nfs/dbraw/zinc/94/42/92/1119944292.db2.gz HEFXUKUDAAAQKM-QGZVFWFLSA-N 1 0 278.440 3.608 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@@H](C)CC2CCCCC2)c1 ZINC000694674883 1120014713 /nfs/dbraw/zinc/01/47/13/1120014713.db2.gz MQQPTXBGIUADLY-ZDUSSCGKSA-N 1 0 277.408 3.849 20 10 CHCDRO CCCN(CCC)c1ccc(C[NH2+][C@@H](C)C[C@@H](C)O)cc1 ZINC000782977986 1120103506 /nfs/dbraw/zinc/10/35/06/1120103506.db2.gz HUOUWKJEPQIVFM-JKSUJKDBSA-N 1 0 292.467 3.562 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H](C)c1ccncc1 ZINC000840893353 1120140459 /nfs/dbraw/zinc/14/04/59/1120140459.db2.gz IUPYFOIHOQZYLD-JKSUJKDBSA-N 1 0 297.446 3.738 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@H]2CCCCC23CCCC3)c1 ZINC000314210354 1120177472 /nfs/dbraw/zinc/17/74/72/1120177472.db2.gz UWOIWVVBJDZEGV-KRWDZBQOSA-N 1 0 289.419 3.993 20 10 CHCDRO COc1cccc(C[N@@H+]2CCc3sccc3[C@H]2C)c1O ZINC000271018986 1120226498 /nfs/dbraw/zinc/22/64/98/1120226498.db2.gz AYZAPYHKWGZKDK-LLVKDONJSA-N 1 0 289.400 3.582 20 10 CHCDRO FC1(F)CCC[C@H]([NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC000921861668 1120257241 /nfs/dbraw/zinc/25/72/41/1120257241.db2.gz YFHCYRYJTPGKDH-AWEZNQCLSA-N 1 0 281.346 3.679 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCC[C@H]3CCC[C@H]32)c1O ZINC000228173059 1120272779 /nfs/dbraw/zinc/27/27/79/1120272779.db2.gz HBAIIESLPVJOEN-UKRRQHHQSA-N 1 0 275.392 3.555 20 10 CHCDRO CSCC[NH2+][C@@H](C)c1cc(Cl)c(Cl)cc1[O-] ZINC000309883154 1120282878 /nfs/dbraw/zinc/28/28/78/1120282878.db2.gz WOILVXYYMYXAQK-ZETCQYMHSA-N 1 0 280.220 3.713 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CCc3ccccc32)c1 ZINC000182802828 1120328973 /nfs/dbraw/zinc/32/89/73/1120328973.db2.gz BNAUHLYJISEMCA-DZGCQCFKSA-N 1 0 297.398 3.781 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1ccccc1O)c1c(C)noc1C ZINC000183630540 1120344054 /nfs/dbraw/zinc/34/40/54/1120344054.db2.gz JGYHBSRHWXKGNM-HZMBPMFUSA-N 1 0 274.364 3.799 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCc2ccc3c(c2)CCO3)c(O)c1 ZINC000185451972 1120376985 /nfs/dbraw/zinc/37/69/85/1120376985.db2.gz BEOHRSANYQUZOW-CQSZACIVSA-N 1 0 297.398 3.529 20 10 CHCDRO CCCC[C@@H](COC)[NH2+][C@H](C)c1cc(C)ccc1O ZINC000185494431 1120378851 /nfs/dbraw/zinc/37/88/51/1120378851.db2.gz WGILMHJTFTWSBC-KGLIPLIRSA-N 1 0 265.397 3.556 20 10 CHCDRO FC1(F)CCC[C@@H]1C[NH2+]Cc1ccc2c(c1)CCCO2 ZINC000922159423 1120397206 /nfs/dbraw/zinc/39/72/06/1120397206.db2.gz SBXFENZHLUOWAU-CQSZACIVSA-N 1 0 281.346 3.537 20 10 CHCDRO COc1cccc(C[NH2+]C(CC(C)C)CC(C)C)c1O ZINC000728781841 1120502947 /nfs/dbraw/zinc/50/29/47/1120502947.db2.gz CSPLJYWOKOZPME-UHFFFAOYSA-N 1 0 279.424 3.951 20 10 CHCDRO CCC(CC)C[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1 ZINC000123432140 1120545553 /nfs/dbraw/zinc/54/55/53/1120545553.db2.gz WVGSSFDTLSHXPA-HNNXBMFYSA-N 1 0 290.451 3.610 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccc(F)cc1F)c1cc(F)ccc1O ZINC000756578869 1120552405 /nfs/dbraw/zinc/55/24/05/1120552405.db2.gz XHSFXGNGQJXJQO-SNVBAGLBSA-N 1 0 295.304 3.703 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+][C@@H](c1ccccn1)C1CC1 ZINC000922587190 1120558141 /nfs/dbraw/zinc/55/81/41/1120558141.db2.gz YGWXKUDCZLGRRR-MRXNPFEDSA-N 1 0 288.778 3.682 20 10 CHCDRO Cc1csc([C@@H](C)C[NH2+][C@H](C)c2ccc(C)cc2O)n1 ZINC000186573107 1120587284 /nfs/dbraw/zinc/58/72/84/1120587284.db2.gz OFDFHEKWTYTUJZ-WCQYABFASA-N 1 0 290.432 3.920 20 10 CHCDRO CC(C)([NH2+]Cc1ccccc1O)c1ccc(F)cc1 ZINC000236699284 1120599544 /nfs/dbraw/zinc/59/95/44/1120599544.db2.gz MWWRVXVENQOTDX-UHFFFAOYSA-N 1 0 259.324 3.556 20 10 CHCDRO Cc1cnc(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)s1 ZINC000756612297 1120605730 /nfs/dbraw/zinc/60/57/30/1120605730.db2.gz ZLOMWRXIDVVELH-KWQFWETISA-N 1 0 292.379 3.634 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H]2CCSC3(CCC3)C2)cc1C ZINC000922844882 1120612625 /nfs/dbraw/zinc/61/26/25/1120612625.db2.gz IFIKRKWELLIPHE-HNNXBMFYSA-N 1 0 291.460 3.917 20 10 CHCDRO c1cnc2c(c1)CCC[C@@H]2[NH2+]Cc1ccc2c(c1)CCCO2 ZINC000922886888 1120633250 /nfs/dbraw/zinc/63/32/50/1120633250.db2.gz WGBDJHFHAQHJKB-KRWDZBQOSA-N 1 0 294.398 3.574 20 10 CHCDRO C[C@H]([NH2+][C@H]1COCC1(C)C)c1ccc2ccccc2c1O ZINC000313016793 1120672765 /nfs/dbraw/zinc/67/27/65/1120672765.db2.gz GZFGIPRPQVLJSI-LRDDRELGSA-N 1 0 285.387 3.621 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCc2c1cccc2F ZINC000766029581 1120672856 /nfs/dbraw/zinc/67/28/56/1120672856.db2.gz OGFWELCOBVWAPC-LJQANCHMSA-N 1 0 298.405 3.977 20 10 CHCDRO C[C@@H](C[NH2+][C@@H]1CCc2cccc(O)c21)c1ccccc1 ZINC000313529982 1120747631 /nfs/dbraw/zinc/74/76/31/1120747631.db2.gz MUEQEGMRLKXXDB-XJKSGUPXSA-N 1 0 267.372 3.773 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CCC3(CCCC3)C2)c1 ZINC000093336668 1120785534 /nfs/dbraw/zinc/78/55/34/1120785534.db2.gz RNRWFYODFQOJFI-UHFFFAOYSA-N 1 0 275.392 3.557 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc3c(c2)COC3)c(O)c1 ZINC000756759434 1120804358 /nfs/dbraw/zinc/80/43/58/1120804358.db2.gz KJGWNDUILIVIDQ-ZDUSSCGKSA-N 1 0 283.371 3.582 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+][C@H]2CCOC(C)(C)C2)c2c1c(F)ccc2O ZINC000756771224 1120821833 /nfs/dbraw/zinc/82/18/33/1120821833.db2.gz SQHLXDNLAJETPX-MDZLAQPJSA-N 1 0 293.382 3.627 20 10 CHCDRO COc1cccc(CC[NH2+][C@@H](C)c2ccc(C)cc2O)c1 ZINC000185040565 1120909349 /nfs/dbraw/zinc/90/93/49/1120909349.db2.gz KJXVAFQHIDSQIS-AWEZNQCLSA-N 1 0 285.387 3.603 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)Cc2ccccc2C)c1 ZINC000314478016 1120953653 /nfs/dbraw/zinc/95/36/53/1120953653.db2.gz OUHRJOACTFEUMT-GJZGRUSLSA-N 1 0 299.414 3.991 20 10 CHCDRO COc1cc(C[NH2+][C@@H](C)C2(C)CC2)c(O)c(C(C)(C)C)c1 ZINC001649122971 1121034078 /nfs/dbraw/zinc/03/40/78/1121034078.db2.gz MSOYRJTXQORLQV-LBPRGKRZSA-N 1 0 291.435 3.977 20 10 CHCDRO CCN(C[C@H]1CCCC[N@@H+]1C(C)C)c1ccc(OC)cc1 ZINC001167835455 1121035907 /nfs/dbraw/zinc/03/59/07/1121035907.db2.gz QQPDEMYLAHFNSK-QGZVFWFLSA-N 1 0 290.451 3.784 20 10 CHCDRO Cc1cc(C[NH2+][C@H](C)[C@@H]2CCOC2)c(C)n1-c1ccccc1 ZINC000317698838 1121036967 /nfs/dbraw/zinc/03/69/67/1121036967.db2.gz HAEVCOFHHRGQQP-NVXWUHKLSA-N 1 0 298.430 3.609 20 10 CHCDRO COc1ccc(C[N@H+](C)Cc2cc(C)c(C)cc2O)cc1 ZINC000006209132 1121043557 /nfs/dbraw/zinc/04/35/57/1121043557.db2.gz NMFGWMOADGXYIR-UHFFFAOYSA-N 1 0 285.387 3.650 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@@H](O)CC(C)(C)C)cc1 ZINC000766060538 1121068595 /nfs/dbraw/zinc/06/85/95/1121068595.db2.gz LZNQLYKKQCUCST-PBHICJAKSA-N 1 0 292.467 3.590 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CC[C@H]2CC2(F)F)cc1 ZINC000701978466 1121176060 /nfs/dbraw/zinc/17/60/60/1121176060.db2.gz VTJHZSHFCYXMGC-AWEZNQCLSA-N 1 0 282.378 3.668 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CC[C@@H]2CC2(F)F)cc1 ZINC000701978468 1121176085 /nfs/dbraw/zinc/17/60/85/1121176085.db2.gz VTJHZSHFCYXMGC-CQSZACIVSA-N 1 0 282.378 3.668 20 10 CHCDRO CCCC[C@@H](COC)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000766076212 1121184345 /nfs/dbraw/zinc/18/43/45/1121184345.db2.gz QMGLLLDIHGIBCN-HOCLYGCPSA-N 1 0 278.440 3.608 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H]2C[C@H](OC(C)C)C2(C)C)cc1C ZINC000766087912 1121205780 /nfs/dbraw/zinc/20/57/80/1121205780.db2.gz HEZVBSYEAIIBFY-IRXDYDNUSA-N 1 0 291.435 3.691 20 10 CHCDRO COc1ccc(N2CCC([NH2+]C[C@H](C)C(C)C)CC2)cc1 ZINC000766113546 1121266393 /nfs/dbraw/zinc/26/63/93/1121266393.db2.gz OCNPWPQPPYPPAB-HNNXBMFYSA-N 1 0 290.451 3.546 20 10 CHCDRO Cc1cccc(C[NH2+]C2CCC(OC(C)C)CC2)c1O ZINC000703795648 1121302122 /nfs/dbraw/zinc/30/21/22/1121302122.db2.gz XUNSOQRYKNEUII-UHFFFAOYSA-N 1 0 277.408 3.526 20 10 CHCDRO Oc1ccc(F)c(Cl)c1C[N@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC001237122774 1128979021 /nfs/dbraw/zinc/97/90/21/1128979021.db2.gz YQBWMLCDGHROFS-PHIMTYICSA-N 1 0 283.774 3.807 20 10 CHCDRO C[C@@H]([NH2+]CC[C@@H]1CCSC1)c1ccc(N(C)C)cc1 ZINC000704775147 1121368735 /nfs/dbraw/zinc/36/87/35/1121368735.db2.gz KJOJWSSDGJHCCY-ZIAGYGMSSA-N 1 0 278.465 3.546 20 10 CHCDRO COc1cccc(C[NH2+]Cc2ccc3ccccc3c2)c1O ZINC000237401229 1121381437 /nfs/dbraw/zinc/38/14/37/1121381437.db2.gz SXTABMAXCQQDIQ-UHFFFAOYSA-N 1 0 293.366 3.844 20 10 CHCDRO CCC[C@H](C[NH2+][C@H](C)c1cc(C)ccc1O)OCC ZINC000705314325 1121395901 /nfs/dbraw/zinc/39/59/01/1121395901.db2.gz HVSKCTGAGPLFQJ-ZIAGYGMSSA-N 1 0 265.397 3.556 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]C[C@H]1CCCC13CC3)CC2 ZINC000707057399 1121449104 /nfs/dbraw/zinc/44/91/04/1121449104.db2.gz KCNFUJJVFZPTNR-ZIAGYGMSSA-N 1 0 257.377 3.549 20 10 CHCDRO CC(C)CCCC[NH2+]Cc1cc(Cl)ccc1O ZINC000096867581 1121459836 /nfs/dbraw/zinc/45/98/36/1121459836.db2.gz FPCASHWCOIRYBO-UHFFFAOYSA-N 1 0 255.789 3.962 20 10 CHCDRO CCC[C@H](C[NH2+][C@@H](C)c1ccc(N(C)C)cc1)OCC ZINC000707801303 1121463234 /nfs/dbraw/zinc/46/32/34/1121463234.db2.gz OORPKQNYHCGJSL-WMLDXEAASA-N 1 0 278.440 3.608 20 10 CHCDRO COc1cccc(C[N@@H+]2CCC[C@@H](C(C)(C)C)C2)c1O ZINC000708455665 1121464446 /nfs/dbraw/zinc/46/44/46/1121464446.db2.gz XSLWAOARBFCHHZ-CQSZACIVSA-N 1 0 277.408 3.659 20 10 CHCDRO Cc1ccc(CC[NH2+][C@@H](C)c2ccc(N(C)C)cc2)o1 ZINC000709765392 1121469564 /nfs/dbraw/zinc/46/95/64/1121469564.db2.gz UGOUMCSWDWRNFB-AWEZNQCLSA-N 1 0 272.392 3.547 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)CC1CCC1)c1ccc(N(C)C)cc1 ZINC000710229790 1121474643 /nfs/dbraw/zinc/47/46/43/1121474643.db2.gz VNSCBKALQGLKQF-UONOGXRCSA-N 1 0 260.425 3.982 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)CC(C)(C)OC)cc1 ZINC000236908465 1121476769 /nfs/dbraw/zinc/47/67/69/1121476769.db2.gz UZGUHLPJBLRCCQ-HNNXBMFYSA-N 1 0 292.467 3.826 20 10 CHCDRO CCOc1cccc(C[NH2+]CC(C)(C)c2ccccc2)c1O ZINC000236923592 1121484509 /nfs/dbraw/zinc/48/45/09/1121484509.db2.gz DISSFIYEANPJRA-UHFFFAOYSA-N 1 0 299.414 3.858 20 10 CHCDRO COC[C@@H](C)C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000178667385 1121490930 /nfs/dbraw/zinc/49/09/30/1121490930.db2.gz PLKSSKYCOQITIU-JKSUJKDBSA-N 1 0 290.451 3.610 20 10 CHCDRO COc1ccc(C[NH2+][C@]2(C)CCOc3ccccc32)cc1C ZINC000923025723 1121513795 /nfs/dbraw/zinc/51/37/95/1121513795.db2.gz OAOWWCBYMJYQLF-LJQANCHMSA-N 1 0 297.398 3.791 20 10 CHCDRO COc1cc(O)c(C[NH2+]C(C)(C)CC(C)(C)C)cc1OC ZINC000182661089 1128992314 /nfs/dbraw/zinc/99/23/14/1128992314.db2.gz UHPBCHJPZBLPHY-UHFFFAOYSA-N 1 0 295.423 3.714 20 10 CHCDRO CSCCCC[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2C ZINC000168784525 1121609649 /nfs/dbraw/zinc/60/96/49/1121609649.db2.gz OKHCJWBSMICFNK-STQMWFEESA-N 1 0 279.449 3.982 20 10 CHCDRO CSCC[C@H](C)[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2C ZINC000168788905 1121610027 /nfs/dbraw/zinc/61/00/27/1121610027.db2.gz USRLCZFZKXAQQD-AVGNSLFASA-N 1 0 279.449 3.980 20 10 CHCDRO CSC[C@H](C)[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C ZINC000168786433 1121610387 /nfs/dbraw/zinc/61/03/87/1121610387.db2.gz SGLZTHPCGXCBMI-SDDRHHMPSA-N 1 0 265.422 3.590 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]CCC2=CCCCC2)c1 ZINC000237035837 1121651848 /nfs/dbraw/zinc/65/18/48/1121651848.db2.gz KWEXILOTMNZEHR-UHFFFAOYSA-N 1 0 275.392 3.771 20 10 CHCDRO CCOCc1cc(C[NH2+]Cc2ccc(C)cc2)ccc1OC ZINC001177066008 1121708678 /nfs/dbraw/zinc/70/86/78/1121708678.db2.gz KWABPGDFLBFNLP-UHFFFAOYSA-N 1 0 299.414 3.830 20 10 CHCDRO COc1cc(C)cc(C[NH2+][C@@H]2CCc3cc(C)ccc32)c1O ZINC000894205393 1121738099 /nfs/dbraw/zinc/73/80/99/1121738099.db2.gz YKLGUVOPHCVJHW-QGZVFWFLSA-N 1 0 297.398 3.795 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]C[C@@H]2Cc3ccccc32)cc1 ZINC001177724612 1121746488 /nfs/dbraw/zinc/74/64/88/1121746488.db2.gz DGIYUYYQQRBGAW-QWNKOJSDSA-N 1 0 292.426 3.695 20 10 CHCDRO CC[C@@H]1CCC[N@@H+]1Cc1cc(C(C)(C)C)cc(O)c1O ZINC000727825144 1121750515 /nfs/dbraw/zinc/75/05/15/1121750515.db2.gz WWEYLNHWGUWIJO-CQSZACIVSA-N 1 0 277.408 3.770 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2c(F)cncc2F)c(O)c1 ZINC000797128377 1121843159 /nfs/dbraw/zinc/84/31/59/1121843159.db2.gz RGBCGKXAMSIIKW-QWRGUYRKSA-N 1 0 292.329 3.786 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+]CCCOC(C)(C)C ZINC001179094976 1121850819 /nfs/dbraw/zinc/85/08/19/1121850819.db2.gz FKEFEOUUTGAFPT-UHFFFAOYSA-N 1 0 288.435 3.782 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CC2=CCCC2)c(Cl)c1 ZINC001179199496 1121857524 /nfs/dbraw/zinc/85/75/24/1121857524.db2.gz GKHUIXMSSZTAPW-UHFFFAOYSA-N 1 0 251.757 3.554 20 10 CHCDRO C[N@H+](CCc1ccccc1F)Cc1cc2c(cc1O)CCC2 ZINC000731661095 1121877046 /nfs/dbraw/zinc/87/70/46/1121877046.db2.gz DPXBFSXZCIQLPN-UHFFFAOYSA-N 1 0 299.389 3.695 20 10 CHCDRO Oc1ccccc1C[N@H+](C[C@H]1CCCCO1)C1CCCC1 ZINC000732204360 1121911920 /nfs/dbraw/zinc/91/19/20/1121911920.db2.gz JONYHHJRJJKHDX-QGZVFWFLSA-N 1 0 289.419 3.706 20 10 CHCDRO Oc1ccccc1C[N@H+](CC1CCCC1)C[C@H]1CCCO1 ZINC000732203447 1121912561 /nfs/dbraw/zinc/91/25/61/1121912561.db2.gz VANJDGUKSZRQQM-QGZVFWFLSA-N 1 0 289.419 3.563 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](CC(C)C)C2CC2)cc1Cl ZINC001179983602 1121932308 /nfs/dbraw/zinc/93/23/08/1121932308.db2.gz AQNCXBCFYLLZSO-UHFFFAOYSA-N 1 0 267.800 3.974 20 10 CHCDRO C[C@@H]1CC[C@@H](C)[NH+]1C/C=C/c1ccc(N(C)C)cc1 ZINC001180108868 1121951520 /nfs/dbraw/zinc/95/15/20/1121951520.db2.gz ZFFRYYZBDDHBAN-XEVLESSRSA-N 1 0 258.409 3.639 20 10 CHCDRO CC[C@@H]1C[C@H](C)C[N@@H+]1C/C=C\c1ccc(N(C)C)cc1 ZINC001180203298 1121963681 /nfs/dbraw/zinc/96/36/81/1121963681.db2.gz OFHJXFDUKUCKMF-RWGIFROESA-N 1 0 272.436 3.886 20 10 CHCDRO CCN(C)c1ccc(C[NH2+]C(C)(C)c2ccc(C)nc2)cc1 ZINC000773846882 1121971396 /nfs/dbraw/zinc/97/13/96/1121971396.db2.gz NOWFKRRPJJEARF-UHFFFAOYSA-N 1 0 297.446 3.871 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]CCCCOc2ccccc2)c1 ZINC000733327379 1121978329 /nfs/dbraw/zinc/97/83/29/1121978329.db2.gz UQCOXMXBHARXOJ-UHFFFAOYSA-N 1 0 285.387 3.649 20 10 CHCDRO CC[N@H+](CCC1CC1)Cc1ccc(N(C)C)cc1C ZINC001180613846 1122001285 /nfs/dbraw/zinc/00/12/85/1122001285.db2.gz VPASUVVECQQTDU-UHFFFAOYSA-N 1 0 260.425 3.683 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CC[C@@H]3CCCC[C@H]3C2)c(O)c1 ZINC001181196047 1122040801 /nfs/dbraw/zinc/04/08/01/1122040801.db2.gz HOLQTONBTLUGAH-OFQRWUPVSA-N 1 0 289.419 3.849 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCC[C@H]2C(C)C)c1 ZINC001181544818 1122061514 /nfs/dbraw/zinc/06/15/14/1122061514.db2.gz ZTQIRMUAAVETIN-DUVNUKRYSA-N 1 0 277.408 3.876 20 10 CHCDRO CCOC1CC([N@H+](C)Cc2cc(C(C)C)ccc2O)C1 ZINC001182129499 1122112380 /nfs/dbraw/zinc/11/23/80/1122112380.db2.gz YBFCUSOUOZZJNX-UHFFFAOYSA-N 1 0 277.408 3.515 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CC[C@H](C)C3(CCC3)C2)c(O)c1 ZINC000779605574 1129032007 /nfs/dbraw/zinc/03/20/07/1129032007.db2.gz UUFJBDBYCLJZAK-AWEZNQCLSA-N 1 0 289.419 3.803 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2ccc3c(c2)OCO3)c1 ZINC000192751117 1129033987 /nfs/dbraw/zinc/03/39/87/1129033987.db2.gz OQRNDLBTGKRUQS-QWHCGFSZSA-N 1 0 299.370 3.841 20 10 CHCDRO CO[C@](C)([C@H](C)[NH2+]Cc1cc(C(C)C)ccc1O)C1CC1 ZINC001182356442 1122147801 /nfs/dbraw/zinc/14/78/01/1122147801.db2.gz KJCTTXRKHKLLCB-SCLBCKFNSA-N 1 0 291.435 3.809 20 10 CHCDRO CCOC[C@H](C)[NH2+][C@H](C)c1cc(Cl)c(Cl)cc1[O-] ZINC000774359680 1122157103 /nfs/dbraw/zinc/15/71/03/1122157103.db2.gz OGYVXIAHVCEBJO-DTWKUNHWSA-N 1 0 292.206 3.775 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1O ZINC000271700422 1122171446 /nfs/dbraw/zinc/17/14/46/1122171446.db2.gz TZFIFKJABZNANC-RYUDHWBXSA-N 1 0 286.331 3.712 20 10 CHCDRO CCc1cccc(C[N@@H+]2CC[C@H](Oc3ccccc3)C2)c1O ZINC001182574065 1122175875 /nfs/dbraw/zinc/17/58/75/1122175875.db2.gz JMQADULOYPNRFH-SFHVURJKSA-N 1 0 297.398 3.608 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+][C@@H]2CCO[C@H](C(C)C)C2)c1O ZINC000271812884 1122176372 /nfs/dbraw/zinc/17/63/72/1122176372.db2.gz LHXVBRCWJOUQGU-CABCVRRESA-N 1 0 297.826 3.647 20 10 CHCDRO COc1ccccc1[C@@H]1CC[N@H+](Cc2cccc(C)c2O)C1 ZINC000271896626 1122181442 /nfs/dbraw/zinc/18/14/42/1122181442.db2.gz YGMUHIVRLBVJAI-OAHLLOKOSA-N 1 0 297.398 3.699 20 10 CHCDRO CCOc1ccc(C[NH2+]Cc2c(O)cccc2Cl)cc1 ZINC000271945282 1122183666 /nfs/dbraw/zinc/18/36/66/1122183666.db2.gz XFEVTXRTOGAEIN-UHFFFAOYSA-N 1 0 291.778 3.734 20 10 CHCDRO CC(C)C[C@H]1C[C@H]([NH2+]Cc2c(O)cccc2Cl)CCO1 ZINC000272034709 1122187816 /nfs/dbraw/zinc/18/78/16/1122187816.db2.gz UYMQQNSWSKWSCK-OLZOCXBDSA-N 1 0 297.826 3.729 20 10 CHCDRO CC(C)O[C@@H]1CCC[N@H+](Cc2cc(C(C)C)ccc2O)C1 ZINC001206544662 1122195638 /nfs/dbraw/zinc/19/56/38/1122195638.db2.gz MZFOYWIYTCKXKW-QGZVFWFLSA-N 1 0 291.435 3.905 20 10 CHCDRO Cc1cccc2oc(CC[NH2+][C@H](C)c3ccccc3O)nc21 ZINC000272872611 1122215226 /nfs/dbraw/zinc/21/52/26/1122215226.db2.gz OYBDDUCKMAPUJA-CYBMUJFWSA-N 1 0 296.370 3.735 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2cccc3c2OCO3)c(O)c1C ZINC000273302336 1122227596 /nfs/dbraw/zinc/22/75/96/1122227596.db2.gz BRRFMTKDPFBGTO-CYBMUJFWSA-N 1 0 299.370 3.589 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)cn1 ZINC000273369807 1122230462 /nfs/dbraw/zinc/23/04/62/1122230462.db2.gz FTJVDDBTJMYUEN-CQSZACIVSA-N 1 0 270.376 3.563 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc3c(c2)OCO3)c(O)c1C ZINC000273384105 1122230664 /nfs/dbraw/zinc/23/06/64/1122230664.db2.gz JAHVRGNCMWFHGD-ZDUSSCGKSA-N 1 0 299.370 3.589 20 10 CHCDRO CCn1cc(C[NH2+][C@@H](C)c2ccc3ccccc3c2O)cn1 ZINC000273446426 1122233187 /nfs/dbraw/zinc/23/31/87/1122233187.db2.gz FBABXOXYRCUYPD-ZDUSSCGKSA-N 1 0 295.386 3.613 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCO[C@H](C(C)C)C2)c(O)c1 ZINC000273503738 1122236837 /nfs/dbraw/zinc/23/68/37/1122236837.db2.gz QOVBBXDKOHDWGR-ZQIUZPCESA-N 1 0 277.408 3.555 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@](C)(O)c2ccccc2)c(O)c1C ZINC000273575677 1122239153 /nfs/dbraw/zinc/23/91/53/1122239153.db2.gz LSSIXGCFXDSPQO-KXBFYZLASA-N 1 0 299.414 3.567 20 10 CHCDRO CCC(CC)(CCO)C[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000273561301 1122239249 /nfs/dbraw/zinc/23/92/49/1122239249.db2.gz ICGLZGBCVFPMGX-OAHLLOKOSA-N 1 0 293.451 3.848 20 10 CHCDRO Cc1ccc2c(c1)C[N@@H+](Cc1cc(Cl)ccc1O)CC2 ZINC001203651011 1122415279 /nfs/dbraw/zinc/41/52/79/1122415279.db2.gz HVNJQFJJQWJLHL-UHFFFAOYSA-N 1 0 287.790 3.912 20 10 CHCDRO COc1ccc(C)cc1C[NH2+][C@@H](C)c1ccccc1O ZINC000775136589 1122437239 /nfs/dbraw/zinc/43/72/39/1122437239.db2.gz LNCBEMWBSQMLRG-ZDUSSCGKSA-N 1 0 271.360 3.560 20 10 CHCDRO Cc1cccc(OC[C@H](C)[NH2+][C@H](C)c2ccccc2O)c1 ZINC000183438584 1129055069 /nfs/dbraw/zinc/05/50/69/1129055069.db2.gz MODUMOCBDHBDEB-LSDHHAIUSA-N 1 0 285.387 3.819 20 10 CHCDRO C[C@@H]([NH2+]CCCCN(C)c1ccccc1)c1ccccc1O ZINC000183438829 1129055107 /nfs/dbraw/zinc/05/51/07/1129055107.db2.gz QVOGXFMPADHTGH-MRXNPFEDSA-N 1 0 298.430 3.959 20 10 CHCDRO CC(C)c1cccc(C[NH2+]Cc2cc3c(cc2O)OCO3)c1 ZINC000775329846 1122518037 /nfs/dbraw/zinc/51/80/37/1122518037.db2.gz SVEFTZAFCWBAGV-UHFFFAOYSA-N 1 0 299.370 3.534 20 10 CHCDRO CCc1ncc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)s1 ZINC000775364374 1122526997 /nfs/dbraw/zinc/52/69/97/1122526997.db2.gz POEAMNURUASDND-LBPRGKRZSA-N 1 0 289.448 3.622 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H]2CCC[C@@H]2OC)cc1 ZINC000775417567 1122558190 /nfs/dbraw/zinc/55/81/90/1122558190.db2.gz NCSRQESRKCYZMO-ZVZYQTTQSA-N 1 0 290.451 3.608 20 10 CHCDRO CC[C@H](CSC)[NH2+][C@H](CC)c1ccc(N(C)C)cc1 ZINC000775424702 1122561640 /nfs/dbraw/zinc/56/16/40/1122561640.db2.gz XLJHFXUZIICTRV-GDBMZVCRSA-N 1 0 280.481 3.935 20 10 CHCDRO CC[C@H]([NH2+]CCc1cc(C)ccc1OC)c1ccccc1O ZINC000775484708 1122616438 /nfs/dbraw/zinc/61/64/38/1122616438.db2.gz HQXXCLHZMTZMSI-KRWDZBQOSA-N 1 0 299.414 3.993 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](C)N(C)c1ccccc1)c1ccccc1O ZINC000775487019 1122616847 /nfs/dbraw/zinc/61/68/47/1122616847.db2.gz GAQORXMILILJDU-CRAIPNDOSA-N 1 0 298.430 3.958 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)CN1CCC[C@@H](C)C1)c1ccccc1O ZINC000775488016 1122616861 /nfs/dbraw/zinc/61/68/61/1122616861.db2.gz GAJMGAVRXNMTHJ-VYDXJSESSA-N 1 0 290.451 3.553 20 10 CHCDRO CC[C@H]([NH2+]CCc1c(F)cccc1F)c1ccccc1O ZINC000775490960 1122619758 /nfs/dbraw/zinc/61/97/58/1122619758.db2.gz FSBGLEMVLYSGMB-INIZCTEOSA-N 1 0 291.341 3.954 20 10 CHCDRO CC[C@H]([NH2+]CCCCCOC)c1cc(Cl)ccc1O ZINC000775497138 1122626528 /nfs/dbraw/zinc/62/65/28/1122626528.db2.gz NBYVFDOEZJYOGG-AWEZNQCLSA-N 1 0 285.815 3.903 20 10 CHCDRO CC[C@@H]([NH2+]CC(O)(CC)CC)c1cc(Cl)ccc1O ZINC000775496624 1122627042 /nfs/dbraw/zinc/62/70/42/1122627042.db2.gz LAXOQUBVLIAWDP-CYBMUJFWSA-N 1 0 285.815 3.637 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)CCOC)c1cc(Cl)ccc1O ZINC000775501457 1122628801 /nfs/dbraw/zinc/62/88/01/1122628801.db2.gz QVRJOWNKZUAPET-GXFFZTMASA-N 1 0 271.788 3.511 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc(C)no1)c1cc(Cl)ccc1O ZINC000775501236 1122628903 /nfs/dbraw/zinc/62/89/03/1122628903.db2.gz CRKPKWUOBUMNRB-CYBMUJFWSA-N 1 0 280.755 3.583 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CCCc2nc(C)ncc21)c1ccccc1O ZINC000775508736 1122629595 /nfs/dbraw/zinc/62/95/95/1122629595.db2.gz WSAUITUDUMSDJS-NVXWUHKLSA-N 1 0 297.402 3.609 20 10 CHCDRO CCc1cc(C[NH2+][C@@H](CC)c2cc(Cl)ccc2O)[nH]n1 ZINC000775508545 1122629656 /nfs/dbraw/zinc/62/96/56/1122629656.db2.gz VLAJSMPOGVTBGU-AWEZNQCLSA-N 1 0 293.798 3.572 20 10 CHCDRO CC[C@@H]([NH2+]CCCSC)c1cc(Cl)ccc1O ZINC000775508631 1122630070 /nfs/dbraw/zinc/63/00/70/1122630070.db2.gz WAMROXKZJLHQBA-GFCCVEGCSA-N 1 0 273.829 3.839 20 10 CHCDRO C[C@H](CCCC(F)(F)F)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000775502772 1122631463 /nfs/dbraw/zinc/63/14/63/1122631463.db2.gz ZARGBKHWYQYISL-LLVKDONJSA-N 1 0 287.325 3.832 20 10 CHCDRO CCc1cc(C[NH2+][C@@H](CC)c2cc(Cl)ccc2O)on1 ZINC000775509202 1122632060 /nfs/dbraw/zinc/63/20/60/1122632060.db2.gz JBUVQHAWIHCCTQ-AWEZNQCLSA-N 1 0 294.782 3.837 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCCC[C@@H]1O)c1cc(Cl)ccc1O ZINC000775508268 1122632152 /nfs/dbraw/zinc/63/21/52/1122632152.db2.gz BANLWBSYWOJBDX-UGFHNGPFSA-N 1 0 297.826 3.637 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CC[C@@H](CO)CC1)c1cc(Cl)ccc1O ZINC000775511848 1122633231 /nfs/dbraw/zinc/63/32/31/1122633231.db2.gz DOUDYVVVFQQAEA-LNSITVRQSA-N 1 0 297.826 3.637 20 10 CHCDRO CC[C@H]([NH2+]CC1(CCO)CCC1)c1cc(Cl)ccc1O ZINC000775521930 1122638566 /nfs/dbraw/zinc/63/85/66/1122638566.db2.gz FIRYYBFCPUDDAB-AWEZNQCLSA-N 1 0 297.826 3.639 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](c1cccnc1)C1CC1)c1ccccc1O ZINC000775526628 1122644020 /nfs/dbraw/zinc/64/40/20/1122644020.db2.gz SKBALXZFDJCXLX-SJLPKXTDSA-N 1 0 282.387 3.979 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCO[C@@H](C)C1)c1cc(Cl)ccc1O ZINC000775525737 1122645465 /nfs/dbraw/zinc/64/54/65/1122645465.db2.gz MWAFNMBVTKQVQQ-SUHUHFCYSA-N 1 0 283.799 3.654 20 10 CHCDRO CC[C@@H]([NH2+]CC[C@H]1CCOC1)c1cc(Cl)ccc1O ZINC000775552478 1122662135 /nfs/dbraw/zinc/66/21/35/1122662135.db2.gz VQSLIALKKNTYBG-SMDDNHRTSA-N 1 0 283.799 3.513 20 10 CHCDRO COC1(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)CCCCC1 ZINC000775562038 1122671163 /nfs/dbraw/zinc/67/11/63/1122671163.db2.gz ATAYHOYVRGCMJU-HNNXBMFYSA-N 1 0 290.451 3.753 20 10 CHCDRO CC(C)Oc1ccc(N(C)C[Si](C)(C)C)cc1 ZINC001193383812 1122687606 /nfs/dbraw/zinc/68/76/06/1122687606.db2.gz BGTBDMCMVMRHHA-UHFFFAOYSA-N 1 0 251.446 3.787 20 10 CHCDRO CC(C)C(C)(C)C[NH2+][C@H](C)c1cc(F)ccc1O ZINC000219269245 1122739773 /nfs/dbraw/zinc/73/97/73/1122739773.db2.gz SGPQWXGYGJWEHY-LLVKDONJSA-N 1 0 253.361 3.864 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1nc(C)cs1)c1ccccc1O ZINC000080274509 1129079567 /nfs/dbraw/zinc/07/95/67/1129079567.db2.gz KQAWFOGNMUGMMF-AAEUAGOBSA-N 1 0 276.405 3.959 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCCC[C@H](SC)C2)c1O ZINC000092064103 1122839844 /nfs/dbraw/zinc/83/98/44/1122839844.db2.gz ABOWQAUTYDVLHX-AWEZNQCLSA-N 1 0 295.448 3.508 20 10 CHCDRO Cc1cc(Br)cc(C[N@@H+](C)[C@@H](C)C2CC2)c1O ZINC000775649393 1122862955 /nfs/dbraw/zinc/86/29/55/1122862955.db2.gz KCYZGWFDSHEGKM-JTQLQIEISA-N 1 0 298.224 3.693 20 10 CHCDRO Cc1cc(Br)cc(C[N@@H+](C(C)C)C2CC2)c1O ZINC000775653978 1122865034 /nfs/dbraw/zinc/86/50/34/1122865034.db2.gz PWWDXWNXDQMGEB-UHFFFAOYSA-N 1 0 298.224 3.836 20 10 CHCDRO COc1ccc(N(C)CC[N@H+](C)C[C@H](C)CC(C)C)cc1 ZINC001195791180 1122888595 /nfs/dbraw/zinc/88/85/95/1122888595.db2.gz YJIWSMMDIGNSNC-MRXNPFEDSA-N 1 0 292.467 3.745 20 10 CHCDRO CC[C@H](C)[C@H](C)[N@H+](Cc1cc(OC)ccc1O)C1CC1 ZINC000775682509 1122901810 /nfs/dbraw/zinc/90/18/10/1122901810.db2.gz ZNJYCOGTWUHNEW-STQMWFEESA-N 1 0 277.408 3.800 20 10 CHCDRO COc1ccc(O)c(C[N@H+](C)[C@H](C)Cc2ccc(C)cc2)c1 ZINC000775710192 1122918559 /nfs/dbraw/zinc/91/85/59/1122918559.db2.gz JQOSHGMPWNZNDX-OAHLLOKOSA-N 1 0 299.414 3.772 20 10 CHCDRO CO[C@H](C)C[N@H+](Cc1cc(Cl)cc(C)c1O)C(C)C ZINC000775715230 1122922347 /nfs/dbraw/zinc/92/23/47/1122922347.db2.gz USTMPIKYXLLAHV-GFCCVEGCSA-N 1 0 285.815 3.599 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+]2CC[C@@H](C)[C@H]2C)c1O ZINC000775737055 1122929185 /nfs/dbraw/zinc/92/91/85/1122929185.db2.gz NXWGJKWGEHFONA-MWLCHTKSSA-N 1 0 253.773 3.584 20 10 CHCDRO Cc1cccc(C[N@H+]2CC=C(C(C)(C)C)CC2)c1O ZINC000775745263 1122935006 /nfs/dbraw/zinc/93/50/06/1122935006.db2.gz SRAUAJMYWWDBHQ-UHFFFAOYSA-N 1 0 259.393 3.879 20 10 CHCDRO Cc1cc(Br)cc(C[N@H+]2CC[C@H]2C(C)C)c1O ZINC000775763096 1122948488 /nfs/dbraw/zinc/94/84/88/1122948488.db2.gz DITVITDCIOMIGG-ZDUSSCGKSA-N 1 0 298.224 3.693 20 10 CHCDRO C[C@H]1c2sccc2CC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC001197432373 1122957003 /nfs/dbraw/zinc/95/70/03/1122957003.db2.gz ULQSXQWRZBCEJO-ZDUSSCGKSA-N 1 0 286.444 3.933 20 10 CHCDRO CCC(CC)(CCO)C[NH2+]Cc1c(O)cc(C)cc1Cl ZINC000840901813 1122971255 /nfs/dbraw/zinc/97/12/55/1122971255.db2.gz KBEAJPHPLPNTSK-UHFFFAOYSA-N 1 0 299.842 3.632 20 10 CHCDRO C[C@H]([NH2+]Cc1cccc(Cl)n1)c1ccc(N(C)C)cc1 ZINC000775834953 1122985729 /nfs/dbraw/zinc/98/57/29/1122985729.db2.gz WWEKYGFLKCGENU-LBPRGKRZSA-N 1 0 289.810 3.652 20 10 CHCDRO Oc1ccc(-c2ccccc2)cc1C[NH+]1CC(C(F)F)C1 ZINC000839141696 1123000576 /nfs/dbraw/zinc/00/05/76/1123000576.db2.gz WNJJKIZLBUJWGH-UHFFFAOYSA-N 1 0 289.325 3.756 20 10 CHCDRO CC[C@@H](C)C[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001201511566 1123113895 /nfs/dbraw/zinc/11/38/95/1123113895.db2.gz OGEOOUSICNDMCB-OAHLLOKOSA-N 1 0 260.425 3.765 20 10 CHCDRO Cc1cc(Br)cc(C[NH2+]CCCC2CC2)c1O ZINC000776208981 1123146161 /nfs/dbraw/zinc/14/61/61/1123146161.db2.gz PPXTZVQMBJHJPR-UHFFFAOYSA-N 1 0 298.224 3.743 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+]C[C@](C)(O)CCC(C)C)c1O ZINC000776209400 1123148254 /nfs/dbraw/zinc/14/82/54/1123148254.db2.gz VGVFJLOQEGOGOG-MRXNPFEDSA-N 1 0 299.842 3.631 20 10 CHCDRO Cc1ccc(CC[C@H](C)[NH2+]Cc2cccc(C)c2O)o1 ZINC000776218950 1123153143 /nfs/dbraw/zinc/15/31/43/1123153143.db2.gz DAQCCQIYKHTWGN-ZDUSSCGKSA-N 1 0 273.376 3.713 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CC23CCCC3)c(O)c1C ZINC000760040826 1123181288 /nfs/dbraw/zinc/18/12/88/1123181288.db2.gz LUMGYWUOOIJEES-DZGCQCFKSA-N 1 0 259.393 3.992 20 10 CHCDRO CCC1(O)CCC([NH2+]Cc2cc(Cl)cc(C)c2O)CC1 ZINC000776255721 1123187948 /nfs/dbraw/zinc/18/79/48/1123187948.db2.gz HFFJUQCUMLIEBZ-UHFFFAOYSA-N 1 0 297.826 3.527 20 10 CHCDRO C[C@@H]1CC[C@H](C[NH2+]C/C=C/c2ccc(N(C)C)cc2)C1 ZINC001202249939 1123190293 /nfs/dbraw/zinc/19/02/93/1123190293.db2.gz BWLKLEJOTYDSHP-LUJIMGINSA-N 1 0 272.436 3.792 20 10 CHCDRO Cc1ccc(CCC[N@@H+](C)Cc2ccc(N(C)C)cc2)cn1 ZINC000776266494 1123194941 /nfs/dbraw/zinc/19/49/41/1123194941.db2.gz WGDCMGQGFOOJRE-UHFFFAOYSA-N 1 0 297.446 3.521 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]CC2(C)CCCC2)c1 ZINC000108941280 1123233675 /nfs/dbraw/zinc/23/36/75/1123233675.db2.gz LPWWFIHJQZNNEF-LBPRGKRZSA-N 1 0 263.381 3.632 20 10 CHCDRO COc1cc(C[NH2+][C@@H](C)C2CC2)c(O)c(C(C)(C)C)c1 ZINC000850010354 1123236671 /nfs/dbraw/zinc/23/66/71/1123236671.db2.gz DQFABYDKAOJARB-NSHDSACASA-N 1 0 277.408 3.586 20 10 CHCDRO CCC1([NH2+]Cc2cc(OC)cc(C(C)(C)C)c2O)CC1 ZINC000850314761 1123253027 /nfs/dbraw/zinc/25/30/27/1123253027.db2.gz ZZTFFLISCPRDEX-UHFFFAOYSA-N 1 0 277.408 3.731 20 10 CHCDRO COc1cc(C[NH2+]CC[C@H](C)F)c(O)c(C(C)(C)C)c1 ZINC000850311761 1123253071 /nfs/dbraw/zinc/25/30/71/1123253071.db2.gz WEQOBEQPHJBFGZ-NSHDSACASA-N 1 0 283.387 3.536 20 10 CHCDRO CCOc1ccc(C[NH2+]Cc2cc(C)cc(C)c2)c(O)c1 ZINC000850366618 1123257418 /nfs/dbraw/zinc/25/74/18/1123257418.db2.gz FRJOOEDXGOYCLQ-UHFFFAOYSA-N 1 0 285.387 3.698 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]CCCOC(C)(C)C)cc1 ZINC000850369060 1123258411 /nfs/dbraw/zinc/25/84/11/1123258411.db2.gz GSYPPYNQUYSEDJ-SOFGYWHQSA-N 1 0 290.451 3.561 20 10 CHCDRO COCc1csc(C[NH2+]Cc2c(O)cccc2Cl)c1 ZINC000850378215 1123260438 /nfs/dbraw/zinc/26/04/38/1123260438.db2.gz YICCBGCJJKYISY-UHFFFAOYSA-N 1 0 297.807 3.543 20 10 CHCDRO CCOc1ccc(C[NH2+][C@@H](C)C2CCC(F)CC2)c(O)c1 ZINC000850396158 1123262601 /nfs/dbraw/zinc/26/26/01/1123262601.db2.gz QMMLRDDCCVTIII-OPFPJEHXSA-N 1 0 295.398 3.797 20 10 CHCDRO COc1cccc(C2([NH2+]Cc3cc(C)ccc3O)CCC2)c1 ZINC000850405244 1123263311 /nfs/dbraw/zinc/26/33/11/1123263311.db2.gz KYLQFEOSSSAHHC-UHFFFAOYSA-N 1 0 297.398 3.878 20 10 CHCDRO COc1cccc(C[NH2+][C@H]2CCCc3c(C)cccc32)c1O ZINC000850411817 1123264373 /nfs/dbraw/zinc/26/43/73/1123264373.db2.gz LMNISYFCOZDSBT-KRWDZBQOSA-N 1 0 297.398 3.876 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCN(C(C)(C)C)C2)c(O)c1C ZINC000850495019 1123275351 /nfs/dbraw/zinc/27/53/51/1123275351.db2.gz VBWSRKVSTDHZAW-GJZGRUSLSA-N 1 0 290.451 3.532 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CC)COCC1CC1)c1ccccc1O ZINC000850494119 1123275517 /nfs/dbraw/zinc/27/55/17/1123275517.db2.gz MZONSUVYKCQHGF-GOEBONIOSA-N 1 0 277.408 3.638 20 10 CHCDRO CSCC1(CC[NH2+][C@H]2CCc3cccc(O)c32)CC1 ZINC000850507475 1123276765 /nfs/dbraw/zinc/27/67/65/1123276765.db2.gz OKKXWMQNEAEMIC-ZDUSSCGKSA-N 1 0 277.433 3.502 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F)c1cscn1 ZINC000850511483 1123278334 /nfs/dbraw/zinc/27/83/34/1123278334.db2.gz GELYEKZPUOCOAT-FXPVBKGRSA-N 1 0 292.379 3.887 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2Cc3ccccc3[C@@H]2C)c1 ZINC000850517972 1123279173 /nfs/dbraw/zinc/27/91/73/1123279173.db2.gz IAFXFGZYAKZVAX-ZJNRKIDTSA-N 1 0 297.398 3.780 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2C[C@H](O)c3ccccc32)c(O)c1C ZINC000850526990 1123281827 /nfs/dbraw/zinc/28/18/27/1123281827.db2.gz DNDQFCMKKLAZOI-VHSSKADRSA-N 1 0 297.398 3.838 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+]CCC(C)(C)F)c2c1c(F)ccc2O ZINC000850532285 1123285980 /nfs/dbraw/zinc/28/59/80/1123285980.db2.gz SRMHLLXRFWTJMA-KOLCDFICSA-N 1 0 269.335 3.807 20 10 CHCDRO COCc1csc(C[NH2+][C@@H](C)c2cc(C)ccc2O)c1 ZINC000850533140 1123286097 /nfs/dbraw/zinc/28/60/97/1123286097.db2.gz RFYSTITVPZSCOR-LBPRGKRZSA-N 1 0 291.416 3.759 20 10 CHCDRO CC[C@H]([NH2+]C[C@]1(C)CC1(F)F)c1ccc(N(C)C)cc1 ZINC000850535282 1123286751 /nfs/dbraw/zinc/28/67/51/1123286751.db2.gz UFHKSEZRDFXCPY-GJZGRUSLSA-N 1 0 282.378 3.839 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCc2ccc(O)cc21)c1ccccc1O ZINC000850543759 1123289087 /nfs/dbraw/zinc/28/90/87/1123289087.db2.gz PNLHBYGTCDTURU-DLBZAZTESA-N 1 0 283.371 3.826 20 10 CHCDRO CC(C)[C@H](O)[C@H]([NH2+][C@@H](C)c1ccccc1O)c1ccccc1 ZINC000850555147 1123290851 /nfs/dbraw/zinc/29/08/51/1123290851.db2.gz MIQAYACUKFTLQK-KYNGSXCRSA-N 1 0 299.414 3.801 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@@H](C)C2CCC(F)CC2)c1O ZINC000850553728 1123291049 /nfs/dbraw/zinc/29/10/49/1123291049.db2.gz BPXPUNWMRHNXKW-MRFVTOPCSA-N 1 0 295.398 3.968 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](c2ccccc2)[C@H](C)O)c(O)c1C ZINC000850585153 1123296239 /nfs/dbraw/zinc/29/62/39/1123296239.db2.gz VZHLGAICSDPFML-RLFYNMQTSA-N 1 0 299.414 3.782 20 10 CHCDRO C[C@@H](O)[C@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1ccccc1 ZINC000850585146 1123296436 /nfs/dbraw/zinc/29/64/36/1123296436.db2.gz VXACVHRXNBQBFJ-KHYOSLBOSA-N 1 0 298.430 3.525 20 10 CHCDRO CC[C@H]([NH2+][C@@H](c1ccccc1)[C@H](C)O)c1ccc(C)cc1O ZINC000850583238 1123296565 /nfs/dbraw/zinc/29/65/65/1123296565.db2.gz JYCYHPSEWWHRHB-UCLAIMLFSA-N 1 0 299.414 3.863 20 10 CHCDRO C[N@H+](Cc1ccccc1O)Cc1ccc(F)cc1Cl ZINC000109771862 1123326218 /nfs/dbraw/zinc/32/62/18/1123326218.db2.gz IDQPNWUJBVVIPL-UHFFFAOYSA-N 1 0 279.742 3.817 20 10 CHCDRO CC(C)=CCC[N@@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000851841117 1123384251 /nfs/dbraw/zinc/38/42/51/1123384251.db2.gz NFZPNDIZJAWLGB-QGZVFWFLSA-N 1 0 289.419 3.730 20 10 CHCDRO CN(C)c1ccc(C[NH+]2CCC(c3ccco3)CC2)cc1 ZINC000852320536 1123403105 /nfs/dbraw/zinc/40/31/05/1123403105.db2.gz BGKGMJGSZKPTHK-UHFFFAOYSA-N 1 0 284.403 3.725 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC2(O)CCC(C)CC2)c(O)c1C ZINC000853238988 1123428785 /nfs/dbraw/zinc/42/87/85/1123428785.db2.gz XESINYXRGDFBMC-HBSPSFQMSA-N 1 0 291.435 3.601 20 10 CHCDRO CCOc1cccc(C[NH2+]C[C@H]2C[C@@H]2c2ccccc2)c1O ZINC000111398358 1123443205 /nfs/dbraw/zinc/44/32/05/1123443205.db2.gz UBQLQIJLMIFCLY-IAGOWNOFSA-N 1 0 297.398 3.684 20 10 CHCDRO CCc1cccc2c(CC[NH2+]Cc3ccccc3O)c[nH]c21 ZINC000111397661 1123443228 /nfs/dbraw/zinc/44/32/28/1123443228.db2.gz DPMPBVCWASPWQC-UHFFFAOYSA-N 1 0 294.398 3.768 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)CC2=CCSC2)cc1C(C)C ZINC000853618586 1123445295 /nfs/dbraw/zinc/44/52/95/1123445295.db2.gz HPWRONVTFRBSIC-UHFFFAOYSA-N 1 0 291.460 3.929 20 10 CHCDRO Cc1cccc(C)c1CC[NH2+][C@H](C)c1ccccc1O ZINC000783517752 1123455202 /nfs/dbraw/zinc/45/52/02/1123455202.db2.gz IFNBUCUBHCBRCO-OAHLLOKOSA-N 1 0 269.388 3.902 20 10 CHCDRO COc1cc(C)cc(C[NH2+][C@H](C)C2CCC(F)CC2)c1O ZINC000895327360 1123456989 /nfs/dbraw/zinc/45/69/89/1123456989.db2.gz MRUTXASMRUEWPN-DNOWBOINSA-N 1 0 295.398 3.716 20 10 CHCDRO CC[C@H]1CCC[N@@H+]1Cc1c(O)ccc2ccccc21 ZINC000112465876 1123491766 /nfs/dbraw/zinc/49/17/66/1123491766.db2.gz KVAQZXRDXZYTRO-AWEZNQCLSA-N 1 0 255.361 3.920 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2ccc(CC(C)C)nc2)c1 ZINC000895582138 1123495356 /nfs/dbraw/zinc/49/53/56/1123495356.db2.gz RUXDWMGWZYFJPU-UHFFFAOYSA-N 1 0 284.403 3.584 20 10 CHCDRO COC[C@H]1CCC[N@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000112961944 1123506108 /nfs/dbraw/zinc/50/61/08/1123506108.db2.gz FTIAOWRGOVHDOP-HNNXBMFYSA-N 1 0 291.435 3.682 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]CCc2c[nH]c3cccc(C)c23)c1 ZINC000113335142 1123521425 /nfs/dbraw/zinc/52/14/25/1123521425.db2.gz WRZJVSPXZLWQRN-UHFFFAOYSA-N 1 0 294.398 3.823 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2cc(C)ccc2O)c(C)c1 ZINC000113324252 1123521754 /nfs/dbraw/zinc/52/17/54/1123521754.db2.gz IILRTRXHKPOBRS-UHFFFAOYSA-N 1 0 255.361 3.607 20 10 CHCDRO COc1ccc(CC[C@H](C)[NH2+]Cc2cc(C)ccc2O)cc1 ZINC000113330272 1123521791 /nfs/dbraw/zinc/52/17/91/1123521791.db2.gz BFFPQQASQNYDES-HNNXBMFYSA-N 1 0 299.414 3.820 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+]2CCC[C@@H](C)[C@H]2C)c1O ZINC001237687804 1129129522 /nfs/dbraw/zinc/12/95/22/1129129522.db2.gz VHTMLUWJEUIEBP-ZYHUDNBSSA-N 1 0 267.800 3.974 20 10 CHCDRO CC[C@@H]([NH2+]CC[C@@H]1CC1(F)F)c1ccc(C)cc1O ZINC000857080644 1123584798 /nfs/dbraw/zinc/58/47/98/1123584798.db2.gz JZBDXYIHDCYYFO-DGCLKSJQSA-N 1 0 269.335 3.787 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CC[C@@H]2CC2(Cl)Cl)c1 ZINC000857081607 1123585835 /nfs/dbraw/zinc/58/58/35/1123585835.db2.gz HDYZMGXXDVSLLZ-GHMZBOCLSA-N 1 0 288.218 3.935 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC[C@H]2CC2(Cl)Cl)c(O)c1 ZINC000857082298 1123585976 /nfs/dbraw/zinc/58/59/76/1123585976.db2.gz MJOBFTXJSWCOIB-MNOVXSKESA-N 1 0 288.218 3.935 20 10 CHCDRO CCOc1ccc(C[NH2+]Cc2ccc(N(C)C)cc2C)cc1 ZINC000115629075 1123619857 /nfs/dbraw/zinc/61/98/57/1123619857.db2.gz YVHIGYCNXQGANI-UHFFFAOYSA-N 1 0 298.430 3.750 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CCC[C@H]3CCC[C@H]32)c1O ZINC000228631178 1123634108 /nfs/dbraw/zinc/63/41/08/1123634108.db2.gz SKMCTMWNNIIWDB-BXUZGUMPSA-N 1 0 295.810 3.819 20 10 CHCDRO CN(C)c1cc(F)c(C[NH2+]CCCC(C)(F)F)cc1F ZINC000858171180 1123636139 /nfs/dbraw/zinc/63/61/39/1123636139.db2.gz WHWOLAYMJQJJMV-UHFFFAOYSA-N 1 0 292.320 3.556 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C/C=C/c2ccc(N(C)C)cc2)c1 ZINC000858239687 1123639375 /nfs/dbraw/zinc/63/93/75/1123639375.db2.gz SDSZAABBQVCXFV-SNAWJCMRSA-N 1 0 296.414 3.570 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)c1ccns1 ZINC000858576113 1123663968 /nfs/dbraw/zinc/66/39/68/1123663968.db2.gz IIYJXCMNJOWRFU-IUCAKERBSA-N 1 0 282.796 3.914 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]C[C@H]2CCCC23CC3)c1O ZINC000858594004 1123666731 /nfs/dbraw/zinc/66/67/31/1123666731.db2.gz LLPUBERSNWWVCC-CHWSQXEVSA-N 1 0 275.392 3.632 20 10 CHCDRO CN1CCCc2cc(C[NH2+][C@@H]3CCCc4occc43)ccc21 ZINC000195287287 1129143780 /nfs/dbraw/zinc/14/37/80/1129143780.db2.gz MVKHZEJYWLEZRQ-QGZVFWFLSA-N 1 0 296.414 3.829 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)CCCc1cccnc1)c1ccccc1O ZINC000840772483 1123789864 /nfs/dbraw/zinc/78/98/64/1123789864.db2.gz UPZJMJBJUGXCCH-LSDHHAIUSA-N 1 0 284.403 3.849 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)nc1C ZINC000840782338 1123797602 /nfs/dbraw/zinc/79/76/02/1123797602.db2.gz ACMMIHSDBZKHFQ-LBPRGKRZSA-N 1 0 290.794 3.908 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCCC(F)(F)CC2)cc1C ZINC000862467072 1123812918 /nfs/dbraw/zinc/81/29/18/1123812918.db2.gz NZUBKJBOYOZVNP-UHFFFAOYSA-N 1 0 269.335 3.630 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCC[C@@H]2C[C@@H]21)c1ccc(N(C)C)cc1 ZINC000840820209 1123827063 /nfs/dbraw/zinc/82/70/63/1123827063.db2.gz QRQGZMNVSVEDHN-IRWJRLHMSA-N 1 0 258.409 3.592 20 10 CHCDRO CCc1cccc(C[NH2+]CC[C@@H]2CCC3(CCC3)O2)c1O ZINC000897246508 1123857369 /nfs/dbraw/zinc/85/73/69/1123857369.db2.gz VENDZHMOHVKXQA-INIZCTEOSA-N 1 0 289.419 3.536 20 10 CHCDRO CCc1cccc(C[NH2+]CC[C@H]2CCC3(CCC3)O2)c1O ZINC000897246509 1123857713 /nfs/dbraw/zinc/85/77/13/1123857713.db2.gz VENDZHMOHVKXQA-MRXNPFEDSA-N 1 0 289.419 3.536 20 10 CHCDRO CCN(CC)c1ccc(CNc2cc[nH+]cc2C)cc1 ZINC000083515114 1129149843 /nfs/dbraw/zinc/14/98/43/1129149843.db2.gz VSOAGOMPAWMLIQ-UHFFFAOYSA-N 1 0 269.392 3.848 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]CCc1cccc(F)c1 ZINC000083551585 1129151148 /nfs/dbraw/zinc/15/11/48/1129151148.db2.gz FBILAEPIINAIFA-UHFFFAOYSA-N 1 0 279.742 3.517 20 10 CHCDRO CCCC[N@H+](Cc1ccccc1O)[C@@H](C)c1cnc(C)cn1 ZINC000794545975 1123885986 /nfs/dbraw/zinc/88/59/86/1123885986.db2.gz NKHOOELFROSBRU-HNNXBMFYSA-N 1 0 299.418 3.854 20 10 CHCDRO COc1cccc(C[NH2+]C[C@H](C)c2ccc(C)cc2)c1O ZINC000119684619 1123901210 /nfs/dbraw/zinc/90/12/10/1123901210.db2.gz RCCVBPJGRPPBOF-AWEZNQCLSA-N 1 0 285.387 3.603 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccco1)c1cc2c(cc1O)CCCC2 ZINC000119880507 1123918059 /nfs/dbraw/zinc/91/80/59/1123918059.db2.gz HPUAZHBJZPXSJB-CYBMUJFWSA-N 1 0 285.387 3.757 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](C)c1ccncc1)c1ccc(C)cc1O ZINC000794800312 1123950301 /nfs/dbraw/zinc/95/03/01/1123950301.db2.gz CHMGFFZXTFUYEX-RHSMWYFYSA-N 1 0 284.403 3.940 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)CN1CCCCC1)c1ccc(C)cc1O ZINC000794799143 1123950702 /nfs/dbraw/zinc/95/07/02/1123950702.db2.gz ZAWOPKRJJPIWLC-RDJZCZTQSA-N 1 0 290.451 3.616 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@](C)(O)CCC(C)C)c1ccc(C)cc1O ZINC000794799983 1123951017 /nfs/dbraw/zinc/95/10/17/1123951017.db2.gz AYIWFJKMWRQMAH-AEFFLSMTSA-N 1 0 293.451 3.929 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)CC(C)(C)OC)c1ccc(C)cc1O ZINC000794803723 1123953005 /nfs/dbraw/zinc/95/30/05/1123953005.db2.gz SMSKBBGIRINUEA-HIFRSBDPSA-N 1 0 279.424 3.945 20 10 CHCDRO CCc1nc(C[NH2+][C@@H](CC)c2ccc(C)cc2O)cs1 ZINC000794803615 1123953169 /nfs/dbraw/zinc/95/31/69/1123953169.db2.gz BINFMFBRGRGMKS-AWEZNQCLSA-N 1 0 290.432 3.960 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CC)C1CCOCC1)c1ccc(C)cc1O ZINC000794805609 1123955971 /nfs/dbraw/zinc/95/59/71/1123955971.db2.gz XWHSDGDQYFVWKB-DLBZAZTESA-N 1 0 291.435 3.947 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCC(F)(F)C1)c1ccc(C)cc1O ZINC000794815564 1123957366 /nfs/dbraw/zinc/95/73/66/1123957366.db2.gz WJYJNXDGDXEEIL-AAEUAGOBSA-N 1 0 269.335 3.929 20 10 CHCDRO CCC(CC)[C@@H](O)C[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000794809114 1123957472 /nfs/dbraw/zinc/95/74/72/1123957472.db2.gz QJILAAXDZXXUAD-RDJZCZTQSA-N 1 0 279.424 3.538 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCC[C@@H]1OC)c1ccc(C)cc1O ZINC000794815175 1123958096 /nfs/dbraw/zinc/95/80/96/1123958096.db2.gz HYFDIRIPYBHGFN-QRTARXTBSA-N 1 0 277.408 3.556 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cncc(C)c1)c1ccc(C)cc1O ZINC000794815305 1123958223 /nfs/dbraw/zinc/95/82/23/1123958223.db2.gz JUIVHCWKSQSWII-MRXNPFEDSA-N 1 0 270.376 3.645 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CO)C1CCCCC1)c1ccc(C)cc1O ZINC000794818366 1123959562 /nfs/dbraw/zinc/95/95/62/1123959562.db2.gz SFUXXTVCLZSCKF-SJORKVTESA-N 1 0 291.435 3.683 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@@H](C)N(CC)CC)cc1 ZINC000794828568 1123962436 /nfs/dbraw/zinc/96/24/36/1123962436.db2.gz CCHBHNRAXXKJJQ-HZPDHXFCSA-N 1 0 291.483 3.524 20 10 CHCDRO CCc1cccc(C[N@H+](CC)CCC(F)(F)F)c1O ZINC000688518020 1124040037 /nfs/dbraw/zinc/04/00/37/1124040037.db2.gz BPCLZYWBCAHVIZ-UHFFFAOYSA-N 1 0 275.314 3.729 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CCO[C@H]1c1ccccc1)c1ccccc1O ZINC000866404996 1124063745 /nfs/dbraw/zinc/06/37/45/1124063745.db2.gz SJCJUEHJOQADMP-LMMKCTJWSA-N 1 0 297.398 3.963 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2ccnc(F)c2)cc1 ZINC000866472706 1124068818 /nfs/dbraw/zinc/06/88/18/1124068818.db2.gz CXAGTJAYLCGSHL-ZDUSSCGKSA-N 1 0 287.382 3.528 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+][C@@H]2C[C@H]2C(F)(F)F)c(O)c1 ZINC000866500395 1124073758 /nfs/dbraw/zinc/07/37/58/1124073758.db2.gz RRBIKMYTLHWEOR-GMTAPVOTSA-N 1 0 273.298 3.610 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H]2CCC23CCOCC3)c1 ZINC000866528916 1124077965 /nfs/dbraw/zinc/07/79/65/1124077965.db2.gz KEYWWMWURGQINE-HUUCEWRRSA-N 1 0 289.419 3.558 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2c3ccccc3CN2C)c(O)c1 ZINC000866562138 1124081546 /nfs/dbraw/zinc/08/15/46/1124081546.db2.gz CRGMOEDQSCWWTF-KBXCAEBGSA-N 1 0 296.414 3.538 20 10 CHCDRO C[C@H](C[NH2+]Cc1ccccc1O)c1cccc(Cl)c1 ZINC000783611074 1124081681 /nfs/dbraw/zinc/08/16/81/1124081681.db2.gz QIOUYHFROWBODD-GFCCVEGCSA-N 1 0 275.779 3.939 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1c2ccccc2CN1C)c1ccccc1O ZINC000866562724 1124082744 /nfs/dbraw/zinc/08/27/44/1124082744.db2.gz GNWZXAPBGPWMEB-QZTJIDSGSA-N 1 0 296.414 3.620 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@@H]1CC=CC[C@H]1C(F)(F)F)CC2 ZINC000866609309 1124087436 /nfs/dbraw/zinc/08/74/36/1124087436.db2.gz LGIKZEXHRVYMMW-UPJWGTAASA-N 1 0 297.320 3.866 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1cc2cnccc2o1 ZINC000866618870 1124090547 /nfs/dbraw/zinc/09/05/47/1124090547.db2.gz BKFIQPILHONUHI-SMDDNHRTSA-N 1 0 294.354 3.872 20 10 CHCDRO COc1cccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)c1 ZINC000037680553 1129165582 /nfs/dbraw/zinc/16/55/82/1129165582.db2.gz CGIFWIFALYFTLE-AWEZNQCLSA-N 1 0 284.403 3.612 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C2([C@@H]3CCCCO3)CCC2)c(O)c1 ZINC000866622961 1124090955 /nfs/dbraw/zinc/09/09/55/1124090955.db2.gz KTNYAKULLASEAQ-PBHICJAKSA-N 1 0 289.419 3.843 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H]2CCCn3nccc32)cc1 ZINC000866633493 1124091878 /nfs/dbraw/zinc/09/18/78/1124091878.db2.gz WCIBVSLPOCIBLJ-PBHICJAKSA-N 1 0 298.434 3.525 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)c1ccco1 ZINC000122758607 1124529889 /nfs/dbraw/zinc/52/98/89/1124529889.db2.gz CNVNMLJILBYMMV-CYBMUJFWSA-N 1 0 258.365 3.505 20 10 CHCDRO C/C(Cl)=C\C[N@@H+](Cc1ccccc1O)C[C@H]1CCCO1 ZINC000528419753 1124658107 /nfs/dbraw/zinc/65/81/07/1124658107.db2.gz PGNBAEAHRIIZQO-XETPBLJFSA-N 1 0 295.810 3.516 20 10 CHCDRO CN1CCC(C)(C)c2cc(C3=CCC[NH2+]CC3)ccc21 ZINC001238950527 1131275798 /nfs/dbraw/zinc/27/57/98/1131275798.db2.gz OPJGTUPMFRGOSK-UHFFFAOYSA-N 1 0 270.420 3.571 20 10 CHCDRO CCC[N@H+](Cc1ccccc1O)C1CC(OC(C)(C)C)C1 ZINC000783650276 1124671812 /nfs/dbraw/zinc/67/18/12/1124671812.db2.gz MSTIQKMONKJILT-UHFFFAOYSA-N 1 0 291.435 3.950 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1C[C@@H]2CCC[C@H]2O1)c1ccc(C)cc1O ZINC000872105729 1124683737 /nfs/dbraw/zinc/68/37/37/1124683737.db2.gz BDIDVTHRKCDQOE-ILXVDBEPSA-N 1 0 289.419 3.699 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2C[C@@H]3CCC[C@@H]3O2)c(O)c1C ZINC000872109332 1124686597 /nfs/dbraw/zinc/68/65/97/1124686597.db2.gz LMEUYRBBZIUGSL-JKQORVJESA-N 1 0 289.419 3.617 20 10 CHCDRO Cc1nccnc1[C@@H](C)[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000872129718 1124690584 /nfs/dbraw/zinc/69/05/84/1124690584.db2.gz ATZPFKDZPBOQQJ-GXSJLCMTSA-N 1 0 291.782 3.556 20 10 CHCDRO CCCOc1ccc(C[NH2+]Cc2ccc(O)cc2)cc1C ZINC000873036180 1124734245 /nfs/dbraw/zinc/73/42/45/1124734245.db2.gz PCDBSLOAQLXBRC-UHFFFAOYSA-N 1 0 285.387 3.779 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2cc(Cl)c(C)cc2O)nc1 ZINC000825671926 1124760176 /nfs/dbraw/zinc/76/01/76/1124760176.db2.gz UCBHHVBOICEOKE-UHFFFAOYSA-N 1 0 290.794 3.689 20 10 CHCDRO C[C@@H]([NH2+]CCCCC(=O)OC(C)(C)C)c1ccccc1O ZINC000783525657 1131285817 /nfs/dbraw/zinc/28/58/17/1131285817.db2.gz MUADWYQBKPCYJV-CYBMUJFWSA-N 1 0 293.407 3.555 20 10 CHCDRO CC(C)([NH2+]Cc1ccc2c(c1)CCO2)c1cccc(F)c1 ZINC000124660562 1124804069 /nfs/dbraw/zinc/80/40/69/1124804069.db2.gz QBGFVQPRBSWIJB-UHFFFAOYSA-N 1 0 285.362 3.786 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2ccc(F)cc2)c1 ZINC000020095657 1124805008 /nfs/dbraw/zinc/80/50/08/1124805008.db2.gz KNLOQMIBPZDQRL-VXGBXAGGSA-N 1 0 289.350 3.952 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCc2ccccc2)c(O)c1 ZINC000020089850 1124805021 /nfs/dbraw/zinc/80/50/21/1124805021.db2.gz JOPRTGNGIGSEKH-CQSZACIVSA-N 1 0 255.361 3.594 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@@H](C)CCCC(C)C)c1 ZINC000021519782 1124931427 /nfs/dbraw/zinc/93/14/27/1124931427.db2.gz LTDGYHQDGRXQLP-ZDUSSCGKSA-N 1 0 265.397 3.705 20 10 CHCDRO Cc1ccc(C[N@@H+](C)[C@@H](C)c2cccc(O)c2)c(O)c1 ZINC000876721615 1124972547 /nfs/dbraw/zinc/97/25/47/1124972547.db2.gz WFFBULQXLAPAKV-ZDUSSCGKSA-N 1 0 271.360 3.599 20 10 CHCDRO Cc1cccc([C@H]2CCC[N@@H+]2Cc2c(C)cccc2O)n1 ZINC000876741348 1124974232 /nfs/dbraw/zinc/97/42/32/1124974232.db2.gz SXICKBWIVAUTJJ-QGZVFWFLSA-N 1 0 282.387 3.741 20 10 CHCDRO COc1ccc([C@@H](C)[NH2+]Cc2ccc(C)cc2O)cc1F ZINC000876901121 1124988328 /nfs/dbraw/zinc/98/83/28/1124988328.db2.gz ZSMMMYCLARGVAG-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](c2ccccc2)C2CC2)c(O)c1 ZINC000876906846 1124989771 /nfs/dbraw/zinc/98/97/71/1124989771.db2.gz JEPNFWSQCNAEAH-SFHVURJKSA-N 1 0 267.372 3.942 20 10 CHCDRO Cc1ccc(C[NH2+][C@H]2CCc3c2cccc3F)c(O)c1 ZINC000876973882 1124993010 /nfs/dbraw/zinc/99/30/10/1124993010.db2.gz RGQFVYQGVZXVOF-INIZCTEOSA-N 1 0 271.335 3.617 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2CCc3cccc(F)c3C2)cc1 ZINC001170961597 1131323919 /nfs/dbraw/zinc/32/39/19/1131323919.db2.gz QCCSVLJJFSVMFM-MRXNPFEDSA-N 1 0 298.405 3.539 20 10 CHCDRO Cc1ccc(C[NH2+][C@H]2CCOC3(CCCCC3)C2)c(O)c1 ZINC000877087647 1125007804 /nfs/dbraw/zinc/00/78/04/1125007804.db2.gz OIQJQSAEGBHYHD-INIZCTEOSA-N 1 0 289.419 3.672 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](c2ccccc2)[C@H]2CCOC2)c(O)c1 ZINC000877133654 1125014084 /nfs/dbraw/zinc/01/40/84/1125014084.db2.gz FUJLSVVXKLLCPK-PKOBYXMFSA-N 1 0 297.398 3.568 20 10 CHCDRO Cc1nc2c(s1)[C@@H]([NH2+]Cc1c(C)cccc1O)CCC2 ZINC000877185157 1125018287 /nfs/dbraw/zinc/01/82/87/1125018287.db2.gz QCEHKQJATVQTMI-ZDUSSCGKSA-N 1 0 288.416 3.633 20 10 CHCDRO CCOC1(C)CC[NH+](Cc2cc(Cl)c(C)cc2O)CC1 ZINC000825955375 1125022759 /nfs/dbraw/zinc/02/27/59/1125022759.db2.gz LQHXILHNPWYVOD-UHFFFAOYSA-N 1 0 297.826 3.745 20 10 CHCDRO CCCN(Cc1nc(Cl)cs1)c1ccc(C[NH3+])cc1 ZINC000877478221 1125033105 /nfs/dbraw/zinc/03/31/05/1125033105.db2.gz KUPLJIODKCTJAA-UHFFFAOYSA-N 1 0 295.839 3.672 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@H](C)c1cnc(C)nc1C ZINC000877478306 1125033455 /nfs/dbraw/zinc/03/34/55/1125033455.db2.gz NDCSWZHQWMQXML-CQSZACIVSA-N 1 0 298.434 3.530 20 10 CHCDRO CCCC[N@H+](CCC[C@H]1CCO1)Cc1ccccc1O ZINC000877503421 1125036711 /nfs/dbraw/zinc/03/67/11/1125036711.db2.gz LPNYYOLSNGYPQD-INIZCTEOSA-N 1 0 277.408 3.563 20 10 CHCDRO CCC[N@H+](CCc1ccccn1)Cc1c(C)cccc1O ZINC000877523113 1125039286 /nfs/dbraw/zinc/03/92/86/1125039286.db2.gz WPVYNHNLOVSDBG-UHFFFAOYSA-N 1 0 284.403 3.550 20 10 CHCDRO Cc1ccc(C[N@@H+](C)C2CCC(F)(F)CC2)c(O)c1 ZINC000877533993 1125041323 /nfs/dbraw/zinc/04/13/23/1125041323.db2.gz YWHCXTLHWNTMNU-UHFFFAOYSA-N 1 0 269.335 3.710 20 10 CHCDRO Cc1cccc(O)c1C[NH+]1CCC(c2ccco2)CC1 ZINC000877622723 1125055953 /nfs/dbraw/zinc/05/59/53/1125055953.db2.gz SVMPXCJKEGWUCY-UHFFFAOYSA-N 1 0 271.360 3.673 20 10 CHCDRO CCC(F)(F)C(C)(C)C[NH2+]Cc1c(C)cccc1O ZINC000877655688 1125059736 /nfs/dbraw/zinc/05/97/36/1125059736.db2.gz HRNQGJPZYCNLEP-UHFFFAOYSA-N 1 0 271.351 3.862 20 10 CHCDRO Oc1ccccc1C[NH+]1CCC2(CCSCC2)CC1 ZINC000877673671 1125062342 /nfs/dbraw/zinc/06/23/42/1125062342.db2.gz GYLSBZQZVAXUGI-UHFFFAOYSA-N 1 0 277.433 3.501 20 10 CHCDRO Cc1cccc(C[NH2+]CC2([C@@H]3CCCCO3)CCC2)c1O ZINC000877698153 1125064289 /nfs/dbraw/zinc/06/42/89/1125064289.db2.gz RIIPMJZKJWSASI-INIZCTEOSA-N 1 0 289.419 3.530 20 10 CHCDRO C[C@@H](C[N@@H+]1Cc2cccc(O)c2C1)c1ccccc1 ZINC000877702965 1125066476 /nfs/dbraw/zinc/06/64/76/1125066476.db2.gz MLRZJTWCALLCEX-ZDUSSCGKSA-N 1 0 253.345 3.512 20 10 CHCDRO CC(C)c1cnc(C[NH2+][C@H](C)c2ccccc2O)s1 ZINC000877756029 1125071451 /nfs/dbraw/zinc/07/14/51/1125071451.db2.gz ZJTZWIZSOWMHSX-LLVKDONJSA-N 1 0 276.405 3.823 20 10 CHCDRO Cc1ccc(C)c(C[NH2+][C@@H](C)c2ccccc2O)c1 ZINC000877756488 1125073298 /nfs/dbraw/zinc/07/32/98/1125073298.db2.gz MCBIUMXLCLAUMP-AWEZNQCLSA-N 1 0 255.361 3.860 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(C(F)F)nc1)c1ccccc1O ZINC000877758316 1125074831 /nfs/dbraw/zinc/07/48/31/1125074831.db2.gz SLZJKSNACLCVPF-JTQLQIEISA-N 1 0 278.302 3.576 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H](C)c2ccccc2O)cc1Cl ZINC000877758219 1125074967 /nfs/dbraw/zinc/07/49/67/1125074967.db2.gz NPQONMHKHXQIGX-NSHDSACASA-N 1 0 291.778 3.910 20 10 CHCDRO C[C@H]([NH2+][C@H]1Cc2[nH]c3ccccc3c2C1)c1ccccc1O ZINC000877758257 1125075126 /nfs/dbraw/zinc/07/51/26/1125075126.db2.gz PMTJIVYFMIKSRV-QWHCGFSZSA-N 1 0 292.382 3.692 20 10 CHCDRO CCO[P@@](C)(=O)CC[C@@H](C)[NH2+][C@@H](C)c1ccccc1O ZINC000877758322 1125075341 /nfs/dbraw/zinc/07/53/41/1125075341.db2.gz SVSVRXSGVQCLMY-MTJIALIYSA-N 1 0 299.351 3.766 20 10 CHCDRO CC[C@@H](C[NH2+][C@@H](C)c1ccccc1O)CC(F)F ZINC000879650183 1125224224 /nfs/dbraw/zinc/22/42/24/1125224224.db2.gz NJOOWTNSLUIKRK-WDEREUQCSA-N 1 0 257.324 3.724 20 10 CHCDRO CSc1ccccc1C[NH2+][C@@H](C)c1ccccc1O ZINC000879650611 1125224401 /nfs/dbraw/zinc/22/44/01/1125224401.db2.gz JLKKKSQTMCHHOP-LBPRGKRZSA-N 1 0 273.401 3.965 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CCc3ccccc32)cc1C ZINC000035052805 1125234028 /nfs/dbraw/zinc/23/40/28/1125234028.db2.gz AESDLBRHMIYSOA-QGZVFWFLSA-N 1 0 267.372 3.781 20 10 CHCDRO CC[N@H+](Cc1[nH]nc2c1cccc2C)Cc1ccccc1O ZINC001137149002 1125241949 /nfs/dbraw/zinc/24/19/49/1125241949.db2.gz ABJSGBCBRKRYPN-UHFFFAOYSA-N 1 0 295.386 3.599 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]Cc2ccccc2C)c1O ZINC000228668767 1125250497 /nfs/dbraw/zinc/25/04/97/1125250497.db2.gz XBUQZIDDVBUXLH-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CC[C@@]3(CC3(F)F)C2)cc1Cl ZINC000826143187 1125252062 /nfs/dbraw/zinc/25/20/62/1125252062.db2.gz UGVYHGQRJZILSK-CYBMUJFWSA-N 1 0 287.737 3.585 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCCCC[C@H]2C)c1O ZINC000211390537 1125304301 /nfs/dbraw/zinc/30/43/01/1125304301.db2.gz PMNXCMBEDMHUSO-CYBMUJFWSA-N 1 0 263.381 3.555 20 10 CHCDRO COc1ccc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCO3)cc1C ZINC000897417375 1125321078 /nfs/dbraw/zinc/32/10/78/1125321078.db2.gz MLZVARDWQOMYQM-CQSZACIVSA-N 1 0 297.398 3.789 20 10 CHCDRO C[C@H](c1ccco1)[N@H+](C)Cc1cc(Cl)ccc1O ZINC000131076726 1125373886 /nfs/dbraw/zinc/37/38/86/1125373886.db2.gz ZHHZAJXVWFXJKM-SNVBAGLBSA-N 1 0 265.740 3.832 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccns1)c1cc(Cl)ccc1O ZINC000883247159 1125384266 /nfs/dbraw/zinc/38/42/66/1125384266.db2.gz BBWILZXOTIWHOX-CYBMUJFWSA-N 1 0 296.823 3.786 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CC[C@H]2CCCC2(F)F)c1O ZINC000883274540 1125390458 /nfs/dbraw/zinc/39/04/58/1125390458.db2.gz NTJGONBEOLYEPG-NWDGAFQWSA-N 1 0 299.361 3.877 20 10 CHCDRO Oc1ccc(Cl)c(C[NH2+][C@H]2CCc3cccc(O)c32)c1 ZINC000883327389 1125396851 /nfs/dbraw/zinc/39/68/51/1125396851.db2.gz XRXZWPUSIQDJEZ-AWEZNQCLSA-N 1 0 289.762 3.528 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C2CCC3(COC3)CC2)c(O)c1C ZINC000883381112 1125406174 /nfs/dbraw/zinc/40/61/74/1125406174.db2.gz GUWJECXUSARODM-AWEZNQCLSA-N 1 0 289.419 3.619 20 10 CHCDRO CC[C@@H]([NH2+]C1CCC2(COC2)CC1)c1ccc(C)cc1O ZINC000883381119 1125406184 /nfs/dbraw/zinc/40/61/84/1125406184.db2.gz GWYRFCRPWVJANF-MRXNPFEDSA-N 1 0 289.419 3.701 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C2CCC3(COC3)CC2)c(O)c1 ZINC000883382016 1125407002 /nfs/dbraw/zinc/40/70/02/1125407002.db2.gz YEWHKDJBEOCZSO-CQSZACIVSA-N 1 0 289.419 3.619 20 10 CHCDRO CC[C@@H](C)[C@H](C)[NH2+]CCCSc1nccs1 ZINC000132160633 1125415145 /nfs/dbraw/zinc/41/51/45/1125415145.db2.gz CUVNTRXMBRZUNJ-MNOVXSKESA-N 1 0 258.456 3.650 20 10 CHCDRO CCSCC[C@@H](C)[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000132241890 1125416185 /nfs/dbraw/zinc/41/61/85/1125416185.db2.gz SPYVYFGMLXAJML-ZIAGYGMSSA-N 1 0 280.481 3.935 20 10 CHCDRO COc1ccc(O)c(C[NH+](CC(C)C)CC(C)C)c1 ZINC000132491931 1125419271 /nfs/dbraw/zinc/41/92/71/1125419271.db2.gz DSVULYRLSNYGSD-UHFFFAOYSA-N 1 0 265.397 3.515 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C2C[C@@H](C)O[C@H](C)C2)cc1 ZINC000245617726 1129214344 /nfs/dbraw/zinc/21/43/44/1129214344.db2.gz VVKPXSJVEABDOY-KFWWJZLASA-N 1 0 290.451 3.749 20 10 CHCDRO Cc1ccccc1C[C@H](C)[NH2+][C@H](C)c1ccccc1O ZINC000037776900 1129268983 /nfs/dbraw/zinc/26/89/83/1129268983.db2.gz SOQUKHBTNJJRKI-LSDHHAIUSA-N 1 0 269.388 3.982 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CCCC12CCOCC2)c1ccccc1O ZINC000282683807 1129276845 /nfs/dbraw/zinc/27/68/45/1129276845.db2.gz JVGGAMMVGBTEAE-NVXWUHKLSA-N 1 0 289.419 3.782 20 10 CHCDRO Cc1ncc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)s1 ZINC000090417266 1129289205 /nfs/dbraw/zinc/28/92/05/1129289205.db2.gz UHZUWFMAPIIURQ-LBPRGKRZSA-N 1 0 289.448 3.677 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H](C)SC)cc1 ZINC000090726489 1129325781 /nfs/dbraw/zinc/32/57/81/1129325781.db2.gz ABNJQFDMLGNFRG-OLZOCXBDSA-N 1 0 266.454 3.545 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H]2CSc3ccccc32)c1 ZINC000735508547 1129348754 /nfs/dbraw/zinc/34/87/54/1129348754.db2.gz DMQPZSCVQBHWGF-AWEZNQCLSA-N 1 0 271.385 3.637 20 10 CHCDRO C[C@@H]1SCC[N@H+](Cc2c(O)ccc3ccccc32)[C@H]1C ZINC000735668131 1129356462 /nfs/dbraw/zinc/35/64/62/1129356462.db2.gz POLZXCWPNSQWGK-STQMWFEESA-N 1 0 287.428 3.871 20 10 CHCDRO CCc1ccc(CC[NH2+]Cc2c(O)cccc2Cl)cc1 ZINC000736358038 1129373150 /nfs/dbraw/zinc/37/31/50/1129373150.db2.gz PMSHMTWQVPPLCD-UHFFFAOYSA-N 1 0 289.806 3.940 20 10 CHCDRO C[N@H+](Cc1ccccc1O)Cc1cccc(Cl)c1F ZINC000091974640 1129376522 /nfs/dbraw/zinc/37/65/22/1129376522.db2.gz XEBYCRZMUHBYFT-UHFFFAOYSA-N 1 0 279.742 3.817 20 10 CHCDRO CCC[N@H+](Cc1ccc(C)o1)Cc1ccccc1O ZINC000092704973 1129404597 /nfs/dbraw/zinc/40/45/97/1129404597.db2.gz NWTNJBDUAGBBDY-UHFFFAOYSA-N 1 0 259.349 3.706 20 10 CHCDRO Oc1cc2c(cc1C[N@@H+]1CCC=C(c3ccco3)C1)CCC2 ZINC000795651221 1129406967 /nfs/dbraw/zinc/40/69/67/1129406967.db2.gz QQNNUAHOCGLYKW-UHFFFAOYSA-N 1 0 295.382 3.763 20 10 CHCDRO Cc1ccc2oc(C[NH2+]Cc3ccc4c(c3)CCO4)cc2c1 ZINC000740004795 1129408882 /nfs/dbraw/zinc/40/88/82/1129408882.db2.gz WLRKOZFDXXFDGC-UHFFFAOYSA-N 1 0 293.366 3.966 20 10 CHCDRO CCC[C@H](C)[NH2+]Cc1ccc(N(CC)CC)c(F)c1 ZINC000740002501 1129409085 /nfs/dbraw/zinc/40/90/85/1129409085.db2.gz PAFASURUMUJCMA-ZDUSSCGKSA-N 1 0 266.404 3.950 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2C[C@H]2c2ccccc2)c1 ZINC000248525348 1129420273 /nfs/dbraw/zinc/42/02/73/1129420273.db2.gz ULOXNRDAIYBAJR-YEWWUXTCSA-N 1 0 297.398 3.855 20 10 CHCDRO CCCO[C@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)CC1 ZINC000093317126 1129421195 /nfs/dbraw/zinc/42/11/95/1129421195.db2.gz ZCNMYJDDLKDVRX-HNNXBMFYSA-N 1 0 297.826 3.827 20 10 CHCDRO CC(C)C[C@@H]1OCCC[C@@H]1[NH2+][C@H](C)c1cc(F)ccc1O ZINC000248555389 1129422054 /nfs/dbraw/zinc/42/20/54/1129422054.db2.gz KKMPOWITWFIEHI-PVUWLOKVSA-N 1 0 295.398 3.776 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCCO[C@H]2CC(C)C)c(O)c1 ZINC000248589884 1129423537 /nfs/dbraw/zinc/42/35/37/1129423537.db2.gz YZMQTROSMSTNHR-LESCRADOSA-N 1 0 291.435 3.945 20 10 CHCDRO CCO[C@@H]1C[C@@H]([NH2+][C@H](CC)c2ccccc2O)C12CCC2 ZINC000248894977 1129430936 /nfs/dbraw/zinc/43/09/36/1129430936.db2.gz UPNGIJQUSVSVEX-DJIMGWMZSA-N 1 0 289.419 3.781 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@@H+]2CCC=C(c3ccncc3)C2)c1 ZINC000795737436 1129446910 /nfs/dbraw/zinc/44/69/10/1129446910.db2.gz KNKRQDCYXJILED-UHFFFAOYSA-N 1 0 294.398 3.693 20 10 CHCDRO Cc1cccc(OCC[NH2+][C@@H](C)c2cc(F)ccc2O)c1 ZINC000094617941 1129448286 /nfs/dbraw/zinc/44/82/86/1129448286.db2.gz OZUCFAGGXAWLJI-ZDUSSCGKSA-N 1 0 289.350 3.569 20 10 CHCDRO Cc1noc(C)c1[C@@H](C)[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000094618496 1129448312 /nfs/dbraw/zinc/44/83/12/1129448312.db2.gz MXLRLZDTOUCPPL-DTWKUNHWSA-N 1 0 278.327 3.548 20 10 CHCDRO Cc1cc(C)cc(C[C@@H](C)[NH2+]Cc2ccc3c(c2)CCO3)c1 ZINC000742380917 1129473161 /nfs/dbraw/zinc/47/31/61/1129473161.db2.gz SECUGMPFCZAXPN-MRXNPFEDSA-N 1 0 295.426 3.959 20 10 CHCDRO Cc1cc(C)cc(C[C@H](C)[NH2+]Cc2ccc3c(c2)CCO3)c1 ZINC000742380916 1129473215 /nfs/dbraw/zinc/47/32/15/1129473215.db2.gz SECUGMPFCZAXPN-INIZCTEOSA-N 1 0 295.426 3.959 20 10 CHCDRO CCC(C)(C)C[NH2+]C1CCN(c2ccc(OC)cc2)CC1 ZINC000742369590 1129474572 /nfs/dbraw/zinc/47/45/72/1129474572.db2.gz NCKRERBLCFRMEF-UHFFFAOYSA-N 1 0 290.451 3.690 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H]2CCC[C@@H](C3CC3)C2)c1 ZINC000742377080 1129475553 /nfs/dbraw/zinc/47/55/53/1129475553.db2.gz LVJOPXUXRAFKGX-ZBFHGGJFSA-N 1 0 259.393 3.759 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H]2CC[C@H]3CCC[C@@H]3C2)c1O ZINC000742378687 1129476008 /nfs/dbraw/zinc/47/60/08/1129476008.db2.gz JQTRQKDNIMSYPK-IIAWOOMASA-N 1 0 289.419 3.849 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2CC[C@@H]3CCC[C@H]3C2)cc1F ZINC000742378736 1129476116 /nfs/dbraw/zinc/47/61/16/1129476116.db2.gz LNZLVEWAPZEFNL-HRCADAONSA-N 1 0 290.426 3.950 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+][C@@H]2CC[C@H]3CCC[C@@H]3C2)c1 ZINC000742378954 1129476126 /nfs/dbraw/zinc/47/61/26/1129476126.db2.gz PFOZZWDNKLKVOR-IIAWOOMASA-N 1 0 289.419 3.849 20 10 CHCDRO Cc1ccc(CC[C@H](C)[NH2+]Cc2ccc3c(c2)CCO3)o1 ZINC000742380325 1129476331 /nfs/dbraw/zinc/47/63/31/1129476331.db2.gz OHRLZNBKCFFAPK-ZDUSSCGKSA-N 1 0 285.387 3.634 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H]2CC[C@H](C)C[C@H]2C)c1O ZINC000250520098 1129483283 /nfs/dbraw/zinc/48/32/83/1129483283.db2.gz RTBMEUHKRNULLY-GZBFAFLISA-N 1 0 277.408 3.705 20 10 CHCDRO CN(C)c1ccc(C[NH2+]Cc2ccc3occc3c2)cc1F ZINC000796282243 1129513435 /nfs/dbraw/zinc/51/34/35/1129513435.db2.gz KKGHLJGJBJTVEU-UHFFFAOYSA-N 1 0 298.361 3.928 20 10 CHCDRO Oc1ccc2ccncc2c1C[N@@H+]1CCC2(CCCC2)C1 ZINC000743390856 1129521599 /nfs/dbraw/zinc/52/15/99/1129521599.db2.gz KQMRNMWZSPVKDM-UHFFFAOYSA-N 1 0 282.387 3.707 20 10 CHCDRO CC(C)[N@H+](CCC1CC1)Cc1ccc(N(C)C)cc1 ZINC000743841790 1129537393 /nfs/dbraw/zinc/53/73/93/1129537393.db2.gz XEDUFOZOFDGJEO-UHFFFAOYSA-N 1 0 260.425 3.763 20 10 CHCDRO CO[C@]1(C)C[C@@H]([NH2+][C@H](C)c2ccc(N(C)C)cc2)C1(C)C ZINC000766382688 1129660846 /nfs/dbraw/zinc/66/08/46/1129660846.db2.gz XYVAYVDTDVEOAX-MZMPZRCHSA-N 1 0 290.451 3.607 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H]2C[C@@H](OC)C2(C)C)cc1 ZINC000766531199 1129683891 /nfs/dbraw/zinc/68/38/91/1129683891.db2.gz ZQNWCPHIJDKYFY-RRQGHBQHSA-N 1 0 290.451 3.607 20 10 CHCDRO CC(C)C[C@H](Cc1ccccc1)[NH2+]Cc1cccc(O)c1O ZINC001169062021 1129694269 /nfs/dbraw/zinc/69/42/69/1129694269.db2.gz PSKSPDSXPQZTGB-QGZVFWFLSA-N 1 0 299.414 3.845 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC2(C)CC(F)(F)C2)c(O)c1 ZINC000720901833 1129718754 /nfs/dbraw/zinc/71/87/54/1129718754.db2.gz USUYKYFSFCEELI-LLVKDONJSA-N 1 0 269.335 3.787 20 10 CHCDRO CSc1cccc(F)c1C[NH2+]Cc1ccccc1O ZINC000796450597 1129727695 /nfs/dbraw/zinc/72/76/95/1129727695.db2.gz PJHBCDKTOQVAMI-UHFFFAOYSA-N 1 0 277.364 3.543 20 10 CHCDRO CC/C=C\CC[N@@H+]1CCCN(c2ccc(OC)cc2)CC1 ZINC000767307144 1129784976 /nfs/dbraw/zinc/78/49/76/1129784976.db2.gz VYBJULBJPGIGJS-PLNGDYQASA-N 1 0 288.435 3.564 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CC3CCC2CC3)c1 ZINC000380548646 1129831392 /nfs/dbraw/zinc/83/13/92/1129831392.db2.gz XFWYCTMLDOARAU-NEQJSVFRSA-N 1 0 275.392 3.630 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](CC)Cc2ccccc2)c1 ZINC000768141335 1129833426 /nfs/dbraw/zinc/83/34/26/1129833426.db2.gz XDSWLMHDODOUSF-UHFFFAOYSA-N 1 0 285.387 3.813 20 10 CHCDRO CC(C)(C)C(C)(C)C[NH2+]Cc1cccc(F)c1[O-] ZINC000380928866 1129833641 /nfs/dbraw/zinc/83/36/41/1129833641.db2.gz GVDSLLLSSMCECK-UHFFFAOYSA-N 1 0 253.361 3.693 20 10 CHCDRO CC[C@H](C)[C@H](C[NH2+]Cc1ccc(N(CC)CC)cc1)OC ZINC000381128641 1129834639 /nfs/dbraw/zinc/83/46/39/1129834639.db2.gz GQUIOSMAFKVZGE-YJBOKZPZSA-N 1 0 292.467 3.684 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+](Cc2ccco2)C(C)C)c1 ZINC000768250431 1129846948 /nfs/dbraw/zinc/84/69/48/1129846948.db2.gz QOMDPKXXWNBMTA-UHFFFAOYSA-N 1 0 259.349 3.704 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCSC[C@@H]2c2ccccc2)c1 ZINC000768247542 1129847303 /nfs/dbraw/zinc/84/73/03/1129847303.db2.gz BMDKWBCIJKERLH-QGZVFWFLSA-N 1 0 299.439 3.991 20 10 CHCDRO CC[C@@H]1C[N@H+](Cc2cc(-c3ccccc3)ccc2O)CCO1 ZINC000768237972 1129847793 /nfs/dbraw/zinc/84/77/93/1129847793.db2.gz OISLHZZYVJQGPL-GOSISDBHSA-N 1 0 297.398 3.670 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CC[C@@H](c3ccccc3)C2)c(O)c1 ZINC000768359291 1129853567 /nfs/dbraw/zinc/85/35/67/1129853567.db2.gz CCLYRLWIGDLLNG-MRXNPFEDSA-N 1 0 297.398 3.780 20 10 CHCDRO C[N@H+](Cc1cc2c(cc1O)CCCC2)C1CCCC1 ZINC000768442475 1129857671 /nfs/dbraw/zinc/85/76/71/1129857671.db2.gz QBRQAZZPLQRIMN-UHFFFAOYSA-N 1 0 259.393 3.645 20 10 CHCDRO CCC1(CC)C[N@H+](Cc2cc(F)ccc2O)CCS1 ZINC000768528936 1129860015 /nfs/dbraw/zinc/86/00/15/1129860015.db2.gz MPSJBSBPERPXGH-UHFFFAOYSA-N 1 0 283.412 3.639 20 10 CHCDRO C[C@@]1(Cc2ccccc2)CCC[N@@H+]1Cc1ccccc1O ZINC000768534614 1129861689 /nfs/dbraw/zinc/86/16/89/1129861689.db2.gz GWVMHQPBYSMHBU-IBGZPJMESA-N 1 0 281.399 3.989 20 10 CHCDRO CCOc1ccc(C[N@H+](C)[C@@H](C)C(C)(C)C)c(O)c1 ZINC000768545329 1129864010 /nfs/dbraw/zinc/86/40/10/1129864010.db2.gz XVNZPCRKCCSISN-LBPRGKRZSA-N 1 0 265.397 3.657 20 10 CHCDRO CCSCCC[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000800492123 1129879508 /nfs/dbraw/zinc/87/95/08/1129879508.db2.gz CAQIFDVUIVGYMQ-JTQLQIEISA-N 1 0 273.829 3.839 20 10 CHCDRO CC[C@H]([NH2+]CC1(COC)CCC1)c1ccc(N(C)C)cc1 ZINC000800492588 1129880513 /nfs/dbraw/zinc/88/05/13/1129880513.db2.gz MOJKFPSUHFSTKR-KRWDZBQOSA-N 1 0 290.451 3.610 20 10 CHCDRO CC(C)[N@H+](Cc1ccccn1)Cc1cc(Cl)ccc1O ZINC000768925363 1129881395 /nfs/dbraw/zinc/88/13/95/1129881395.db2.gz GTJZCIIPFKTIJF-UHFFFAOYSA-N 1 0 290.794 3.851 20 10 CHCDRO COc1cccc(C[N@H+](CC2CCCCC2)C2CC2)c1O ZINC000768920329 1129881522 /nfs/dbraw/zinc/88/15/22/1129881522.db2.gz KUMXMFRSGAJIDX-UHFFFAOYSA-N 1 0 289.419 3.946 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCc3cc(F)cc(C)c3C2)c1 ZINC000800535757 1129882037 /nfs/dbraw/zinc/88/20/37/1129882037.db2.gz HDZJOAAXACOXMP-UHFFFAOYSA-N 1 0 285.362 3.706 20 10 CHCDRO COc1cccc(C[N@H+](C)C2CCCCCCC2)c1O ZINC000769222631 1129896129 /nfs/dbraw/zinc/89/61/29/1129896129.db2.gz LBTZNZGYDRIXKA-UHFFFAOYSA-N 1 0 277.408 3.946 20 10 CHCDRO FCCC[C@@H]1CCC[C@H]1[NH2+]Cc1ccc2c(c1)CCO2 ZINC000800969097 1129900640 /nfs/dbraw/zinc/90/06/40/1129900640.db2.gz HACXFFULLMNLIN-GOEBONIOSA-N 1 0 277.383 3.630 20 10 CHCDRO c1csc(SCCC[NH2+][C@@H]2CC[C@H]2C2CCC2)n1 ZINC000800971999 1129900840 /nfs/dbraw/zinc/90/08/40/1129900840.db2.gz ZRNWYBRKRNZQIA-QWHCGFSZSA-N 1 0 282.478 3.794 20 10 CHCDRO C[C@H]1C[N@H+](Cc2cc(-c3ccccc3)ccc2O)CCCO1 ZINC000769319136 1129902414 /nfs/dbraw/zinc/90/24/14/1129902414.db2.gz RIVGGOCCWABTDF-HNNXBMFYSA-N 1 0 297.398 3.670 20 10 CHCDRO CC[C@H]([NH2+]CCCOC(F)F)c1cc(Cl)ccc1O ZINC000800989731 1129902768 /nfs/dbraw/zinc/90/27/68/1129902768.db2.gz ITZSNFUXBAHZLM-NSHDSACASA-N 1 0 293.741 3.716 20 10 CHCDRO CCCN(CCC)c1ccc(C[N@H+](C)[C@H]2CCOC2)cc1 ZINC000769331644 1129903203 /nfs/dbraw/zinc/90/32/03/1129903203.db2.gz VFVRVJARGSTKFG-SFHVURJKSA-N 1 0 290.451 3.534 20 10 CHCDRO COc1cccc(O)c1C[N@@H+]1CCc2ccccc2[C@@H]1C ZINC000769354022 1129904321 /nfs/dbraw/zinc/90/43/21/1129904321.db2.gz ZCVGPVKLNJTDGO-ZDUSSCGKSA-N 1 0 283.371 3.520 20 10 CHCDRO CC[C@@H]1[C@@H](C)CC[N@@H+]1Cc1cc(Cl)cc(OC)c1O ZINC000384283160 1129905799 /nfs/dbraw/zinc/90/57/99/1129905799.db2.gz OTRASADWMMJYME-GXFFZTMASA-N 1 0 283.799 3.675 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC[C@@H](c3ccc(F)cc3)C2)c1 ZINC000769399099 1129906167 /nfs/dbraw/zinc/90/61/67/1129906167.db2.gz VSRDCUVQPDRLSR-OAHLLOKOSA-N 1 0 285.362 3.829 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CCC3(CCCC3)C2)c(O)c1 ZINC000769402130 1129906333 /nfs/dbraw/zinc/90/63/33/1129906333.db2.gz BHRSSOIYAUJRCZ-UHFFFAOYSA-N 1 0 275.392 3.557 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CCCCC[C@@H]2C)c(O)c1 ZINC000769405952 1129907156 /nfs/dbraw/zinc/90/71/56/1129907156.db2.gz ZFMZSAGPCBCSPU-ZDUSSCGKSA-N 1 0 263.381 3.555 20 10 CHCDRO COc1cccc(C[N@@H+]2Cc3ccccc3C(C)(C)C2)c1O ZINC000769427158 1129907687 /nfs/dbraw/zinc/90/76/87/1129907687.db2.gz DNQYRNSHGAGBKX-UHFFFAOYSA-N 1 0 297.398 3.694 20 10 CHCDRO CCOc1cccc(C[N@@H+]2Cc3ccccc3C[C@@H]2C)c1O ZINC000769483368 1129909543 /nfs/dbraw/zinc/90/95/43/1129909543.db2.gz PIGCHVSEFJJWSK-AWEZNQCLSA-N 1 0 297.398 3.738 20 10 CHCDRO CCOc1cccc(C[N@@H+]2C[C@H](C)CCC[C@@H]2C)c1O ZINC000769452315 1129911228 /nfs/dbraw/zinc/91/12/28/1129911228.db2.gz WFTWRKAGZIDEEO-KGLIPLIRSA-N 1 0 277.408 3.801 20 10 CHCDRO CC(C)[N@H+](Cc1cc(Cl)ccc1O)C1CCC1 ZINC000769471027 1129912538 /nfs/dbraw/zinc/91/25/38/1129912538.db2.gz QBIZMDWLHZAVKS-UHFFFAOYSA-N 1 0 253.773 3.809 20 10 CHCDRO COc1cccc(C[N@@H+]2CCC[C@@H](CC(C)C)C2)c1O ZINC000769506610 1129914820 /nfs/dbraw/zinc/91/48/20/1129914820.db2.gz ZNAWRKBQXFNMII-AWEZNQCLSA-N 1 0 277.408 3.659 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CC[C@@H]1Cc1ccccc1 ZINC000769506891 1129915119 /nfs/dbraw/zinc/91/51/19/1129915119.db2.gz XZASGVIFVQRJOO-CQSZACIVSA-N 1 0 287.790 3.863 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2C[C@H](C)[C@@H]2c2ccccc2)c1 ZINC000769541281 1129916340 /nfs/dbraw/zinc/91/63/40/1129916340.db2.gz TXCZYWOCSHVHOP-IFXJQAMLSA-N 1 0 297.398 3.984 20 10 CHCDRO CCCC[N@H+](Cc1ncc(CC)o1)Cc1ccccc1O ZINC000801595660 1129930876 /nfs/dbraw/zinc/93/08/76/1129930876.db2.gz HXPDMYHSCPONQC-UHFFFAOYSA-N 1 0 288.391 3.745 20 10 CHCDRO CCCC[N@@H+](Cc1ccccc1O)C[C@H]1CC[C@H](C)O1 ZINC000801594584 1129930913 /nfs/dbraw/zinc/93/09/13/1129930913.db2.gz GUKJFJLTGAGNIT-GOEBONIOSA-N 1 0 277.408 3.562 20 10 CHCDRO CCCC[N@@H+](Cc1ccccc1O)C[C@@H]1CCCCO1 ZINC000801596013 1129931649 /nfs/dbraw/zinc/93/16/49/1129931649.db2.gz ZBGKZNVZIHMPDF-INIZCTEOSA-N 1 0 277.408 3.563 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]CC2CC(c3ccccc3)C2)c1 ZINC000801730132 1129940695 /nfs/dbraw/zinc/94/06/95/1129940695.db2.gz GCQUEEIZJQGNAJ-UHFFFAOYSA-N 1 0 281.399 3.984 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+](C)[C@@H](C)[C@@H]2Cc3ccccc3O2)c1 ZINC000770349845 1129945733 /nfs/dbraw/zinc/94/57/33/1129945733.db2.gz NLCKDUGRVIICAC-LIRRHRJNSA-N 1 0 297.398 3.525 20 10 CHCDRO CCCOc1ccc2c(c1)CC[N@@H+](Cc1ccccc1O)C2 ZINC000770505270 1129947795 /nfs/dbraw/zinc/94/77/95/1129947795.db2.gz MODFZCCNBRBWSX-UHFFFAOYSA-N 1 0 297.398 3.739 20 10 CHCDRO CC(C)[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccccc1O ZINC000770509105 1129948357 /nfs/dbraw/zinc/94/83/57/1129948357.db2.gz IENDUOAUELPSNS-UHFFFAOYSA-N 1 0 298.430 3.869 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CC[C@H](c2ccc(F)cc2)C1 ZINC000770510625 1129949035 /nfs/dbraw/zinc/94/90/35/1129949035.db2.gz OQGUVCSIGIRNOI-AWEZNQCLSA-N 1 0 271.335 3.521 20 10 CHCDRO CC[C@@H]1c2ccsc2CC[N@H+]1Cc1ccccc1O ZINC000770509833 1129949358 /nfs/dbraw/zinc/94/93/58/1129949358.db2.gz UNJCLUYGYFCXMP-CQSZACIVSA-N 1 0 273.401 3.963 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCO[C@H](C)C1)c1ccc(N(C)C)cc1 ZINC000771388839 1129979261 /nfs/dbraw/zinc/97/92/61/1129979261.db2.gz PPNQZJDQLHAEAK-RKVPGOIHSA-N 1 0 290.451 3.608 20 10 CHCDRO CC(C)[N@H+](CCc1cccnc1)Cc1ccc(N(C)C)cc1 ZINC000771790873 1129989860 /nfs/dbraw/zinc/98/98/60/1129989860.db2.gz IJYRDPMIEXSWID-UHFFFAOYSA-N 1 0 297.446 3.601 20 10 CHCDRO CCc1cccc(C[NH2+][C@H](C)CCc2ccco2)c1O ZINC000691507868 1130021043 /nfs/dbraw/zinc/02/10/43/1130021043.db2.gz TVYNGENXNUESFK-CYBMUJFWSA-N 1 0 273.376 3.659 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC[C@](F)(c3ccccc3)C2)c1 ZINC000802656923 1130027963 /nfs/dbraw/zinc/02/79/63/1130027963.db2.gz SCHOGRRXRALMTE-GOSISDBHSA-N 1 0 285.362 3.771 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)CC[C@H]2CCCO2)cc1 ZINC000786577870 1130106341 /nfs/dbraw/zinc/10/63/41/1130106341.db2.gz RHJMBKCROBUCGN-GOSISDBHSA-N 1 0 290.451 3.534 20 10 CHCDRO C[C@@H]([NH2+]Cc1nccc2c1CCCC2)c1ccccc1O ZINC000903185514 1130126082 /nfs/dbraw/zinc/12/60/82/1130126082.db2.gz UOGMVEVRDBPJSK-CYBMUJFWSA-N 1 0 282.387 3.517 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2nccc3c2CCCC3)c(O)c1 ZINC000903182602 1130126186 /nfs/dbraw/zinc/12/61/86/1130126186.db2.gz SLBHYKJDNSWGBU-CQSZACIVSA-N 1 0 296.414 3.825 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)C[C@H]2CCSC2)cc1 ZINC000787063219 1130130539 /nfs/dbraw/zinc/13/05/39/1130130539.db2.gz AJCGNJKFCJKSPC-MRXNPFEDSA-N 1 0 292.492 3.718 20 10 CHCDRO CN(C)c1ccc(C[N@H+](CCOC(C)(C)C)C2CC2)cc1 ZINC000746651246 1130137044 /nfs/dbraw/zinc/13/70/44/1130137044.db2.gz QMBSUBHHORXZPI-UHFFFAOYSA-N 1 0 290.451 3.532 20 10 CHCDRO CCc1cccc(C[NH2+][C@H](C)c2ccccc2O)c1 ZINC000787280273 1130142511 /nfs/dbraw/zinc/14/25/11/1130142511.db2.gz VTQAQTKUEIIZQB-CYBMUJFWSA-N 1 0 255.361 3.805 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F)c1cncs1 ZINC000903310522 1130151093 /nfs/dbraw/zinc/15/10/93/1130151093.db2.gz KKQCHXIUBLRRBS-FXPVBKGRSA-N 1 0 292.379 3.887 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H](c2ncccn2)C2CC2)c(O)c1C ZINC000903327365 1130156047 /nfs/dbraw/zinc/15/60/47/1130156047.db2.gz SDNMTWQPWPRFOV-CZUORRHYSA-N 1 0 297.402 3.601 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H](c2ccccn2)C2CC2)c(O)c1 ZINC000903335659 1130160925 /nfs/dbraw/zinc/16/09/25/1130160925.db2.gz RLCUJRDYZSFQNQ-ACJLOTCBSA-N 1 0 282.387 3.898 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCOC12CCCC2)c1ccc(Cl)cc1O ZINC000903388973 1130169624 /nfs/dbraw/zinc/16/96/24/1130169624.db2.gz NMQWBIRRIRANPE-XHDPSFHLSA-N 1 0 295.810 3.798 20 10 CHCDRO Cc1cccc(C[NH2+][C@H]2c3ccccc3NC2(C)C)c1O ZINC000903948628 1130211484 /nfs/dbraw/zinc/21/14/84/1130211484.db2.gz SNLKCINCQNXFKG-KRWDZBQOSA-N 1 0 282.387 3.736 20 10 CHCDRO CCOC[C@H]([NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F)C(C)C ZINC000788985785 1130221993 /nfs/dbraw/zinc/22/19/93/1130221993.db2.gz RXMTXMLFOVTWCR-YUTCNCBUSA-N 1 0 295.398 3.730 20 10 CHCDRO CCC[N@@H+](Cc1ccccc1O)C[C@@H](O)C1CCCCC1 ZINC000789325601 1130244043 /nfs/dbraw/zinc/24/40/43/1130244043.db2.gz BOYFCKKBIPDCCB-GOSISDBHSA-N 1 0 291.435 3.545 20 10 CHCDRO CCc1ccc([C@H](O)C[NH2+][C@H](CC)c2ccccc2O)cc1 ZINC000789363044 1130247514 /nfs/dbraw/zinc/24/75/14/1130247514.db2.gz RJXLQQOVVBVARS-IEBWSBKVSA-N 1 0 299.414 3.729 20 10 CHCDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]C[C@H]1CCSC1 ZINC000790484562 1130315731 /nfs/dbraw/zinc/31/57/31/1130315731.db2.gz FONLXTUDXMOHPH-CQSZACIVSA-N 1 0 299.439 3.902 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1N(C)CCCC1(C)C)c1ccccc1O ZINC000790499430 1130315844 /nfs/dbraw/zinc/31/58/44/1130315844.db2.gz WVOWPGKHRUNDJJ-WBVHZDCISA-N 1 0 290.451 3.553 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCSC1)c1cc(Cl)ccc1O ZINC000790498850 1130316280 /nfs/dbraw/zinc/31/62/80/1130316280.db2.gz UQJJINVQUVYUMT-MFKMUULPSA-N 1 0 285.840 3.839 20 10 CHCDRO Oc1cc(OCc2ccccc2)ccc1C[NH2+][C@@H]1C=CCC1 ZINC000826941143 1130316893 /nfs/dbraw/zinc/31/68/93/1130316893.db2.gz HDFZITRSGIJNFW-QGZVFWFLSA-N 1 0 295.382 3.779 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+]2CCSCC[C@@H]2C)c1O ZINC000792197253 1130437506 /nfs/dbraw/zinc/43/75/06/1130437506.db2.gz SETXAOIORXIOSA-NSHDSACASA-N 1 0 285.840 3.681 20 10 CHCDRO CC(C)(C)C[C@@H]1CCC[N@@H+]1Cc1cc2c(cc1O)OCO2 ZINC000747076620 1130449637 /nfs/dbraw/zinc/44/96/37/1130449637.db2.gz MPLWJWYVWBFQSV-ZDUSSCGKSA-N 1 0 291.391 3.522 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC2(C)C)c(C(F)(F)F)c1 ZINC000792826285 1130500561 /nfs/dbraw/zinc/50/05/61/1130500561.db2.gz GIFVWTUSNGVAGK-UHFFFAOYSA-N 1 0 286.341 3.756 20 10 CHCDRO C[C@@H]1C[C@@H]1C[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000792917866 1130506334 /nfs/dbraw/zinc/50/63/34/1130506334.db2.gz LNYSNFDRCFFLKZ-ZYHUDNBSSA-N 1 0 286.341 3.517 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H]2CC=CCC2)c(C(F)(F)F)c1 ZINC000792993194 1130510896 /nfs/dbraw/zinc/51/08/96/1130510896.db2.gz WNGCLLDFSQBPCE-ZDUSSCGKSA-N 1 0 298.352 3.970 20 10 CHCDRO Cc1cc(Br)cc(C[NH2+]CCC2(C)CC2)c1O ZINC000793199078 1130526407 /nfs/dbraw/zinc/52/64/07/1130526407.db2.gz PCKVOJUZJUEFHT-UHFFFAOYSA-N 1 0 298.224 3.743 20 10 CHCDRO C[C@H]1CCC[C@@H](C[NH2+]Cc2ccc3ccccc3c2O)O1 ZINC000827251701 1130529839 /nfs/dbraw/zinc/52/98/39/1130529839.db2.gz LGFNZJHJDUMGJS-BBRMVZONSA-N 1 0 285.387 3.593 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+][C@H]1CCCc2ccc(F)cc21 ZINC000793309175 1130539645 /nfs/dbraw/zinc/53/96/45/1130539645.db2.gz LUIRFOJBFVJROD-INIZCTEOSA-N 1 0 289.325 3.838 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](CC2CC2)C2CCC2)c1 ZINC000793393108 1130551242 /nfs/dbraw/zinc/55/12/42/1130551242.db2.gz CHJCKSOTDBNHMM-UHFFFAOYSA-N 1 0 275.392 3.555 20 10 CHCDRO COc1ccc(C[NH2+]C2CC(c3ccc(C)cc3)C2)c(O)c1 ZINC000793387259 1130551581 /nfs/dbraw/zinc/55/15/81/1130551581.db2.gz BKBPSMALCZVFHY-UHFFFAOYSA-N 1 0 297.398 3.745 20 10 CHCDRO [O-]c1ccc(Cl)c(F)c1C[N@H+](CC1CC1)C1CCC1 ZINC000793396697 1130553439 /nfs/dbraw/zinc/55/34/39/1130553439.db2.gz YBUGIVMLQGKGSL-UHFFFAOYSA-N 1 0 283.774 3.949 20 10 CHCDRO CC[C@@]1(C)CC[N@H+](Cc2cc3c(cc2O)CCC3)C1 ZINC000758394912 1130609931 /nfs/dbraw/zinc/60/99/31/1130609931.db2.gz GVNBDGHOXMJQNY-KRWDZBQOSA-N 1 0 259.393 3.503 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2CCC(F)(F)[C@@H](C)C2)c1O ZINC000811512030 1130618308 /nfs/dbraw/zinc/61/83/08/1130618308.db2.gz BVWYPCSBCUMTGP-JTQLQIEISA-N 1 0 289.753 3.831 20 10 CHCDRO COc1ccc(C[NH2+][C@H](c2cccnc2)C2CC2)cc1C ZINC000758624098 1130619421 /nfs/dbraw/zinc/61/94/21/1130619421.db2.gz NEYKGBWRLFKUGL-SFHVURJKSA-N 1 0 282.387 3.640 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CC(C)(C)[C@@H]2C2CC2)cc1F ZINC000811513749 1130619572 /nfs/dbraw/zinc/61/95/72/1130619572.db2.gz OMEVMJCDGDRZBF-INIZCTEOSA-N 1 0 276.399 3.512 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CC3(CCC3)[C@@H]2C2CC2)cc1 ZINC000811513745 1130619643 /nfs/dbraw/zinc/61/96/43/1130619643.db2.gz OGQZJNJMFGVINQ-KRWDZBQOSA-N 1 0 270.420 3.517 20 10 CHCDRO CCOc1ccc(O)c(C[NH+]2CCC(C)(C3CC3)CC2)c1 ZINC000811514322 1130620669 /nfs/dbraw/zinc/62/06/69/1130620669.db2.gz HSYAUKQWSQCBJR-UHFFFAOYSA-N 1 0 289.419 3.803 20 10 CHCDRO Oc1ccccc1C[NH2+][C@H]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000780520415 1130682830 /nfs/dbraw/zinc/68/28/30/1130682830.db2.gz PEPGULUMPWCKII-PBHICJAKSA-N 1 0 285.362 3.957 20 10 CHCDRO CCOCc1cc(C[NH2+][C@@H]2CC[C@@H](C)C2)ccc1OC ZINC000780579168 1130684484 /nfs/dbraw/zinc/68/44/84/1130684484.db2.gz ZSHCLCZDYOEUCR-CZUORRHYSA-N 1 0 277.408 3.510 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2cccc(-c3ccccc3)c2O)[C@@H](C)CO1 ZINC001234999509 1130700561 /nfs/dbraw/zinc/70/05/61/1130700561.db2.gz WEMQCZQAVLEXNS-LSDHHAIUSA-N 1 0 297.398 3.668 20 10 CHCDRO Oc1c(C[N@@H+]2C[C@@H]3C[C@H]2C[C@H]3F)cccc1-c1ccccc1 ZINC001234995880 1130700616 /nfs/dbraw/zinc/70/06/16/1130700616.db2.gz QHIRNIACFODUBL-XYJFISCASA-N 1 0 297.373 3.992 20 10 CHCDRO CCC[N@H+](C)Cc1cccc(-c2ccccc2)c1O ZINC001234990683 1130701274 /nfs/dbraw/zinc/70/12/74/1130701274.db2.gz JPHCPUPQHIBTAL-UHFFFAOYSA-N 1 0 255.361 3.901 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@@](C)(OC)C2CC2)cc1 ZINC000812734655 1130709463 /nfs/dbraw/zinc/70/94/63/1130709463.db2.gz PPNPZFDGLPOCTF-RDTXWAMCSA-N 1 0 290.451 3.608 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@@](C)(OC)C2CC2)cc1 ZINC000812734652 1130709575 /nfs/dbraw/zinc/70/95/75/1130709575.db2.gz PPNPZFDGLPOCTF-KBXCAEBGSA-N 1 0 290.451 3.608 20 10 CHCDRO CC[C@@H]1CCC[N@H+](Cc2ccc(N(C)C)c(C)c2)C1 ZINC001139672672 1130744329 /nfs/dbraw/zinc/74/43/29/1130744329.db2.gz AOBBOKDEIPCYPX-OAHLLOKOSA-N 1 0 260.425 3.683 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CC[C@@]3(CC[C@@H](C)C3)C2)c1 ZINC000781927825 1130749471 /nfs/dbraw/zinc/74/94/71/1130749471.db2.gz HRQOYVDMGBWTBH-RDTXWAMCSA-N 1 0 289.419 3.803 20 10 CHCDRO Cc1ccc(O)c(C[N@H+]2CC[C@@]3(CC[C@@H](C)C3)C2)c1 ZINC000781928117 1130750221 /nfs/dbraw/zinc/75/02/21/1130750221.db2.gz JRNICHIFXNTOSV-RHSMWYFYSA-N 1 0 259.393 3.713 20 10 CHCDRO Oc1ccccc1C[NH+]1CC(Cc2ccccc2Cl)C1 ZINC000813332235 1130761208 /nfs/dbraw/zinc/76/12/08/1130761208.db2.gz RQBHHFZVCDMPQF-UHFFFAOYSA-N 1 0 287.790 3.720 20 10 CHCDRO C[C@@H]1CCC[N@H+](Cc2ccc(C(C)(C)C)cc2O)C1 ZINC001235676810 1130765265 /nfs/dbraw/zinc/76/52/65/1130765265.db2.gz VQXSIKOMANUQTM-CYBMUJFWSA-N 1 0 261.409 3.922 20 10 CHCDRO CC(C)(C)c1ccc(C[N@@H+]2CCC[C@H](CF)C2)c(O)c1 ZINC001235684734 1130768357 /nfs/dbraw/zinc/76/83/57/1130768357.db2.gz IYQNOCCZFUYFRQ-CYBMUJFWSA-N 1 0 279.399 3.871 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@H+]2Cc3ccccc3OC[C@@H]2C)c1 ZINC000782290882 1130769650 /nfs/dbraw/zinc/76/96/50/1130769650.db2.gz UEFXYLJQAOZSJE-HNNXBMFYSA-N 1 0 297.398 3.792 20 10 CHCDRO COc1ccc(C[NH2+]Cc2ccccc2C(C)C)c(O)c1 ZINC000782539242 1130782665 /nfs/dbraw/zinc/78/26/65/1130782665.db2.gz ISOWNAKWGSJWOS-UHFFFAOYSA-N 1 0 285.387 3.814 20 10 CHCDRO CC(C)[C@H](CC(F)(F)F)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000782543215 1130783000 /nfs/dbraw/zinc/78/30/00/1130783000.db2.gz FUARLJKWADMWLD-AWEZNQCLSA-N 1 0 288.357 3.819 20 10 CHCDRO FC1(F)CCCC[C@@H](C[NH2+]Cc2ccc3c(c2)CCO3)C1 ZINC000813782804 1130783402 /nfs/dbraw/zinc/78/34/02/1130783402.db2.gz UHLJKNMHKLLNLC-CQSZACIVSA-N 1 0 295.373 3.927 20 10 CHCDRO Oc1ccccc1C[NH2+]Cc1ccc2c(c1)CCCC2 ZINC000813771977 1130783969 /nfs/dbraw/zinc/78/39/69/1130783969.db2.gz ODINIORCMSRBBY-UHFFFAOYSA-N 1 0 267.372 3.561 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]CCCc2ccsc2)c1 ZINC000782985327 1130792969 /nfs/dbraw/zinc/79/29/69/1130792969.db2.gz NXLQXINBIFKFHX-LBPRGKRZSA-N 1 0 291.416 3.746 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1CCC=CO1)c1cc(Cl)ccc1O ZINC000783310560 1130814802 /nfs/dbraw/zinc/81/48/02/1130814802.db2.gz PMQSEDCLCCQKIA-GXTWGEPZSA-N 1 0 281.783 3.779 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CC[C@@H](C)C1)c1ccc(Br)cc1O ZINC000783311585 1130814853 /nfs/dbraw/zinc/81/48/53/1130814853.db2.gz XQPVLJZEMSYELR-FOGDFJRCSA-N 1 0 298.224 3.994 20 10 CHCDRO C[C@@H]1CC[C@H]([NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)C1 ZINC000783311310 1130815300 /nfs/dbraw/zinc/81/53/00/1130815300.db2.gz VHSHPJXETVHWJH-BLFANLJRSA-N 1 0 263.356 3.858 20 10 CHCDRO CCN(CC[NH2+][C@@H](C)c1ccccc1O)c1cccc(C)c1 ZINC000783491227 1130829429 /nfs/dbraw/zinc/82/94/29/1130829429.db2.gz RBZQNMBFJVLRGN-INIZCTEOSA-N 1 0 298.430 3.878 20 10 CHCDRO C[C@@H]([NH2+]Cc1coc2ccccc12)c1ccccc1O ZINC000783524184 1130834478 /nfs/dbraw/zinc/83/44/78/1130834478.db2.gz YEFQBHGKMNKXBI-GFCCVEGCSA-N 1 0 267.328 3.989 20 10 CHCDRO C[C@@H]([NH2+][C@@H](c1cccnc1)C1CC1)c1ccccc1O ZINC000783526056 1130835434 /nfs/dbraw/zinc/83/54/34/1130835434.db2.gz RGAXDWVQTXPHPC-SJKOYZFVSA-N 1 0 268.360 3.589 20 10 CHCDRO C[C@@H]([NH2+]CCCc1cccs1)c1ccccc1O ZINC000783526647 1130835557 /nfs/dbraw/zinc/83/55/57/1130835557.db2.gz XRUMWNVNDHPKDL-GFCCVEGCSA-N 1 0 261.390 3.737 20 10 CHCDRO COc1cccc(C[N@H+](C)Cc2cccc(C)c2C)c1O ZINC000814169845 1130837507 /nfs/dbraw/zinc/83/75/07/1130837507.db2.gz NHOJYAHXJCOXCT-UHFFFAOYSA-N 1 0 285.387 3.650 20 10 CHCDRO C[C@@H]1COc2ccccc2C[N@@H+]1Cc1ccc(N(C)C)cc1 ZINC000783598518 1130841418 /nfs/dbraw/zinc/84/14/18/1130841418.db2.gz VJFDPIINCGYLKE-OAHLLOKOSA-N 1 0 296.414 3.536 20 10 CHCDRO CCOc1cccc(C[NH2+][C@H]2CC[C@H](CC)CC2)c1O ZINC000814300057 1130862229 /nfs/dbraw/zinc/86/22/29/1130862229.db2.gz GJRDYNOWDICVBH-CTYIDZIISA-N 1 0 277.408 3.849 20 10 CHCDRO CCCC[C@@H]1CN(Cc2c(O)ccc3ccccc32)CC[NH2+]1 ZINC001236135772 1130874165 /nfs/dbraw/zinc/87/41/65/1130874165.db2.gz BVNZGLGMIMJLFN-MRXNPFEDSA-N 1 0 298.430 3.509 20 10 CHCDRO CC(C)c1ccc(C[N@@H+]2CCc3ccc(N)cc3C2)c(O)c1 ZINC001236234321 1130900570 /nfs/dbraw/zinc/90/05/70/1130900570.db2.gz OAPORWGVHRLTJN-UHFFFAOYSA-N 1 0 296.414 3.656 20 10 CHCDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]CC[C@@H]1CCOC1 ZINC000784662309 1130915668 /nfs/dbraw/zinc/91/56/68/1130915668.db2.gz JBVARIKDYOYDBG-OAHLLOKOSA-N 1 0 297.398 3.575 20 10 CHCDRO CC(C)[C@H]1CC[C@@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000796697098 1130923797 /nfs/dbraw/zinc/92/37/97/1130923797.db2.gz WKYNIRNZAYNADT-MSOLQXFVSA-N 1 0 272.436 3.811 20 10 CHCDRO C[C@@H](CCc1ccc(F)cc1F)[NH2+]Cc1ccccc1O ZINC000796745662 1130927873 /nfs/dbraw/zinc/92/78/73/1130927873.db2.gz RNJBWINFEHTANE-LBPRGKRZSA-N 1 0 291.341 3.781 20 10 CHCDRO Cc1cc(C[N@@H+]2CC[C@H](c3ccco3)C2)ccc1N(C)C ZINC000815045996 1130950788 /nfs/dbraw/zinc/95/07/88/1130950788.db2.gz FFJNWATXHJZPEW-INIZCTEOSA-N 1 0 284.403 3.644 20 10 CHCDRO CCc1ccc([C@@H](O)C[NH2+][C@H](C)c2ccc(C)cc2O)cc1 ZINC000797027765 1130954200 /nfs/dbraw/zinc/95/42/00/1130954200.db2.gz VHCLCYLZTCMZDE-KUHUBIRLSA-N 1 0 299.414 3.647 20 10 CHCDRO CCc1cnccc1[C@H](C)[NH2+]Cc1ccc(N(C)C)c(C)c1 ZINC000815091207 1130954620 /nfs/dbraw/zinc/95/46/20/1130954620.db2.gz OBJKDSJDDCDNRS-HNNXBMFYSA-N 1 0 297.446 3.869 20 10 CHCDRO Cc1cc(C[N@@H+]2CCCc3occc3C2)ccc1N(C)C ZINC000815120818 1130958258 /nfs/dbraw/zinc/95/82/58/1130958258.db2.gz VOPLOWWNPJVSIG-UHFFFAOYSA-N 1 0 284.403 3.602 20 10 CHCDRO C[C@H]([NH2+]CC1(C(F)(F)F)CC1)c1cc(F)ccc1O ZINC000797071506 1130958814 /nfs/dbraw/zinc/95/88/14/1130958814.db2.gz RZUKUASOGRGGHP-QMMMGPOBSA-N 1 0 277.261 3.524 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CCN2CCCCCC2)c(O)c1 ZINC000815556320 1130999821 /nfs/dbraw/zinc/99/98/21/1130999821.db2.gz SNQMJNKUUUCBCG-INIZCTEOSA-N 1 0 290.451 3.536 20 10 CHCDRO C[N@H+](Cc1cccc2ccoc21)Cc1ccccc1O ZINC001236734348 1131001852 /nfs/dbraw/zinc/00/18/52/1131001852.db2.gz CGDCUBNTSXSFBS-UHFFFAOYSA-N 1 0 267.328 3.770 20 10 CHCDRO CCc1nc(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)cs1 ZINC000815578816 1131002787 /nfs/dbraw/zinc/00/27/87/1131002787.db2.gz XUGNKPGGVBQZQK-LBPRGKRZSA-N 1 0 290.432 3.879 20 10 CHCDRO CCc1ccc(C[N@@H+]2CCCC(F)(F)[C@@H](F)C2)c(O)c1 ZINC001236783351 1131006407 /nfs/dbraw/zinc/00/64/07/1131006407.db2.gz KKYFTCXUPNCCLC-AWEZNQCLSA-N 1 0 287.325 3.524 20 10 CHCDRO CCc1ccc(C[N@@H+]2CCC[C@H]3CCC[C@@H]32)c(O)c1 ZINC001236787252 1131007536 /nfs/dbraw/zinc/00/75/36/1131007536.db2.gz APSULZJHMJSYTI-ZBFHGGJFSA-N 1 0 259.393 3.719 20 10 CHCDRO C[C@H]1CCC[N@@H+]1Cc1cc(OCc2ccccc2)ccc1O ZINC001236793125 1131008140 /nfs/dbraw/zinc/00/81/40/1131008140.db2.gz RAQYUQRCMARMLF-HNNXBMFYSA-N 1 0 297.398 3.956 20 10 CHCDRO CC(C)[N@H+](C)Cc1cc(OCc2ccccc2)ccc1O ZINC001236792509 1131008499 /nfs/dbraw/zinc/00/84/99/1131008499.db2.gz NJDGPCHQLVHODQ-UHFFFAOYSA-N 1 0 285.387 3.811 20 10 CHCDRO CCc1ccc(C[N@@H+]2CCO[C@H](c3ccccc3)C2)c(O)c1 ZINC001236795483 1131008574 /nfs/dbraw/zinc/00/85/74/1131008574.db2.gz VMDCBAAYEJHRAT-IBGZPJMESA-N 1 0 297.398 3.528 20 10 CHCDRO CC1(C)C[NH+](Cc2cc(OCc3ccccc3)ccc2O)C1 ZINC001236791612 1131009375 /nfs/dbraw/zinc/00/93/75/1131009375.db2.gz HVXWXZOGYXVWMP-UHFFFAOYSA-N 1 0 297.398 3.813 20 10 CHCDRO CCc1ccc(C[N@@H+]2CCC[C@@H]2c2nccs2)c(O)c1 ZINC001236795737 1131009475 /nfs/dbraw/zinc/00/94/75/1131009475.db2.gz ZNNZGQMGYGVNQC-CQSZACIVSA-N 1 0 288.416 3.748 20 10 CHCDRO CCCC[N@H+](CC)Cc1c(O)cc(OC)cc1Cl ZINC001236801591 1131012197 /nfs/dbraw/zinc/01/21/97/1131012197.db2.gz DCFNNBBTLARVDM-UHFFFAOYSA-N 1 0 271.788 3.676 20 10 CHCDRO COc1cc(O)c(C[N@H+]2[C@H](C)CCC[C@@H]2C)c(Cl)c1 ZINC001236801205 1131012454 /nfs/dbraw/zinc/01/24/54/1131012454.db2.gz BQEXIUUCZYJYHL-PHIMTYICSA-N 1 0 283.799 3.817 20 10 CHCDRO CCCC1CC[NH+](Cc2c(C)cc(OC)cc2O)CC1 ZINC001236813707 1131012659 /nfs/dbraw/zinc/01/26/59/1131012659.db2.gz MMCGEQPXVDELRP-UHFFFAOYSA-N 1 0 277.408 3.721 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+][C@H]2CCC(F)(F)C2)c(O)c1 ZINC000815607511 1131013052 /nfs/dbraw/zinc/01/30/52/1131013052.db2.gz AGSNJYBONMLDEQ-NEPJUHHUSA-N 1 0 269.335 3.847 20 10 CHCDRO COC1(CC[NH2+][C@H]2C[C@@H](C)c3c2c(O)ccc3F)CCC1 ZINC000815642156 1131015304 /nfs/dbraw/zinc/01/53/04/1131015304.db2.gz UBIDJBWPIZTOGE-YPMHNXCESA-N 1 0 293.382 3.628 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]C2CC(C(C)(C)C)C2)c1 ZINC000815642918 1131015569 /nfs/dbraw/zinc/01/55/69/1131015569.db2.gz OYBCSNKVWXBKAG-PNESKVBLSA-N 1 0 277.408 3.876 20 10 CHCDRO CC[C@@H]([NH2+]CC(C)(F)F)c1cccc(Cl)c1[O-] ZINC000815645085 1131015733 /nfs/dbraw/zinc/01/57/33/1131015733.db2.gz UVYUFTAQUIHYOZ-SNVBAGLBSA-N 1 0 263.715 3.742 20 10 CHCDRO C[C@H]1C[C@H]2C[N@H+](Cc3cc4ccccc4cc3O)CC[C@H]2O1 ZINC001236830195 1131015902 /nfs/dbraw/zinc/01/59/02/1131015902.db2.gz NBTONNMEEQKRQT-SOVGHPHASA-N 1 0 297.398 3.545 20 10 CHCDRO Oc1cc2ccccc2cc1C[NH+]1CCCCCC1 ZINC001236826670 1131016756 /nfs/dbraw/zinc/01/67/56/1131016756.db2.gz LMFUZXDCJVUPMB-UHFFFAOYSA-N 1 0 255.361 3.921 20 10 CHCDRO Oc1cc2ccccc2cc1C[NH+]1CC2(C1)CC(F)(F)C2 ZINC001236826491 1131017538 /nfs/dbraw/zinc/01/75/38/1131017538.db2.gz LGWMCSWKWOBZQF-UHFFFAOYSA-N 1 0 289.325 3.777 20 10 CHCDRO Oc1cc2ccccc2cc1C[NH+]1C2CCC1CC2 ZINC001236834675 1131019268 /nfs/dbraw/zinc/01/92/68/1131019268.db2.gz DQJFZNGCUNOUNK-UHFFFAOYSA-N 1 0 253.345 3.672 20 10 CHCDRO CO[C@@H]1CC[N@H+](Cc2cc3ccccc3cc2O)[C@@H](C)C1 ZINC001236834597 1131019602 /nfs/dbraw/zinc/01/96/02/1131019602.db2.gz BWPNZEOVYJUOCV-SUMWQHHRSA-N 1 0 285.387 3.545 20 10 CHCDRO COC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1cc2ccccc2cc1O ZINC001236837114 1131019844 /nfs/dbraw/zinc/01/98/44/1131019844.db2.gz OEZCGBJWBVCLDD-JWTNVVGKSA-N 1 0 297.398 3.687 20 10 CHCDRO CCCOC1CC[NH+](Cc2cc3ccccc3cc2O)CC1 ZINC001236840121 1131022190 /nfs/dbraw/zinc/02/21/90/1131022190.db2.gz HRSUGLPPFGPMJO-UHFFFAOYSA-N 1 0 299.414 3.936 20 10 CHCDRO CCOc1ccc(C[N@H+](C)CCc2cccc(C)c2)c(O)c1 ZINC001237045194 1131039761 /nfs/dbraw/zinc/03/97/61/1131039761.db2.gz XXAPYOKPOHQGJD-UHFFFAOYSA-N 1 0 299.414 3.774 20 10 CHCDRO CCOc1ccc(C[N@@H+]2CCC[C@@](C)(F)CC2)c(O)c1 ZINC001237049432 1131040871 /nfs/dbraw/zinc/04/08/71/1131040871.db2.gz FIWIDYSRDAICPE-MRXNPFEDSA-N 1 0 281.371 3.505 20 10 CHCDRO CC(C)c1ccc(C[N@@H+]2CC[C@@H]3CCCO[C@@H]3C2)c(O)c1 ZINC001237051948 1131043913 /nfs/dbraw/zinc/04/39/13/1131043913.db2.gz PNSBNGDZCXIBFF-KBXCAEBGSA-N 1 0 289.419 3.517 20 10 CHCDRO CC1CC[NH+](Cc2c(O)cccc2OC(F)(F)F)CC1 ZINC001237119531 1131053796 /nfs/dbraw/zinc/05/37/96/1131053796.db2.gz IRTDPFCYNUJCPY-UHFFFAOYSA-N 1 0 289.297 3.523 20 10 CHCDRO C[N@H+](CCc1ccccc1)Cc1c(O)ccc(F)c1Cl ZINC001237121514 1131055443 /nfs/dbraw/zinc/05/54/43/1131055443.db2.gz OZZLLWQFGSMBBT-UHFFFAOYSA-N 1 0 293.769 3.859 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H](CO)CC2CCCC2)c1 ZINC000798936803 1131062772 /nfs/dbraw/zinc/06/27/72/1131062772.db2.gz GTAIEDFXGOSPTG-GDBMZVCRSA-N 1 0 291.435 3.540 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H](CO)CC2CCCC2)c(O)c1 ZINC000798938539 1131063030 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Oc1c(C[NH2+]C[C@H]2Cc3ccccc32)ccc2ccccc21 ZINC000816548779 1131106347 /nfs/dbraw/zinc/10/63/47/1131106347.db2.gz SBFLMLAYWLIHJQ-QGZVFWFLSA-N 1 0 289.378 3.975 20 10 CHCDRO Oc1c(C[NH2+]CC2(O)CCCCCC2)ccc2ccccc21 ZINC000816552855 1131109329 /nfs/dbraw/zinc/10/93/29/1131109329.db2.gz ZHWSQYGYYXZTPH-UHFFFAOYSA-N 1 0 299.414 3.720 20 10 CHCDRO CCC1(C[NH2+]Cc2ccc3ccccc3c2O)CC1 ZINC000816555426 1131109369 /nfs/dbraw/zinc/10/93/69/1131109369.db2.gz DFKMUZVKDAAAFH-UHFFFAOYSA-N 1 0 255.361 3.825 20 10 CHCDRO CCOCCC1(C[NH2+]Cc2ccc3ccccc3c2O)CC1 ZINC000816557974 1131110727 /nfs/dbraw/zinc/11/07/27/1131110727.db2.gz IOYPXSFZWUKDIJ-UHFFFAOYSA-N 1 0 299.414 3.842 20 10 CHCDRO C[C@@H](C[NH2+]Cc1ccc2ccccc2c1O)c1nccs1 ZINC000816569470 1131112816 /nfs/dbraw/zinc/11/28/16/1131112816.db2.gz MYFPQDYLKXKHBB-LBPRGKRZSA-N 1 0 298.411 3.895 20 10 CHCDRO Oc1c(C[N@@H+]2CCOCC3(CCC3)C2)ccc2ccccc21 ZINC000816569745 1131113316 /nfs/dbraw/zinc/11/33/16/1131113316.db2.gz VKYYDSQRXOOGMA-UHFFFAOYSA-N 1 0 297.398 3.548 20 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ZINC001238061877 1131166098 /nfs/dbraw/zinc/16/60/98/1131166098.db2.gz KSDAKFHEIALTAQ-INIZCTEOSA-N 1 0 299.389 3.904 20 10 CHCDRO Cc1cc(F)cc(C[N@H+](C)Cc2ccccc2F)c1O ZINC001238060640 1131166649 /nfs/dbraw/zinc/16/66/49/1131166649.db2.gz CZLGKXGMVJCJQL-UHFFFAOYSA-N 1 0 277.314 3.611 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCO[C@H](CC)C1)c1ccc(F)cc1[O-] ZINC000817587430 1131173913 /nfs/dbraw/zinc/17/39/13/1131173913.db2.gz WYIRKVURXMFWSX-NFAWXSAZSA-N 1 0 281.371 3.530 20 10 CHCDRO Cc1cc(C[NH2+][C@H](C)c2cc(F)cc(F)c2[O-])cc(C)n1 ZINC000817588992 1131174473 /nfs/dbraw/zinc/17/44/73/1131174473.db2.gz KPNRLTVNIUDGPS-LLVKDONJSA-N 1 0 292.329 3.533 20 10 CHCDRO Cc1ccc(C)c([C@@H](C)[NH2+]CCc2ccc(N)cc2)c1 ZINC000817955775 1131190274 /nfs/dbraw/zinc/19/02/74/1131190274.db2.gz HLKBLNBZWCJKGV-OAHLLOKOSA-N 1 0 268.404 3.779 20 10 CHCDRO C[C@H]([NH2+]CCc1ccc(N)cc1)c1ccc(F)c(Cl)c1 ZINC000817955894 1131190344 /nfs/dbraw/zinc/19/03/44/1131190344.db2.gz KIHIUDDIEPUVSU-NSHDSACASA-N 1 0 292.785 3.955 20 10 CHCDRO CC1(C)C[C@@H]([NH2+]CCc2ccc(N)cc2)c2ccccc21 ZINC000817955754 1131190722 /nfs/dbraw/zinc/19/07/22/1131190722.db2.gz HAPMFWOHSMMZKQ-GOSISDBHSA-N 1 0 280.415 3.824 20 10 CHCDRO Cc1cc([C@@H]([NH2+]CCc2ccc(N)cc2)C2CC2)ccc1F ZINC000817956394 1131191272 /nfs/dbraw/zinc/19/12/72/1131191272.db2.gz YEMSCMOUEXIVNE-IBGZPJMESA-N 1 0 298.405 4.000 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCCC[C@H]1C[NH3+])c1cccc(Cl)c1[O-] ZINC000817960642 1131192414 /nfs/dbraw/zinc/19/24/14/1131192414.db2.gz ONGWKWJENMMPBO-TUKIKUTGSA-N 1 0 296.842 3.604 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCCc2cc(N)ccc21)c1ccccc1O ZINC000817967012 1131193922 /nfs/dbraw/zinc/19/39/22/1131193922.db2.gz CGMFKKMTGLBWLD-SJCJKPOMSA-N 1 0 282.387 3.703 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]C[C@@H]1C[C@@H](C)O[C@H]1C ZINC001118005818 1131208201 /nfs/dbraw/zinc/20/82/01/1131208201.db2.gz CRVDQFJJBISXOI-MRLBHPIUSA-N 1 0 289.419 3.652 20 10 CHCDRO CCC[C@H](CC)[NH2+]C[C@H]1CCN(c2ccc(OC)cc2)C1 ZINC000818341564 1131209444 /nfs/dbraw/zinc/20/94/44/1131209444.db2.gz ARWDCADKUCOIML-CVEARBPZSA-N 1 0 290.451 3.690 20 10 CHCDRO CC[C@H](C)[C@H](C)[NH2+]C[C@@H]1CCN(c2ccc(OC)cc2)C1 ZINC000818344617 1131209689 /nfs/dbraw/zinc/20/96/89/1131209689.db2.gz OYNAXAZSLUXKRO-JYJNAYRXSA-N 1 0 290.451 3.546 20 10 CHCDRO C[C@H]([NH2+][C@@H]1C[C@]1(F)c1ccccc1)c1ccccc1O ZINC000818357242 1131211127 /nfs/dbraw/zinc/21/11/27/1131211127.db2.gz XEBLUOHDLWSGJN-VUCTXSBTSA-N 1 0 271.335 3.680 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@@H]1C[C@]1(F)c1ccccc1)CC2 ZINC000818356845 1131211590 /nfs/dbraw/zinc/21/15/90/1131211590.db2.gz RMNOQENYWYGTRX-KYJSFNMBSA-N 1 0 283.346 3.606 20 10 CHCDRO Oc1cccc2c1C[N@H+](Cc1ccc(F)c(C3CC3)c1)CC2 ZINC001238517262 1131212737 /nfs/dbraw/zinc/21/27/37/1131212737.db2.gz SDTMXQABEUGIQF-UHFFFAOYSA-N 1 0 297.373 3.967 20 10 CHCDRO Oc1ccccc1C[NH2+][C@H]1CCc2c(Cl)cccc2C1 ZINC001171012192 1131419454 /nfs/dbraw/zinc/41/94/54/1131419454.db2.gz GSTHNDDZCTZGJW-AWEZNQCLSA-N 1 0 287.790 3.693 20 10 CHCDRO COCC1CCC([NH2+][C@@H](C)c2ccc(N(C)C)cc2)CC1 ZINC000824196495 1131458938 /nfs/dbraw/zinc/45/89/38/1131458938.db2.gz SGTXRUSBCQHPEC-UQPPLGOBSA-N 1 0 290.451 3.608 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)Cc2cccc(O)c2)cc1Cl ZINC000824474389 1131470405 /nfs/dbraw/zinc/47/04/05/1131470405.db2.gz NZJLVCXPRBCHCR-UHFFFAOYSA-N 1 0 291.778 3.692 20 10 CHCDRO C[C@@]1(F)CCC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC000824472882 1131470736 /nfs/dbraw/zinc/47/07/36/1131470736.db2.gz ZYKHXDCEUSWZEA-QGZVFWFLSA-N 1 0 273.351 3.869 20 10 CHCDRO Cc1ncc(C[N@@H+](C)Cc2cc(Cl)c(C)cc2O)s1 ZINC000824598018 1131476044 /nfs/dbraw/zinc/47/60/44/1131476044.db2.gz ZZGOTAWLWHZDMJ-UHFFFAOYSA-N 1 0 296.823 3.751 20 10 CHCDRO Oc1c(C[N@@H+]2CC[C@H]2C2CC2)ccc2ccccc21 ZINC000824653357 1131478421 /nfs/dbraw/zinc/47/84/21/1131478421.db2.gz AHWRRGKAXICGBP-INIZCTEOSA-N 1 0 253.345 3.530 20 10 CHCDRO COCC[N@H+](Cc1ccc(N2CCCCC2)cc1)C(C)C ZINC001138219829 1131479044 /nfs/dbraw/zinc/47/90/44/1131479044.db2.gz PPDWBPWXDBVHDL-UHFFFAOYSA-N 1 0 290.451 3.534 20 10 CHCDRO CCC[C@H]([NH2+]Cc1cccc(OC)c1O)C(C)(C)C ZINC000824722952 1131480577 /nfs/dbraw/zinc/48/05/77/1131480577.db2.gz ZGWUTCTUCIWIIV-AWEZNQCLSA-N 1 0 265.397 3.705 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCO[C@H](C(C)C)C1)c1ccccc1O ZINC000824798828 1131484965 /nfs/dbraw/zinc/48/49/65/1131484965.db2.gz GRYVLRAUADSDTG-ZVZYQTTQSA-N 1 0 291.435 3.884 20 10 CHCDRO CCOC[C@@H]1CCC[N@H+](Cc2cc(Cl)c(C)cc2O)C1 ZINC000824814967 1131486165 /nfs/dbraw/zinc/48/61/65/1131486165.db2.gz XFAYPEFOLJIEQC-CYBMUJFWSA-N 1 0 297.826 3.603 20 10 CHCDRO Cc1cccc(C[N@@H+](C)Cc2cc(Cl)c(C)cc2O)n1 ZINC000824855500 1131486468 /nfs/dbraw/zinc/48/64/68/1131486468.db2.gz LZWIBDINCNODQY-UHFFFAOYSA-N 1 0 290.794 3.689 20 10 CHCDRO CN1CCCc2cc(C[N@@H+]3CCC[C@H]4CCC[C@@H]43)ccc21 ZINC001138355734 1131493602 /nfs/dbraw/zinc/49/36/02/1131493602.db2.gz BDCPTXRWNAKFBF-APWZRJJASA-N 1 0 284.447 3.834 20 10 CHCDRO CN1CCCc2cc(C[N@@H+]3CCCC(F)(F)CC3)ccc21 ZINC001138354594 1131494207 /nfs/dbraw/zinc/49/42/07/1131494207.db2.gz ONILOTOORUDEJA-UHFFFAOYSA-N 1 0 294.389 3.690 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CC2(CCC2)[C@H]1c1ccco1 ZINC000825104292 1131496160 /nfs/dbraw/zinc/49/61/60/1131496160.db2.gz SRBKMBWEOTXLAJ-MRXNPFEDSA-N 1 0 269.344 3.712 20 10 CHCDRO CC1(C)C[C@@H](O)CC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC000825090708 1131498996 /nfs/dbraw/zinc/49/89/96/1131498996.db2.gz FKHSJRJXBJSYLK-INIZCTEOSA-N 1 0 299.414 3.528 20 10 CHCDRO CSC(C)(C)C[NH2+]Cc1cc(Cl)c(C)cc1O ZINC000825314918 1131508902 /nfs/dbraw/zinc/50/89/02/1131508902.db2.gz ARNJIWQDPOXWTD-UHFFFAOYSA-N 1 0 273.829 3.585 20 10 CHCDRO CC[C@@H](CSC)[NH2+]Cc1cc(Cl)c(C)cc1O ZINC000825401380 1131510678 /nfs/dbraw/zinc/51/06/78/1131510678.db2.gz VEBIPRPLYNOMCY-NSHDSACASA-N 1 0 273.829 3.585 20 10 CHCDRO Oc1ccccc1C[NH2+][C@@H]1CCc2cc(Cl)ccc2C1 ZINC001171092850 1131517279 /nfs/dbraw/zinc/51/72/79/1131517279.db2.gz ACUUKFMWWYJYDR-MRXNPFEDSA-N 1 0 287.790 3.693 20 10 CHCDRO COc1cc(C)c(C[N@H+](C)Cc2ccccc2O)c(C)c1C ZINC001138725065 1131542947 /nfs/dbraw/zinc/54/29/47/1131542947.db2.gz ODEHUAPYQUJBOS-UHFFFAOYSA-N 1 0 299.414 3.958 20 10 CHCDRO C[N@H+](Cc1ccc(-n2cccc2)cc1)Cc1ccccc1O ZINC001144251608 1131606892 /nfs/dbraw/zinc/60/68/92/1131606892.db2.gz IBGUBCHIHBKRLE-UHFFFAOYSA-N 1 0 292.382 3.815 20 10 CHCDRO Cc1cc(C[N@@H+]2CCC[C@H]3CCC[C@H]32)ccc1N(C)C ZINC001139672718 1131626482 /nfs/dbraw/zinc/62/64/82/1131626482.db2.gz CUAYIKDNPQKSMK-SJLPKXTDSA-N 1 0 272.436 3.826 20 10 CHCDRO Cc1ccc(C[N@H+](C)Cc2ccc(N3CCCC3)cc2)nc1 ZINC001139838812 1131640536 /nfs/dbraw/zinc/64/05/36/1131640536.db2.gz SIZDMHNUGUDMEM-UHFFFAOYSA-N 1 0 295.430 3.622 20 10 CHCDRO CC[N@H+](Cc1cccc(OC)c1)Cc1cc(F)ccc1O ZINC001140058918 1131660163 /nfs/dbraw/zinc/66/01/63/1131660163.db2.gz ONTULAOSZVOPMM-UHFFFAOYSA-N 1 0 289.350 3.562 20 10 CHCDRO Cc1cccc2c1C[N@H+](Cc1c(C)ccc(C)c1O)C2 ZINC001140178226 1131672858 /nfs/dbraw/zinc/67/28/58/1131672858.db2.gz DDGMZVSQYOYLER-UHFFFAOYSA-N 1 0 267.372 3.833 20 10 CHCDRO COc1ccc2c(c1)C[N@@H+](Cc1c(C)ccc(C)c1O)CC2 ZINC001140178149 1131672971 /nfs/dbraw/zinc/67/29/71/1131672971.db2.gz ARNCQXJKWYSTSF-UHFFFAOYSA-N 1 0 297.398 3.576 20 10 CHCDRO Cc1ccc(C)c(C[NH+]2CCc3ccccc3CC2)c1O ZINC001140179040 1131673398 /nfs/dbraw/zinc/67/33/98/1131673398.db2.gz FSJQUYLLLVRHSF-UHFFFAOYSA-N 1 0 281.399 3.610 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+](C)Cc2ccc(N(C)C)cc2)c1O ZINC001140183713 1131674072 /nfs/dbraw/zinc/67/40/72/1131674072.db2.gz IDPWUMUCCWVGMA-UHFFFAOYSA-N 1 0 298.430 3.707 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CC[C@@H]2c2ccccc2)c1O ZINC001140182704 1131674251 /nfs/dbraw/zinc/67/42/51/1131674251.db2.gz XRRJAXYUNGMBDX-QGZVFWFLSA-N 1 0 267.372 3.956 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CCC12CCCC2 ZINC000845999331 1131676870 /nfs/dbraw/zinc/67/68/70/1131676870.db2.gz HMKFPMIFBOQDJU-UHFFFAOYSA-N 1 0 251.757 3.564 20 10 CHCDRO CS[C@@H]1CCCC[C@H]1[NH2+]Cc1cc(C)c(C)cc1O ZINC000846010398 1131677941 /nfs/dbraw/zinc/67/79/41/1131677941.db2.gz LCMMVNAMXLKQIP-GDBMZVCRSA-N 1 0 279.449 3.773 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]CC[C@]1(C)C[C@@]1(F)Cl ZINC000846030123 1131680468 /nfs/dbraw/zinc/68/04/68/1131680468.db2.gz QDXDEXVPUNKHFG-CVEARBPZSA-N 1 0 298.833 3.855 20 10 CHCDRO COc1ccc(C)cc1CC[NH2+][C@H]1CCc2cccc(O)c21 ZINC000834496496 1131680892 /nfs/dbraw/zinc/68/08/92/1131680892.db2.gz LHFLDGDIHDLSCK-INIZCTEOSA-N 1 0 297.398 3.529 20 10 CHCDRO C[C@H](CCCc1cccnc1)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000834496394 1131681123 /nfs/dbraw/zinc/68/11/23/1131681123.db2.gz GKFCMGQXXZXWIK-MRXNPFEDSA-N 1 0 297.446 3.649 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@@H]1CSCc3ccccc31)CC2 ZINC000834545331 1131682847 /nfs/dbraw/zinc/68/28/47/1131682847.db2.gz YETYRCYXXDWMES-JKSUJKDBSA-N 1 0 297.423 3.957 20 10 CHCDRO C[C@@H](CCCc1cccnc1)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000834554804 1131683376 /nfs/dbraw/zinc/68/33/76/1131683376.db2.gz GHIBBXPFVSRKGA-HNNXBMFYSA-N 1 0 296.414 3.518 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]C[C@@H]1CCc3ccccc31)CC2 ZINC000834578534 1131684986 /nfs/dbraw/zinc/68/49/86/1131684986.db2.gz UCXVYKPBYHLKJV-DOTOQJQBSA-N 1 0 279.383 3.699 20 10 CHCDRO C[C@H](C[NH2+][C@@H]1CCc2cccc(O)c21)Cc1cccs1 ZINC000834603235 1131687675 /nfs/dbraw/zinc/68/76/75/1131687675.db2.gz XEGWGRMGZGWWON-SWLSCSKDSA-N 1 0 287.428 3.909 20 10 CHCDRO CCSCC[C@H](C)[NH2+][C@H](C)c1cccc(OC)c1O ZINC000846148915 1131691354 /nfs/dbraw/zinc/69/13/54/1131691354.db2.gz ULNNQMVXBPIHGN-NWDGAFQWSA-N 1 0 283.437 3.583 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CCc2ccc(C)cc2C)c1O ZINC000846148114 1131691469 /nfs/dbraw/zinc/69/14/69/1131691469.db2.gz ZPLAIDAXFXNGHW-HNNXBMFYSA-N 1 0 299.414 3.911 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H]2C[C@@H]2Cc2ccccc2)c1O ZINC000846155973 1131692025 /nfs/dbraw/zinc/69/20/25/1131692025.db2.gz RIUVCNGIYRAMAI-JLJPHGGASA-N 1 0 297.398 3.683 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H]2CCCC(F)(F)C2)c1O ZINC000846157005 1131692229 /nfs/dbraw/zinc/69/22/29/1131692229.db2.gz RISDDHMSSRJNIS-WDEREUQCSA-N 1 0 285.334 3.629 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CCc2sccc2C)c1O ZINC000846160402 1131692970 /nfs/dbraw/zinc/69/29/70/1131692970.db2.gz VJGZCHJZXNNDAO-GFCCVEGCSA-N 1 0 291.416 3.664 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]C[C@H]2CCC[C@@H]2C2CC2)c1O ZINC000846168660 1131692973 /nfs/dbraw/zinc/69/29/73/1131692973.db2.gz LKIQERSVBCLMHD-JGGQBBKZSA-N 1 0 289.419 3.878 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CCc2ccccc2C)c1O ZINC000846136484 1131693600 /nfs/dbraw/zinc/69/36/00/1131693600.db2.gz IVUMRDJVHHPZPQ-AWEZNQCLSA-N 1 0 285.387 3.603 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@H]2CCCc3occc32)c1O ZINC000846138249 1131693779 /nfs/dbraw/zinc/69/37/79/1131693779.db2.gz AGCBNDXIWOHFDT-RISCZKNCSA-N 1 0 287.359 3.722 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@@H](C)Cc2cccs2)c1O ZINC000846139060 1131694072 /nfs/dbraw/zinc/69/40/72/1131694072.db2.gz PGPLIZCSAODSGW-NWDGAFQWSA-N 1 0 291.416 3.744 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]Cc2ccc(F)c(C)c2)c1O ZINC000846137041 1131694125 /nfs/dbraw/zinc/69/41/25/1131694125.db2.gz QQINVPFHNBBKRM-LBPRGKRZSA-N 1 0 289.350 3.699 20 10 CHCDRO CC(C)CSCCC[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000834692942 1131694306 /nfs/dbraw/zinc/69/43/06/1131694306.db2.gz JMEFQVDNGZHOOX-CQSZACIVSA-N 1 0 279.449 3.748 20 10 CHCDRO CC(C)OC1CCC([NH2+][C@@H]2CCc3cccc(O)c32)CC1 ZINC000834689054 1131694407 /nfs/dbraw/zinc/69/44/07/1131694407.db2.gz IOEUWEPHXKLYSG-UYSNPLJNSA-N 1 0 289.419 3.705 20 10 CHCDRO CCC[C@H](C)[C@H](CO)[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000846183988 1131696475 /nfs/dbraw/zinc/69/64/75/1131696475.db2.gz LLPPMKUDFJFFQF-BPUTZDHNSA-N 1 0 279.424 3.538 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H](C2CC2)C2CCOCC2)c(O)c1 ZINC000846185473 1131697947 /nfs/dbraw/zinc/69/79/47/1131697947.db2.gz AERNYZFWRFXFRN-SCLBCKFNSA-N 1 0 289.419 3.556 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)COCC1CC1)c1ccc(N(C)C)cc1 ZINC000846202397 1131699478 /nfs/dbraw/zinc/69/94/78/1131699478.db2.gz CHLVUHNYCYCSCA-KSSFIOAISA-N 1 0 290.451 3.608 20 10 CHCDRO CO[C@@H]1CCCC[C@H]1[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000846200605 1131699579 /nfs/dbraw/zinc/69/95/79/1131699579.db2.gz GFOPLWHWELVLNN-WDBKCZKBSA-N 1 0 283.799 3.654 20 10 CHCDRO CC(C)O[C@@H]1C[C@@H]([NH2+][C@H]2CCc3cccc(O)c32)C1(C)C ZINC000834766242 1131703246 /nfs/dbraw/zinc/70/32/46/1131703246.db2.gz RLDPWWKMHGJSLX-NUEKZKHPSA-N 1 0 289.419 3.561 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]CCCc1ccccc1F)CC2 ZINC000834790593 1131705747 /nfs/dbraw/zinc/70/57/47/1131705747.db2.gz STEMGNKTEUQWAR-INIZCTEOSA-N 1 0 285.362 3.741 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CSc2ccccc21)c1ccccc1O ZINC000834817876 1131707335 /nfs/dbraw/zinc/70/73/35/1131707335.db2.gz DTAHJKBGBIAZFN-STQMWFEESA-N 1 0 285.412 3.932 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCn2ccnc21)c1ccc2ccccc2c1O ZINC000834832812 1131710344 /nfs/dbraw/zinc/71/03/44/1131710344.db2.gz RNPDTSYTIKDVIZ-LRDDRELGSA-N 1 0 293.370 3.538 20 10 CHCDRO CO[C@H](C[NH2+][C@@H](C)c1cc(C)ccc1O)Cc1ccccc1 ZINC000834856072 1131712759 /nfs/dbraw/zinc/71/27/59/1131712759.db2.gz KJEWEDGCUVTYBQ-RDJZCZTQSA-N 1 0 299.414 3.609 20 10 CHCDRO CCC1([NH2+][C@@H](C)c2ccc(Br)cc2O)CC1 ZINC000834874793 1131715180 /nfs/dbraw/zinc/71/51/80/1131715180.db2.gz GWVWUJLCQJRBLV-VIFPVBQESA-N 1 0 284.197 3.748 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@@](C)(CC)OC)cc1 ZINC000834882174 1131717010 /nfs/dbraw/zinc/71/70/10/1131717010.db2.gz KCWNCMILNGCCMS-RHSMWYFYSA-N 1 0 278.440 3.608 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@]2(C)CC2(Cl)Cl)c(O)c1 ZINC000834885905 1131718209 /nfs/dbraw/zinc/71/82/09/1131718209.db2.gz YVAFSMJPRGAAEB-MFKMUULPSA-N 1 0 288.218 3.935 20 10 CHCDRO Cc1ccncc1C[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000834887221 1131719521 /nfs/dbraw/zinc/71/95/21/1131719521.db2.gz QCZGDBMUERYQBT-FZMZJTMJSA-N 1 0 286.350 3.573 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2C[C@@H](C)n3ccnc32)cc1 ZINC000834896817 1131721575 /nfs/dbraw/zinc/72/15/75/1131721575.db2.gz OBQLUQQGZLRMIB-JKIFEVAISA-N 1 0 298.434 3.696 20 10 CHCDRO CCn1ccnc1[C@H](C)[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000834896111 1131721756 /nfs/dbraw/zinc/72/17/56/1131721756.db2.gz UQDFVXSPCNFEHV-KGLIPLIRSA-N 1 0 287.407 3.637 20 10 CHCDRO CCn1ccnc1[C@@H](C)[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000834897006 1131722253 /nfs/dbraw/zinc/72/22/53/1131722253.db2.gz XXCHQMAKUXEDRX-ZIAGYGMSSA-N 1 0 287.407 3.637 20 10 CHCDRO CCc1ncc(C[NH2+][C@H](C)c2ccc3ccccc3c2O)o1 ZINC000834898501 1131724382 /nfs/dbraw/zinc/72/43/82/1131724382.db2.gz FHIGBOJDXYKFNP-GFCCVEGCSA-N 1 0 296.370 3.947 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)[C@H](OC)C1CC1)c1cc(Cl)ccc1O ZINC000834901875 1131725553 /nfs/dbraw/zinc/72/55/53/1131725553.db2.gz AGKXPCDEXUYZRW-FSBGKCOPSA-N 1 0 297.826 3.900 20 10 CHCDRO CC[C@H]([NH2+]CCC[C@H]1CCOC1)c1ccc(N(C)C)cc1 ZINC000834903548 1131727031 /nfs/dbraw/zinc/72/70/31/1131727031.db2.gz KTMIYWIWBGPGJY-YJBOKZPZSA-N 1 0 290.451 3.610 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](C)[C@@H](OC)C2CC2)cc1 ZINC000834904444 1131728055 /nfs/dbraw/zinc/72/80/55/1131728055.db2.gz OEBQLHBVZGMQPP-SUNYJGFJSA-N 1 0 290.451 3.607 20 10 CHCDRO COc1cccc([C@H]2C[C@H]([NH2+][C@@H](C)c3ccccc3O)C2)c1 ZINC000834906282 1131728299 /nfs/dbraw/zinc/72/82/99/1131728299.db2.gz YSIRJDFEVXMLQK-BPUTZDHNSA-N 1 0 297.398 3.998 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CC(C)(C)C2(O)CCCC2)c1 ZINC000834905375 1131729043 /nfs/dbraw/zinc/72/90/43/1131729043.db2.gz GMXOPNUTQDVCJO-AWEZNQCLSA-N 1 0 291.435 3.683 20 10 CHCDRO C[C@@H]([NH2+]CCC1CC(F)(F)C1)c1ccc(N(C)C)cc1 ZINC000834910215 1131730080 /nfs/dbraw/zinc/73/00/80/1131730080.db2.gz WBZAALGURCEJTB-GFCCVEGCSA-N 1 0 282.378 3.839 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCOC(C)(C)C1)c1ccc(C)cc1O ZINC000834909133 1131730174 /nfs/dbraw/zinc/73/01/74/1131730174.db2.gz JHSCJEXSVLFWJI-ZBFHGGJFSA-N 1 0 291.435 3.947 20 10 CHCDRO Cc1nsc(C)c1C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000846862688 1131745806 /nfs/dbraw/zinc/74/58/06/1131745806.db2.gz WUOSNPPWQIPSKN-NSHDSACASA-N 1 0 289.448 3.677 20 10 CHCDRO Oc1cc(Cl)ccc1C[N@@H+]1CCC[C@H]2CCC[C@@H]21 ZINC001140465429 1131751619 /nfs/dbraw/zinc/75/16/19/1131751619.db2.gz NAGBPWHMYKRBBB-RISCZKNCSA-N 1 0 265.784 3.810 20 10 CHCDRO CC(C)OCCC[N@H+](C)C/C=C/c1ccc(N(C)C)cc1 ZINC000835025911 1131759779 /nfs/dbraw/zinc/75/97/79/1131759779.db2.gz NJLQZACAVUVHPB-SOFGYWHQSA-N 1 0 290.451 3.513 20 10 CHCDRO C[C@@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)C1(C)CC1 ZINC000835037252 1131760392 /nfs/dbraw/zinc/76/03/92/1131760392.db2.gz PGKVVWHNWCTQFK-GEXIGZQTSA-N 1 0 258.409 3.544 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]C(C2CC2)C2CC2)cc1 ZINC000835036582 1131760596 /nfs/dbraw/zinc/76/05/96/1131760596.db2.gz MMPFUQCQWJVPBI-ONEGZZNKSA-N 1 0 270.420 3.544 20 10 CHCDRO CC[C@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)c1ccncc1 ZINC000835039075 1131762966 /nfs/dbraw/zinc/76/29/66/1131762966.db2.gz ASPSFSAUWPNOJJ-UEKDZROGSA-N 1 0 295.430 3.902 20 10 CHCDRO Cc1noc(C)c1[C@H](C)[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC000835040233 1131762995 /nfs/dbraw/zinc/76/29/95/1131762995.db2.gz OICSMSZYKAAAFB-FWWRYZNZSA-N 1 0 299.418 3.721 20 10 CHCDRO C[C@H]1CCSCC[N@@H+]1C/C=C/c1ccc(N(C)C)cc1 ZINC000835049400 1131764900 /nfs/dbraw/zinc/76/49/00/1131764900.db2.gz RDRBANMEMZXUEO-RGDDUWESSA-N 1 0 290.476 3.593 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]C[C@H]2CCCCS2)cc1 ZINC000835048288 1131765007 /nfs/dbraw/zinc/76/50/07/1131765007.db2.gz PRJSCGTUBCTHTN-KEGWNNHHSA-N 1 0 290.476 3.641 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]C[C@H]2CCCCS2)cc1 ZINC000835048287 1131765364 /nfs/dbraw/zinc/76/53/64/1131765364.db2.gz PRJSCGTUBCTHTN-FUTAKVPZSA-N 1 0 290.476 3.641 20 10 CHCDRO CN(C)c1ccc(/C=C\C[N@H+](C)Cc2ccc(O)cc2)cc1 ZINC000835054762 1131766302 /nfs/dbraw/zinc/76/63/02/1131766302.db2.gz YBCPJKYAEZJENJ-PLNGDYQASA-N 1 0 296.414 3.603 20 10 CHCDRO C[C@H]1CC[C@H](C[NH2+]Cc2cc(-c3ccccc3)ccc2O)O1 ZINC000835088827 1131771015 /nfs/dbraw/zinc/77/10/15/1131771015.db2.gz VIPOMLSSWNAOCV-KBXCAEBGSA-N 1 0 297.398 3.716 20 10 CHCDRO C[N@@H+]1CC[C@@H](Oc2ccccc2NN=C2C=CC=CC2=O)C1 ZINC001228420290 1131879286 /nfs/dbraw/zinc/87/92/86/1131879286.db2.gz UIFTVWMMZMANHM-NIVDNSEKSA-N 1 0 297.358 3.891 20 10 CHCDRO Cc1c(O)ccc(C[N@@H+]2CCC[C@@H]2c2ccccc2)c1O ZINC001140745547 1131905101 /nfs/dbraw/zinc/90/51/01/1131905101.db2.gz KHMQAGQAWLAMJX-MRXNPFEDSA-N 1 0 283.371 3.743 20 10 CHCDRO Cc1c(O)ccc(C[N@@H+]2CCC[C@H]3CCCC[C@@H]32)c1O ZINC001140749133 1131906575 /nfs/dbraw/zinc/90/65/75/1131906575.db2.gz QUCDOJHEZKCANS-HIFRSBDPSA-N 1 0 275.392 3.561 20 10 CHCDRO CC[C@@H](c1ccccc1)[N@H+](C)Cc1ccc(O)c(C)c1O ZINC001140749272 1131906659 /nfs/dbraw/zinc/90/66/59/1131906659.db2.gz UXENTHMSJJROIZ-INIZCTEOSA-N 1 0 285.387 3.989 20 10 CHCDRO CC[N@H+](Cc1cc(O)cc(Cl)c1)Cc1ccccc1O ZINC001140797804 1131923923 /nfs/dbraw/zinc/92/39/23/1131923923.db2.gz RNBLTJVUGMYMFW-UHFFFAOYSA-N 1 0 291.778 3.773 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)COC2)c1ccc(N(C)C)cc1 ZINC000773077038 1131937710 /nfs/dbraw/zinc/93/77/10/1131937710.db2.gz BNNDDNLXZQUIDU-AWEZNQCLSA-N 1 0 296.414 3.634 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](C)C2CCC2)cc1 ZINC000773105791 1131945794 /nfs/dbraw/zinc/94/57/94/1131945794.db2.gz QWRJYDOHXWKIFQ-UONOGXRCSA-N 1 0 260.425 3.982 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](CC2CC2)C2CC2)c(O)c1 ZINC001140857095 1131948801 /nfs/dbraw/zinc/94/88/01/1131948801.db2.gz LQZYDNLXQUXBFQ-UHFFFAOYSA-N 1 0 288.435 3.613 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+]2C[C@H](C)C[C@H](C)C2)c(O)c1 ZINC001140856043 1131949083 /nfs/dbraw/zinc/94/90/83/1131949083.db2.gz PTEINOZBRNTWKF-GASCZTMLSA-N 1 0 290.451 3.716 20 10 CHCDRO CC[C@H]1CCC[N@H+](Cc2ccc(N(CC)CC)cc2O)C1 ZINC001140856355 1131949255 /nfs/dbraw/zinc/94/92/55/1131949255.db2.gz YUPQYPMYKJNBLC-HNNXBMFYSA-N 1 0 290.451 3.860 20 10 CHCDRO CCN(CC)c1ccc(C[NH+]2C[C@H](C)C[C@@H](C)C2)c(O)c1 ZINC001140856045 1131949471 /nfs/dbraw/zinc/94/94/71/1131949471.db2.gz PTEINOZBRNTWKF-HUUCEWRRSA-N 1 0 290.451 3.716 20 10 CHCDRO CN(C)c1ccc(C[NH+]2CC3(C2)CCCC3)c(Cl)c1 ZINC001140922111 1131963371 /nfs/dbraw/zinc/96/33/71/1131963371.db2.gz HLLSQFMBMUPTAQ-UHFFFAOYSA-N 1 0 278.827 3.782 20 10 CHCDRO Cc1ccc(C[N@@H+]2CC[C@H](c3ccccc3F)C2)c(O)c1 ZINC001140950209 1131969387 /nfs/dbraw/zinc/96/93/87/1131969387.db2.gz VRILDJFXBBJDGN-AWEZNQCLSA-N 1 0 285.362 3.829 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccccc1O)c1ccc(F)cc1F ZINC000036952738 1131983071 /nfs/dbraw/zinc/98/30/71/1131983071.db2.gz VZIYCDIKEAATHL-SNVBAGLBSA-N 1 0 263.287 3.521 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)Cc2ccco2)c(O)c1 ZINC000036993356 1131985443 /nfs/dbraw/zinc/98/54/43/1131985443.db2.gz MAGZFBCGIFBTTF-QWHCGFSZSA-N 1 0 259.349 3.575 20 10 CHCDRO C[C@H]([NH2+]CC1C[C@H]2CC[C@@H](C1)S2)c1ccccc1O ZINC000716000434 1132007920 /nfs/dbraw/zinc/00/79/20/1132007920.db2.gz JAZDICUNMIIOIJ-FUDCBSFHSA-N 1 0 277.433 3.717 20 10 CHCDRO Cc1cccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)c1 ZINC000037230780 1132023630 /nfs/dbraw/zinc/02/36/30/1132023630.db2.gz DNAJWEVGSYWDMF-OAHLLOKOSA-N 1 0 268.404 3.912 20 10 CHCDRO Oc1ccc(O)c(C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)c1 ZINC001141156602 1132028979 /nfs/dbraw/zinc/02/89/79/1132028979.db2.gz OIDZIKCGVWAMDJ-MRXNPFEDSA-N 1 0 287.334 3.574 20 10 CHCDRO Oc1ccc(O)c(C[N@@H+]2CCC[C@H]2c2ccccc2F)c1 ZINC001141159330 1132031511 /nfs/dbraw/zinc/03/15/11/1132031511.db2.gz FDBLPQSCKXJMKL-INIZCTEOSA-N 1 0 287.334 3.574 20 10 CHCDRO Cc1cccc2c1CC[C@@H]([NH2+][C@@H](C)c1ccccc1O)C2 ZINC001171552990 1132052916 /nfs/dbraw/zinc/05/29/16/1132052916.db2.gz JRGUDOADQHCPOP-GOEBONIOSA-N 1 0 281.399 3.909 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CCc3c(C)cccc3C2)cc1C ZINC001171560625 1132055327 /nfs/dbraw/zinc/05/53/27/1132055327.db2.gz UTDDLHCFZXDUFX-GOSISDBHSA-N 1 0 295.426 3.959 20 10 CHCDRO CC[C@@H]1C[N@H+](Cc2ccc(N(C)CC)cc2)[C@H](CC)CO1 ZINC001171778860 1132098696 /nfs/dbraw/zinc/09/86/96/1132098696.db2.gz QULLHEQMNXDWPE-SJLPKXTDSA-N 1 0 290.451 3.532 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCC[C@@H]3CCCC[C@H]32)c1 ZINC000228136792 1132107780 /nfs/dbraw/zinc/10/77/80/1132107780.db2.gz GYJLSXKQXNQORD-GOEBONIOSA-N 1 0 259.393 3.855 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CSc2ccccc2C1)c1ccccc1O ZINC001172188748 1132137477 /nfs/dbraw/zinc/13/74/77/1132137477.db2.gz WDEDXLPGOVMSFL-JSGCOSHPSA-N 1 0 285.412 3.760 20 10 CHCDRO CC[C@H](C)OCC[C@H](C)[NH2+]Cc1c(C)cc(C)cc1O ZINC001172340106 1132177076 /nfs/dbraw/zinc/17/70/76/1132177076.db2.gz VYJGGJHZJNOKHP-GJZGRUSLSA-N 1 0 279.424 3.692 20 10 CHCDRO Cc1ccc(O)c(C[NH+]2CC(Cc3ccc(F)cc3)C2)c1 ZINC000839134766 1132183523 /nfs/dbraw/zinc/18/35/23/1132183523.db2.gz PXKJKEWDUHYMPW-UHFFFAOYSA-N 1 0 285.362 3.514 20 10 CHCDRO CCOCc1cc(C[NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)ccc1OC ZINC000839186887 1132188656 /nfs/dbraw/zinc/18/86/56/1132188656.db2.gz RTLDVGMGTUWXQV-HYVNUMGLSA-N 1 0 289.419 3.510 20 10 CHCDRO CC[C@H](CC(C)C)[N@@H+]1CCCc2cc(O)c(O)cc2C1 ZINC001172404222 1132196402 /nfs/dbraw/zinc/19/64/02/1132196402.db2.gz SXSAUUDQNGMFMC-OAHLLOKOSA-N 1 0 277.408 3.671 20 10 CHCDRO C[N@H+](Cc1ccc2cc(F)ccc2n1)Cc1ccccc1O ZINC001141650949 1132225016 /nfs/dbraw/zinc/22/50/16/1132225016.db2.gz PJPBRUBBUQNGTI-UHFFFAOYSA-N 1 0 296.345 3.712 20 10 CHCDRO COC[C@]1(C)CC[N@H+](Cc2cc(C(C)C)c(C)cc2O)C1 ZINC000840108687 1132247282 /nfs/dbraw/zinc/24/72/82/1132247282.db2.gz RLORZTFUPLRSFK-GOSISDBHSA-N 1 0 291.435 3.682 20 10 CHCDRO COc1ccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2)c(C)c1 ZINC000840709583 1132272757 /nfs/dbraw/zinc/27/27/57/1132272757.db2.gz KHHQDUYFPJVPLI-OAHLLOKOSA-N 1 0 298.430 3.920 20 10 CHCDRO COC1CCC([NH2+][C@@H](C)c2cc(Cl)ccc2O)CC1 ZINC000840791669 1132287372 /nfs/dbraw/zinc/28/73/72/1132287372.db2.gz BPIWHNLQPCGTMD-PKSQDBQZSA-N 1 0 283.799 3.654 20 10 CHCDRO CO[C@@H]1C[C@@H]([NH2+][C@@H](C)c2ccc(C)c(C)c2O)C12CCC2 ZINC000840806493 1132288597 /nfs/dbraw/zinc/28/85/97/1132288597.db2.gz HUGUJAHEFOILTP-NUEKZKHPSA-N 1 0 289.419 3.617 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]C1(C3CCC3)CCC1)CC2 ZINC000840811454 1132290633 /nfs/dbraw/zinc/29/06/33/1132290633.db2.gz LATAMNDSHQANEX-AWEZNQCLSA-N 1 0 257.377 3.692 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)[C@@](C)(OC)C1CC1)c1ccc(C)cc1O ZINC000840858840 1132295509 /nfs/dbraw/zinc/29/55/09/1132295509.db2.gz GZHIPPALFDWLBD-RPVQJOFSSA-N 1 0 291.435 3.945 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CS[C@H](C)C1)c1cc2c(cc1O)CCCC2 ZINC000840858954 1132296171 /nfs/dbraw/zinc/29/61/71/1132296171.db2.gz FASPFGFTMBFYGK-JMSVASOKSA-N 1 0 291.460 3.816 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1C[C@H](C)O[C@H]1C)c1ccc(C)cc1O ZINC000840872309 1132299321 /nfs/dbraw/zinc/29/93/21/1132299321.db2.gz KHQXXYSVLPZEMF-YXWQFLTLSA-N 1 0 277.408 3.555 20 10 CHCDRO Cc1occc1C[NH2+]Cc1c(O)cc(C)cc1Cl ZINC000840883649 1132302624 /nfs/dbraw/zinc/30/26/24/1132302624.db2.gz HCGJVRBZSZSEER-UHFFFAOYSA-N 1 0 265.740 3.545 20 10 CHCDRO COCCC1(C[NH2+]Cc2c(O)cc(C)cc2Cl)CCC1 ZINC000840904599 1132308303 /nfs/dbraw/zinc/30/83/03/1132308303.db2.gz BRBLFYMNEXNWGT-UHFFFAOYSA-N 1 0 297.826 3.650 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@H]1c1ccc[nH]1 ZINC000840908198 1132308348 /nfs/dbraw/zinc/30/83/48/1132308348.db2.gz PSYTVYMCUKHENE-SFHVURJKSA-N 1 0 283.419 3.726 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]C1CCC(F)(F)CC1 ZINC000840937388 1132309573 /nfs/dbraw/zinc/30/95/73/1132309573.db2.gz SIHBYUOXPODZLF-UHFFFAOYSA-N 1 0 282.378 3.729 20 10 CHCDRO COc1cc(C)cc(C[NH2+]Cc2ccc(N(C)C)cc2C)c1 ZINC000840937727 1132309764 /nfs/dbraw/zinc/30/97/64/1132309764.db2.gz WVBZXNDDHZQGNL-UHFFFAOYSA-N 1 0 298.430 3.668 20 10 CHCDRO CSC[C@H]1CCC[N@H+](Cc2ccc(N(C)C)cc2C)C1 ZINC000840950629 1132311481 /nfs/dbraw/zinc/31/14/81/1132311481.db2.gz PPSUIORROIFJJA-HNNXBMFYSA-N 1 0 292.492 3.636 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+]C1CC(C(F)F)C1 ZINC000840976703 1132316927 /nfs/dbraw/zinc/31/69/27/1132316927.db2.gz QDNVMPQWHMKKMY-GRTSSRMGSA-N 1 0 296.405 3.625 20 10 CHCDRO Cc1cccc(C[N@H+]2CC[C@@H](C)C(F)(F)CC2)c1O ZINC001231591163 1132317058 /nfs/dbraw/zinc/31/70/58/1132317058.db2.gz VDLGDXMVWBXYMZ-GFCCVEGCSA-N 1 0 269.335 3.568 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CCC(F)(F)[C@H](F)C1 ZINC001231587365 1132318389 /nfs/dbraw/zinc/31/83/89/1132318389.db2.gz ADUBTGPLRYJTQP-OAHLLOKOSA-N 1 0 295.304 3.725 20 10 CHCDRO CCCO[C@@H]1CC[N@H+](Cc2c(O)ccc3ccccc32)C1 ZINC001231588991 1132318774 /nfs/dbraw/zinc/31/87/74/1132318774.db2.gz ULORAGHMBVQGIG-OAHLLOKOSA-N 1 0 285.387 3.546 20 10 CHCDRO Cc1cccc(C[N@H+]2CC=C(c3ccccc3)CC2)c1O ZINC001231593717 1132319934 /nfs/dbraw/zinc/31/99/34/1132319934.db2.gz LKYJOLHHHWFZAB-UHFFFAOYSA-N 1 0 279.383 3.990 20 10 CHCDRO COc1cccc([C@@H]2CC[N@H+](Cc3cccc(C)c3O)C2)c1 ZINC001231594845 1132322170 /nfs/dbraw/zinc/32/21/70/1132322170.db2.gz PYSCDWSSRBRSDS-MRXNPFEDSA-N 1 0 297.398 3.699 20 10 CHCDRO Nc1ccc(CC[NH2+][C@@H]2CCC[C@H](C(F)(F)F)C2)cc1 ZINC000841038032 1132323475 /nfs/dbraw/zinc/32/34/75/1132323475.db2.gz GANKSUVCWDPLMZ-GXTWGEPZSA-N 1 0 286.341 3.522 20 10 CHCDRO Cc1ccc2c(c1)C[C@@H]([NH2+]Cc1cccc(C)c1O)CC2 ZINC001172831830 1132324707 /nfs/dbraw/zinc/32/47/07/1132324707.db2.gz PWJPDADPKGBTBJ-SFHVURJKSA-N 1 0 281.399 3.656 20 10 CHCDRO Cc1ccc2c(c1)C[C@@H]([N@H+](C)Cc1ccccc1O)CC2 ZINC001172840390 1132333687 /nfs/dbraw/zinc/33/36/87/1132333687.db2.gz BFVPHIVMQCBNOQ-SFHVURJKSA-N 1 0 281.399 3.690 20 10 CHCDRO CO[C@@H]1CCC[C@H]([NH2+]Cc2cc3ccccc3cc2O)C1 ZINC001172922623 1132363234 /nfs/dbraw/zinc/36/32/34/1132363234.db2.gz IYRVPKZMEBZPGQ-DLBZAZTESA-N 1 0 285.387 3.593 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCc3c(C)cccc3C2)c(O)c1 ZINC001231842246 1132375613 /nfs/dbraw/zinc/37/56/13/1132375613.db2.gz LQUQKKOYRHFMJL-UHFFFAOYSA-N 1 0 281.399 3.876 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2c(C)cc(C)cc2O)cc1 ZINC001231845906 1132378668 /nfs/dbraw/zinc/37/86/68/1132378668.db2.gz UEGONGRMTNAWED-UHFFFAOYSA-N 1 0 269.388 3.949 20 10 CHCDRO Cc1cc(O)c(C[NH+]2CCC(C)(F)CC2)cc1Cl ZINC001231869503 1132382989 /nfs/dbraw/zinc/38/29/89/1132382989.db2.gz UKIPDPVSIDAGLI-UHFFFAOYSA-N 1 0 271.763 3.678 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@H](C(F)F)C2)cc1Cl ZINC001231870851 1132385371 /nfs/dbraw/zinc/38/53/71/1132385371.db2.gz VFSWXWWGDMLORH-SNVBAGLBSA-N 1 0 289.753 3.831 20 10 CHCDRO C[C@H]1C[N@H+](Cc2ccc3ccccc3c2O)CCC[C@@]1(C)O ZINC001231879574 1132389067 /nfs/dbraw/zinc/38/90/67/1132389067.db2.gz IZCXNJXCKWVHOW-IFXJQAMLSA-N 1 0 299.414 3.528 20 10 CHCDRO C[C@@H]([NH2+][C@H](CO)C1CCCCC1)c1ccc(Cl)cc1O ZINC000841751191 1132389336 /nfs/dbraw/zinc/38/93/36/1132389336.db2.gz MILRQXZGGSHEHP-IAQYHMDHSA-N 1 0 297.826 3.637 20 10 CHCDRO Cc1nc(C)c(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)s1 ZINC000841748531 1132390994 /nfs/dbraw/zinc/39/09/94/1132390994.db2.gz ALQBZWBOZCZLKP-QMMMGPOBSA-N 1 0 296.823 3.970 20 10 CHCDRO Oc1c(C[N@@H+]2CCCC[C@@H](F)C2)ccc2ccccc21 ZINC001231879615 1132392364 /nfs/dbraw/zinc/39/23/64/1132392364.db2.gz KQWUXYXZOIFHKB-OAHLLOKOSA-N 1 0 273.351 3.869 20 10 CHCDRO Oc1c(C[N@@H+]2CC[C@@H]3CCCO[C@@H]3C2)ccc2ccccc21 ZINC001231879347 1132392393 /nfs/dbraw/zinc/39/23/93/1132392393.db2.gz CGPTXAFTCKNZNF-MAUKXSAKSA-N 1 0 297.398 3.546 20 10 CHCDRO CCO[C@@H]1CCC[C@H]1[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841757627 1132393874 /nfs/dbraw/zinc/39/38/74/1132393874.db2.gz NYKROSLFFBJNBR-PSOPSSQASA-N 1 0 283.799 3.654 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H]2COCc3ccccc32)c1 ZINC000841758350 1132394947 /nfs/dbraw/zinc/39/49/47/1132394947.db2.gz 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CC[C@@H]([NH2+][C@@H](CO)C[C@@H](C)CC)c1ccc(C)cc1O ZINC000842915914 1132476639 /nfs/dbraw/zinc/47/66/39/1132476639.db2.gz HWKSZKIMKSSULO-JGGQBBKZSA-N 1 0 279.424 3.538 20 10 CHCDRO Cc1cccc(F)c1C[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC001232487828 1132479931 /nfs/dbraw/zinc/47/99/31/1132479931.db2.gz VTTZHMIWDVZSKU-UHFFFAOYSA-N 1 0 286.394 3.832 20 10 CHCDRO C[N@H+](Cc1cccc(C(C)(C)C)c1O)C1CC(F)(F)C1 ZINC001143103433 1132501867 /nfs/dbraw/zinc/50/18/67/1132501867.db2.gz DBDYRCHMTXZRLA-UHFFFAOYSA-N 1 0 283.362 3.919 20 10 CHCDRO C[N@@H+](Cc1cccc(C(C)(C)C)c1O)CC1CCOCC1 ZINC001143103957 1132502827 /nfs/dbraw/zinc/50/28/27/1132502827.db2.gz NRXLPYCAFSHXLX-UHFFFAOYSA-N 1 0 291.435 3.548 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)[C@H]2CCc3ccccc32)c(O)c1 ZINC001232841735 1132528740 /nfs/dbraw/zinc/52/87/40/1132528740.db2.gz APNUQTYVDBNJSW-SFHVURJKSA-N 1 0 296.414 3.578 20 10 CHCDRO C[C@H](C[NH2+]Cc1ccc2ccccc2c1O)CC(F)F ZINC000843418308 1132531039 /nfs/dbraw/zinc/53/10/39/1132531039.db2.gz 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C[N@H+](Cc1ccccc1O)C(C)(C)Cc1ccccc1 ZINC001203558672 1133339728 /nfs/dbraw/zinc/33/97/28/1133339728.db2.gz UNKMYDGOPCZORV-UHFFFAOYSA-N 1 0 269.388 3.845 20 10 CHCDRO COc1cccc(C[NH+]2CCC3(CC[C@H](F)C3)CC2)c1O ZINC001203596853 1133344491 /nfs/dbraw/zinc/34/44/91/1133344491.db2.gz PBSGZZNSLCQHGM-AWEZNQCLSA-N 1 0 293.382 3.505 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CC[C@H](C3CCCCC3)C2)c1 ZINC001203680395 1133352985 /nfs/dbraw/zinc/35/29/85/1133352985.db2.gz UEXIHJONHOXANU-HNNXBMFYSA-N 1 0 289.419 3.803 20 10 CHCDRO CC(C)[N@H+](Cc1ccccc1)Cc1ccc(O)c(O)c1 ZINC001203874068 1133378661 /nfs/dbraw/zinc/37/86/61/1133378661.db2.gz MVKUKKMUROIOFN-UHFFFAOYSA-N 1 0 271.360 3.508 20 10 CHCDRO CC(C)(C)[N@H+](Cc1ccccc1)Cc1ccc(O)c(O)c1 ZINC001203874146 1133378767 /nfs/dbraw/zinc/37/87/67/1133378767.db2.gz QGRGDBIQBDPKMW-UHFFFAOYSA-N 1 0 285.387 3.899 20 10 CHCDRO Oc1cccc2c1C[N@H+](Cc1ccc(Cl)cc1)CC2 ZINC001203922829 1133385644 /nfs/dbraw/zinc/38/56/44/1133385644.db2.gz CKGWCWGLOLZJCG-UHFFFAOYSA-N 1 0 273.763 3.604 20 10 CHCDRO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1ccc(N(C)C)cc1 ZINC001203937617 1133385845 /nfs/dbraw/zinc/38/58/45/1133385845.db2.gz HJXYPXFAQDDZIW-HNNXBMFYSA-N 1 0 280.415 3.699 20 10 CHCDRO Cc1cccc(CC[N@@H+](C)Cc2ccc(N(C)C)cc2)c1 ZINC001203933919 1133386540 /nfs/dbraw/zinc/38/65/40/1133386540.db2.gz HOBNCZUKBGYYTB-UHFFFAOYSA-N 1 0 282.431 3.736 20 10 CHCDRO CCN(CC)c1ccc(C[NH+]2CC(c3cccnc3)C2)cc1 ZINC001203941549 1133387541 /nfs/dbraw/zinc/38/75/41/1133387541.db2.gz BEZXJYHYWYTTOW-UHFFFAOYSA-N 1 0 295.430 3.527 20 10 CHCDRO C[N@H+](Cc1ccc(O)cc1)Cc1ccc(N2CCCC2)cc1 ZINC001204094125 1133408005 /nfs/dbraw/zinc/40/80/05/1133408005.db2.gz YSEDSXUIWOXAJJ-UHFFFAOYSA-N 1 0 296.414 3.624 20 10 CHCDRO C[C@@H]1CCC[N@@H+]1Cc1ccc(N(C)C)c2ccccc12 ZINC001204233695 1133423028 /nfs/dbraw/zinc/42/30/28/1133423028.db2.gz UKDDXPTYAGYVSL-CQSZACIVSA-N 1 0 268.404 3.890 20 10 CHCDRO CC1(C)CCC[N@@H+]1Cc1ccc(N2CCCC2)cc1 ZINC001204326260 1133438430 /nfs/dbraw/zinc/43/84/30/1133438430.db2.gz WHLOHVXVCXAHAJ-UHFFFAOYSA-N 1 0 258.409 3.661 20 10 CHCDRO CC[C@H]1CC[N@H+](Cc2cc(Cl)c(C)cc2O)C1 ZINC001204388370 1133441530 /nfs/dbraw/zinc/44/15/30/1133441530.db2.gz BKANOOCJZIKCSB-NSHDSACASA-N 1 0 253.773 3.586 20 10 CHCDRO C[C@@H]1[C@H](C)SCC[N@@H+]1C/C=C\c1ccc(N(C)C)cc1 ZINC001204768497 1133483348 /nfs/dbraw/zinc/48/33/48/1133483348.db2.gz JTMQJDLPADYMKL-JGUVHBTRSA-N 1 0 290.476 3.592 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CC[C@H](C)[C@@H]3CCCC[C@H]32)c1 ZINC001204880679 1133495514 /nfs/dbraw/zinc/49/55/14/1133495514.db2.gz FGRXADFAOURPCU-RRQGHBQHSA-N 1 0 289.419 3.801 20 10 CHCDRO COCCC(C)(C)C[NH2+]Cc1cc(C(C)C)ccc1O ZINC001205348213 1133566559 /nfs/dbraw/zinc/56/65/59/1133566559.db2.gz ZWXMLGLSVFOPFV-UHFFFAOYSA-N 1 0 279.424 3.668 20 10 CHCDRO CC[C@H]1C[N@H+](Cc2cc(C(C)C)ccc2O)CCCO1 ZINC001205503516 1133584046 /nfs/dbraw/zinc/58/40/46/1133584046.db2.gz ATABXSMTJCEMPM-INIZCTEOSA-N 1 0 277.408 3.517 20 10 CHCDRO CCC[C@@H]([NH2+]Cc1ccc(OC)cc1O)[C@H]1CC1(C)C ZINC001205517484 1133585069 /nfs/dbraw/zinc/58/50/69/1133585069.db2.gz QYWAUFVBWGGTCP-HUUCEWRRSA-N 1 0 277.408 3.705 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H]1CCc2ccccc2C1 ZINC001205656343 1133599822 /nfs/dbraw/zinc/59/98/22/1133599822.db2.gz OQPMTFQHKKPPQZ-HXUWFJFHSA-N 1 0 294.442 3.919 20 10 CHCDRO Oc1cc(Cl)ccc1C[NH2+]C[C@H]1CCC2(CCCC2)O1 ZINC001206490346 1133709355 /nfs/dbraw/zinc/70/93/55/1133709355.db2.gz MAJIVXBXKSRAAS-CQSZACIVSA-N 1 0 295.810 3.627 20 10 CHCDRO CCc1cccc(C[NH2+]Cc2cccc3[nH]ccc32)c1O ZINC001207271131 1133785990 /nfs/dbraw/zinc/78/59/90/1133785990.db2.gz SDRHGQYTQYACCI-UHFFFAOYSA-N 1 0 280.371 3.726 20 10 CHCDRO Oc1cc(Cl)ccc1CNc1ccc2c([nH+]1)CCCC2 ZINC001207449301 1133803104 /nfs/dbraw/zinc/80/31/04/1133803104.db2.gz VNYCZVLKIBTJKD-UHFFFAOYSA-N 1 0 288.778 3.932 20 10 CHCDRO Oc1cc(Cl)ccc1C[NH2+]C[C@H]1CCCC2(CCC2)O1 ZINC001207700922 1133839454 /nfs/dbraw/zinc/83/94/54/1133839454.db2.gz VQWMMRUBCIHDIM-CQSZACIVSA-N 1 0 295.810 3.627 20 10 CHCDRO CSCC[N@H+](C)Cc1ccc(-n2c(C)ccc2C)cc1 ZINC001209520163 1134035146 /nfs/dbraw/zinc/03/51/46/1134035146.db2.gz PDVLGAFCFRATCC-UHFFFAOYSA-N 1 0 288.460 3.889 20 10 CHCDRO CC[C@H](C[NH2+]Cc1cccc(C)c1O)CC(F)(F)F ZINC000402550507 1134659768 /nfs/dbraw/zinc/65/97/68/1134659768.db2.gz DWGQNNYRDMNKPY-NSHDSACASA-N 1 0 275.314 3.769 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]Cc2cc(C)ns2)cc1 ZINC000404403890 1134945242 /nfs/dbraw/zinc/94/52/42/1134945242.db2.gz SXLYWIBUZCTXLB-UHFFFAOYSA-N 1 0 289.448 3.588 20 10 CHCDRO CC(C)C[C@H](Oc1ccc(N2CC[NH2+]CC2)cc1)C(C)C ZINC001218296388 1135081729 /nfs/dbraw/zinc/08/17/29/1135081729.db2.gz KIACSZYESRLRTD-SFHVURJKSA-N 1 0 290.451 3.546 20 10 CHCDRO Cc1ccoc1C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC000312869628 1135135618 /nfs/dbraw/zinc/13/56/18/1135135618.db2.gz UAMXUMWBHZQOBI-CHWSQXEVSA-N 1 0 271.360 3.940 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@@H](C)c1cccnc1 ZINC000020127811 171013417 /nfs/dbraw/zinc/01/34/17/171013417.db2.gz CURACHQIEXDXDQ-IPYPFGDCSA-N 1 0 282.387 3.995 20 10 CHCDRO Cc1cccc(C[NH2+][C@H](C)c2ccc(C)cc2O)c1 ZINC000020134476 171022799 /nfs/dbraw/zinc/02/27/99/171022799.db2.gz JHDGWGJQZPELAU-CQSZACIVSA-N 1 0 255.361 3.860 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]C[C@@H](C)c2ccccc2)c1 ZINC000020137293 171024479 /nfs/dbraw/zinc/02/44/79/171024479.db2.gz MEQXPZUOCXBGOY-ZIAGYGMSSA-N 1 0 285.387 3.855 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2)o1 ZINC000020146069 171032104 /nfs/dbraw/zinc/03/21/04/171032104.db2.gz QFGZJVFXQLZGNI-CYBMUJFWSA-N 1 0 258.365 3.505 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2cccc(F)c2)c1 ZINC000020147927 171035268 /nfs/dbraw/zinc/03/52/68/171035268.db2.gz VAZVUEIAJBPOMY-RYUDHWBXSA-N 1 0 289.350 3.952 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CCCc3occc32)cc1C ZINC000035273643 172094053 /nfs/dbraw/zinc/09/40/53/172094053.db2.gz IPWYTIMOYAWVIB-OAHLLOKOSA-N 1 0 271.360 3.764 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCc2ccc(F)cc2)c1 ZINC000035628529 172307271 /nfs/dbraw/zinc/30/72/71/172307271.db2.gz MNGWXVGCUIVBEY-CYBMUJFWSA-N 1 0 273.351 3.733 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccsc1)c1ccccc1O ZINC000042599322 174815695 /nfs/dbraw/zinc/81/56/95/174815695.db2.gz NAKOISBQXBBCCT-AWEZNQCLSA-N 1 0 261.390 3.737 20 10 CHCDRO CS[C@H](C)C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000128002160 260370791 /nfs/dbraw/zinc/37/07/91/260370791.db2.gz JYOYJKAZYHEAQP-CQSZACIVSA-N 1 0 278.465 3.518 20 10 CHCDRO CC[C@](C)([NH2+]Cc1cc(C)ccc1O)c1nccs1 ZINC000152628723 261066741 /nfs/dbraw/zinc/06/67/41/261066741.db2.gz VQLDTDKGGLSZBS-HNNXBMFYSA-N 1 0 276.405 3.572 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@H](O)c2ccccc2)cc1 ZINC000153788599 261083003 /nfs/dbraw/zinc/08/30/03/261083003.db2.gz FBMGRYPMHICJNA-KXBFYZLASA-N 1 0 298.430 3.527 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(COC)cc1)c1ccccc1O ZINC000155013611 261097307 /nfs/dbraw/zinc/09/73/07/261097307.db2.gz QUPKTXQZFKHJEG-QGZVFWFLSA-N 1 0 285.387 3.780 20 10 CHCDRO CC[C@@H]([NH2+]CCc1nc(C)c(C)s1)c1ccccc1O ZINC000156387892 261122234 /nfs/dbraw/zinc/12/22/34/261122234.db2.gz DBTFDBGUTDEJNI-CQSZACIVSA-N 1 0 290.432 3.749 20 10 CHCDRO CCC[N@H+](Cc1ccccc1O)[C@@H](C)c1ccccn1 ZINC000157070996 261139196 /nfs/dbraw/zinc/13/91/96/261139196.db2.gz ZFYQPHCJCHZQOQ-AWEZNQCLSA-N 1 0 270.376 3.760 20 10 CHCDRO CCC[N@H+](Cc1ccccc1O)[C@H](C)c1ccccn1 ZINC000157071155 261139347 /nfs/dbraw/zinc/13/93/47/261139347.db2.gz ZFYQPHCJCHZQOQ-CQSZACIVSA-N 1 0 270.376 3.760 20 10 CHCDRO CCOCCCC[NH2+][C@@H](CC)c1ccc(N(C)C)cc1 ZINC000165118216 261365028 /nfs/dbraw/zinc/36/50/28/261365028.db2.gz CBHTYLJZJKGUPG-KRWDZBQOSA-N 1 0 278.440 3.610 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCCOc2ccccc21)c1ccccc1O ZINC000183475567 261976680 /nfs/dbraw/zinc/97/66/80/261976680.db2.gz FVTLYRJLIXAYPS-XJKSGUPXSA-N 1 0 283.371 3.957 20 10 CHCDRO COCCC(C)(C)C[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000183943166 262000814 /nfs/dbraw/zinc/00/08/14/262000814.db2.gz UIDQDUMEUHIWFL-NSHDSACASA-N 1 0 285.815 3.759 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)Cc2ccc(O)cc2)c1 ZINC000185351549 262051870 /nfs/dbraw/zinc/05/18/70/262051870.db2.gz OLWNIBXIKYWFBI-KBPBESRZSA-N 1 0 285.387 3.688 20 10 CHCDRO Cc1cnc([C@@H](C)C[NH2+][C@@H](C)c2ccc(C)cc2O)s1 ZINC000186777962 262109539 /nfs/dbraw/zinc/10/95/39/262109539.db2.gz QCKUMRXRJGJUBK-AAEUAGOBSA-N 1 0 290.432 3.920 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H](C)c2nccs2)c(O)c1 ZINC000186743687 262322858 /nfs/dbraw/zinc/32/28/58/262322858.db2.gz ASYWDNLUZGAPPW-RYUDHWBXSA-N 1 0 276.405 3.611 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1CCC(F)(F)C1)c1ccccc1O ZINC000281226274 263067322 /nfs/dbraw/zinc/06/73/22/263067322.db2.gz VJKPEQXCRUXUHS-WCQYABFASA-N 1 0 269.335 3.868 20 10 CHCDRO CC[C@H]([NH2+]Cc1nccs1)c1cccc(Cl)c1[O-] ZINC000287850744 263102863 /nfs/dbraw/zinc/10/28/63/263102863.db2.gz WTFDQVCHMLTSIJ-NSHDSACASA-N 1 0 282.796 3.743 20 10 CHCDRO COc1cccc(C[NH2+][C@@H]2C[C@@H](c3ccccc3)[C@@H]2C)c1O ZINC000370560410 267328202 /nfs/dbraw/zinc/32/82/02/267328202.db2.gz YODKBIVPKCSAAH-IAOVAPTHSA-N 1 0 297.398 3.683 20 10 CHCDRO CO[C@H]1CCC[N@H+](Cc2c(O)ccc3ccccc32)CC1 ZINC000370707306 267340587 /nfs/dbraw/zinc/34/05/87/267340587.db2.gz NTBMHHYPHYVTCH-HNNXBMFYSA-N 1 0 285.387 3.546 20 10 CHCDRO CC[C@H]([NH2+]Cc1cn2c(cccc2C)n1)c1ccccc1O ZINC000183331236 327819321 /nfs/dbraw/zinc/81/93/21/327819321.db2.gz HSYVKWRECFSECR-INIZCTEOSA-N 1 0 295.386 3.589 20 10 CHCDRO COC(C)(C)C[C@H](C)[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000185564301 327841028 /nfs/dbraw/zinc/84/10/28/327841028.db2.gz MQONWBZYBFYEOM-STQMWFEESA-N 1 0 265.397 3.555 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)C[C@H](O)c2ccccc2)c(O)c1 ZINC000185834292 327847101 /nfs/dbraw/zinc/84/71/01/327847101.db2.gz LPTKGYVGNBFFBR-MPGHIAIKSA-N 1 0 299.414 3.863 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H](C)c2nccs2)c(O)c1 ZINC000285128794 328247265 /nfs/dbraw/zinc/24/72/65/328247265.db2.gz LKPJSVROZRMMAZ-CHWSQXEVSA-N 1 0 290.432 3.920 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CC[C@@H](c2ccccc2)O1)c1ccccc1O ZINC000377796155 329029839 /nfs/dbraw/zinc/02/98/39/329029839.db2.gz LQAOJSDYFQZANJ-GMBSWORKSA-N 1 0 297.398 3.963 20 10 CHCDRO COc1cccc2c1OCC[C@@H]2[NH2+][C@@H](C)c1ccccc1O ZINC000378630017 329057110 /nfs/dbraw/zinc/05/71/10/329057110.db2.gz GDCKPYDHAMOMDM-WFASDCNBSA-N 1 0 299.370 3.575 20 10 CHCDRO Cc1cccc([C@H]2CCC[N@@H+]2Cc2cccc(C)c2O)n1 ZINC000180277717 329219469 /nfs/dbraw/zinc/21/94/69/329219469.db2.gz RFRPPWHLCCCKLE-QGZVFWFLSA-N 1 0 282.387 3.741 20 10 CHCDRO C[C@H]([NH2+]CC1CC=CC1)c1ccc(Br)cc1O ZINC000527951690 330294470 /nfs/dbraw/zinc/29/44/70/330294470.db2.gz ROGVNADGDGSTNU-JTQLQIEISA-N 1 0 296.208 3.772 20 10 CHCDRO C[C@H]([NH2+]CC[C@H]1CCCOC1)c1cc(Cl)ccc1O ZINC000527925209 330296496 /nfs/dbraw/zinc/29/64/96/330296496.db2.gz IJEZJULSIRSTED-NWDGAFQWSA-N 1 0 283.799 3.513 20 10 CHCDRO COc1ccc([C@H]([NH2+][C@H](C)c2ccccc2O)C2CC2)cn1 ZINC000528041627 330305802 /nfs/dbraw/zinc/30/58/02/330305802.db2.gz BTFQBOVMGILOFG-KZULUSFZSA-N 1 0 298.386 3.598 20 10 CHCDRO CCC[C@](C)(O)C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000230661816 333319995 /nfs/dbraw/zinc/31/99/95/333319995.db2.gz ZGBPQDYBECLOPU-UGSOOPFHSA-N 1 0 287.403 3.747 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+][C@@H](C)c2ncccc2F)c1O ZINC000529689372 333506007 /nfs/dbraw/zinc/50/60/07/333506007.db2.gz OEDFRSCJPZDWMG-JTQLQIEISA-N 1 0 294.757 3.739 20 10 CHCDRO C[C@H](CCCCO)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000296604037 334912938 /nfs/dbraw/zinc/91/29/38/334912938.db2.gz VVSZALOXXDCXEV-KGLIPLIRSA-N 1 0 287.403 3.747 20 10 CHCDRO CC(C)([NH2+]Cc1ccccc1O)c1cccc(F)c1 ZINC000076901936 519325558 /nfs/dbraw/zinc/32/55/58/519325558.db2.gz NXTUMDKHWOIIFC-UHFFFAOYSA-N 1 0 259.324 3.556 20 10 CHCDRO CCCc1nc(C)c(C[NH2+][C@@H](C)c2cc(C)ccc2O)o1 ZINC000293785278 521496902 /nfs/dbraw/zinc/49/69/02/521496902.db2.gz UDGBDXXCUGGDDF-LBPRGKRZSA-N 1 0 288.391 3.800 20 10 CHCDRO CCOC(C)(C)C[NH2+][C@H](CC)c1ccc(C)cc1O ZINC000280154096 521627483 /nfs/dbraw/zinc/62/74/83/521627483.db2.gz QIYGVOZDUHGIAP-CQSZACIVSA-N 1 0 265.397 3.556 20 10 CHCDRO CCc1ccccc1C[NH2+][C@H](C)c1ccccc1O ZINC000084200321 521843051 /nfs/dbraw/zinc/84/30/51/521843051.db2.gz NYLPLVSSOHSXPF-CYBMUJFWSA-N 1 0 255.361 3.805 20 10 CHCDRO COc1cc(C)cc(C[NH2+]Cc2c(O)cccc2Cl)c1 ZINC000127274702 522243566 /nfs/dbraw/zinc/24/35/66/522243566.db2.gz CURRAZCQHQMDNI-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO CC[C@H]([NH2+]CC[C@@H]1CCO[C@H](C)C1)c1ccc(C)cc1O ZINC000280288060 522599329 /nfs/dbraw/zinc/59/93/29/522599329.db2.gz ZATOHAIZAJOIRU-INMHGKMJSA-N 1 0 291.435 3.947 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1ccccn1)c1ccc(C)cc1O ZINC000280119786 522698151 /nfs/dbraw/zinc/69/81/51/522698151.db2.gz OGQHVEPLVUHBEE-ZFWWWQNUSA-N 1 0 270.376 3.898 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCO[C@H](C2CC2)C1)c1ccc(C)cc1O ZINC000280269172 522719765 /nfs/dbraw/zinc/71/97/65/522719765.db2.gz XTSJOZODXFZHLC-HFTRVMKXSA-N 1 0 289.419 3.699 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)[C@H](O)c1ccccc1)c1ccc(C)cc1O ZINC000290161515 522735707 /nfs/dbraw/zinc/73/57/07/522735707.db2.gz DETHPXILTXEBIK-LJHODMEESA-N 1 0 299.414 3.863 20 10 CHCDRO CC[C@@H]([NH2+]CC1CC(F)(F)C1)c1ccc(N(C)C)cc1 ZINC000293624202 522820353 /nfs/dbraw/zinc/82/03/53/522820353.db2.gz JVCFKZZQMBAAOE-OAHLLOKOSA-N 1 0 282.378 3.839 20 10 CHCDRO CC[C@@H]([NH2+]CC1([C@@H](C)CCO)CCC1)c1ccccc1O ZINC000274741696 522822082 /nfs/dbraw/zinc/82/20/82/522822082.db2.gz FKWHEGNLOLHTGY-GOEBONIOSA-N 1 0 291.435 3.622 20 10 CHCDRO CC[C@@H]([NH2+]CCCc1cccc(C)n1)c1ccccc1O ZINC000287542821 522831603 /nfs/dbraw/zinc/83/16/03/522831603.db2.gz PINAQCYABSLEGS-QGZVFWFLSA-N 1 0 284.403 3.769 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](CO)c1ccccc1)c1ccc(C)cc1O ZINC000280105871 522862199 /nfs/dbraw/zinc/86/21/99/522862199.db2.gz NIWWFYHUXOKBOL-SJLPKXTDSA-N 1 0 299.414 3.517 20 10 CHCDRO COCC1(CC[NH2+][C@@H](C)c2cc(Cl)ccc2O)CCC1 ZINC000293635004 522863282 /nfs/dbraw/zinc/86/32/82/522863282.db2.gz GUIVITJSOSBSIF-LBPRGKRZSA-N 1 0 297.826 3.903 20 10 CHCDRO CC[C@@H]([NH2+]Cc1nc(C2CC2)cs1)c1ccccc1O ZINC000130134382 522893470 /nfs/dbraw/zinc/89/34/70/522893470.db2.gz OSVNEBGBJTWXCM-CYBMUJFWSA-N 1 0 288.416 3.967 20 10 CHCDRO COCc1ccccc1C[NH2+][C@H](C)c1cc(F)ccc1O ZINC000094617648 523106636 /nfs/dbraw/zinc/10/66/36/523106636.db2.gz ZGPJFUJTYPXAHA-GFCCVEGCSA-N 1 0 289.350 3.529 20 10 CHCDRO C[N@H+](Cc1cc(F)ccc1O)C1CCC(F)(F)CC1 ZINC000290136495 523180286 /nfs/dbraw/zinc/18/02/86/523180286.db2.gz JYWOWPALNAJLOG-UHFFFAOYSA-N 1 0 273.298 3.541 20 10 CHCDRO CO[C@@H](C)[C@@H](C)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000289799631 523427597 /nfs/dbraw/zinc/42/75/97/523427597.db2.gz LYSYHVWGEXLREU-KGLIPLIRSA-N 1 0 285.387 3.572 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccccc2C)c1 ZINC000037718889 524773040 /nfs/dbraw/zinc/77/30/40/524773040.db2.gz VJZMJOUPTYVWNK-ZDUSSCGKSA-N 1 0 271.360 3.560 20 10 CHCDRO Cc1cc(C[NH2+][C@H](C)c2ccc(N3CCCCC3)cc2)on1 ZINC000125495070 524778568 /nfs/dbraw/zinc/77/85/68/524778568.db2.gz AXGVQLMRUDQUCM-OAHLLOKOSA-N 1 0 299.418 3.824 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(n1)CCCC2)c1ccccc1O ZINC000278170607 525531603 /nfs/dbraw/zinc/53/16/03/525531603.db2.gz AZYTYSOQZXUTKO-CYBMUJFWSA-N 1 0 282.387 3.517 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCc2c1cccc2O)c1ccc(N(C)C)cc1 ZINC000130333499 525582246 /nfs/dbraw/zinc/58/22/46/525582246.db2.gz YHOIYGFUROTYOK-SCLBCKFNSA-N 1 0 296.414 3.796 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCCc2occc21)c1cc(F)ccc1O ZINC000094617006 525639742 /nfs/dbraw/zinc/63/97/42/525639742.db2.gz SOIPIERAOFOPDQ-QMTHXVAHSA-N 1 0 275.323 3.853 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC2CC(F)(F)C2)c(O)c1C ZINC000293380657 525725544 /nfs/dbraw/zinc/72/55/44/525725544.db2.gz IHZBNTBPCVDQJH-LLVKDONJSA-N 1 0 269.335 3.705 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2COc3ccccc32)c(O)c1 ZINC000290459479 525730196 /nfs/dbraw/zinc/73/01/96/525730196.db2.gz WLVYRWRVRVUUMM-KGLIPLIRSA-N 1 0 283.371 3.527 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCO[C@H](C(C)C)C2)c(O)c1 ZINC000273503732 525938296 /nfs/dbraw/zinc/93/82/96/525938296.db2.gz QOVBBXDKOHDWGR-VBQJREDUSA-N 1 0 277.408 3.555 20 10 CHCDRO Cc1nc(C)c([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2)s1 ZINC000040445928 526746726 /nfs/dbraw/zinc/74/67/26/526746726.db2.gz JOXBAPZKIACMDF-LLVKDONJSA-N 1 0 289.448 3.677 20 10 CHCDRO C[C@H](c1ccc(F)cc1)[N@H+](C)Cc1ccccc1O ZINC000109772799 1125469452 /nfs/dbraw/zinc/46/94/52/1125469452.db2.gz AQNCPDDOYUYUNL-GFCCVEGCSA-N 1 0 259.324 3.724 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@](C)(O)CCC(C)C)c1 ZINC000185527799 1117838575 /nfs/dbraw/zinc/83/85/75/1117838575.db2.gz MCJPFXYVFMTXDH-PBHICJAKSA-N 1 0 279.424 3.538 20 10 CHCDRO C[C@H]1[C@@H](C)[N@@H+](Cc2c(O)cccc2Br)C[C@H]1C ZINC000707138832 1118642808 /nfs/dbraw/zinc/64/28/08/1118642808.db2.gz IDDACCIGBWYJTL-GMTAPVOTSA-N 1 0 298.224 3.631 20 10 CHCDRO Cc1ccc2c(cccc2N(C)c2ccc(N)cc2)n1 ZINC001212798808 1125494538 /nfs/dbraw/zinc/49/45/38/1125494538.db2.gz TXKKKDSORSDQPX-UHFFFAOYSA-N 1 0 263.344 3.893 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C[C@H]2CCCC2(C)C)cc1F ZINC001178783472 1121814941 /nfs/dbraw/zinc/81/49/41/1121814941.db2.gz RCJVZLDQCVMOMG-CQSZACIVSA-N 1 0 278.415 3.808 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)c(C)c1)[C@H]1CC1(C)C ZINC001195280416 1122860244 /nfs/dbraw/zinc/86/02/44/1122860244.db2.gz STTLZWWPFQRBIC-CVEARBPZSA-N 1 0 274.452 3.975 20 10 CHCDRO C[C@@H]([NH2+]CC[C@]1(C)CC1(F)F)c1cc(F)ccc1O ZINC000850537673 1123287690 /nfs/dbraw/zinc/28/76/90/1123287690.db2.gz WYNBJRCTVCRKBD-NOZJJQNGSA-N 1 0 273.298 3.617 20 10 CHCDRO C[C@H]1C[C@H]([NH2+]CCC(C)(C)F)c2c1c(F)ccc2O ZINC000850532287 1123285988 /nfs/dbraw/zinc/28/59/88/1123285988.db2.gz SRMHLLXRFWTJMA-ONGXEEELSA-N 1 0 269.335 3.807 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@H]2CCCSC2)cc1Cl ZINC000825940288 1125019555 /nfs/dbraw/zinc/01/95/55/1125019555.db2.gz RTYVIBKWWIZLEZ-LLVKDONJSA-N 1 0 285.840 3.587 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@H]2CC[C@H](C)O2)c1O ZINC000834913935 1131733076 /nfs/dbraw/zinc/73/30/76/1131733076.db2.gz JNIAMEKCYDCKGT-GMXVVIOVSA-N 1 0 283.799 3.572 20 10 CHCDRO Cc1cc(O)c(C[NH+]2CC(C)(C)OC(C)(C)C2)cc1Cl ZINC001231870252 1132383787 /nfs/dbraw/zinc/38/37/87/1132383787.db2.gz PXUIGHMOJFPVBY-UHFFFAOYSA-N 1 0 297.826 3.743 20 10 CHCDRO Cc1cc(O)c(C[NH+]2C[C@H]3CCC[C@@H]3C2)cc1Cl ZINC001231869258 1132384217 /nfs/dbraw/zinc/38/42/17/1132384217.db2.gz NVEWQFIJRXTFTA-VXGBXAGGSA-N 1 0 265.784 3.586 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCCc3ccccc3C2)c1 ZINC000133961062 1125514721 /nfs/dbraw/zinc/51/47/21/1125514721.db2.gz LFDMPUSBCDVBID-UHFFFAOYSA-N 1 0 267.372 3.649 20 10 CHCDRO CC1CCN(c2ccc(C[NH2+]Cc3cccn3C)cc2)CC1 ZINC000119150761 1125528935 /nfs/dbraw/zinc/52/89/35/1125528935.db2.gz LOCXQMYJUCZSRZ-UHFFFAOYSA-N 1 0 297.446 3.551 20 10 CHCDRO CCCCOc1ccc(C[NH2+]Cc2ccccc2O)cc1 ZINC000134236924 1125546322 /nfs/dbraw/zinc/54/63/22/1125546322.db2.gz LZUXWHKLVUAODA-UHFFFAOYSA-N 1 0 285.387 3.861 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CC[C@H](C(F)(F)F)C2(CCC2)C1 ZINC000282917395 1125554484 /nfs/dbraw/zinc/55/44/84/1125554484.db2.gz DVNJSGASJPVSSG-AWEZNQCLSA-N 1 0 299.336 3.947 20 10 CHCDRO C[C@@H](Cc1ccco1)[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841743615 1125568286 /nfs/dbraw/zinc/56/82/86/1125568286.db2.gz IRSLPNZIVHZYNZ-QWRGUYRKSA-N 1 0 279.767 3.920 20 10 CHCDRO CCn1ccnc1[C@@H](C)[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841756755 1125597024 /nfs/dbraw/zinc/59/70/24/1125597024.db2.gz JXWMBCWPLPBNOC-WDEREUQCSA-N 1 0 293.798 3.674 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]Cc2cscc2Cl)c1 ZINC000886199279 1125661452 /nfs/dbraw/zinc/66/14/52/1125661452.db2.gz QIWJDHXOVWMDKF-UHFFFAOYSA-N 1 0 297.807 3.796 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]Cc2cscc2Cl)c1O ZINC000886657904 1125703975 /nfs/dbraw/zinc/70/39/75/1125703975.db2.gz IAPXLWXOKGVLAQ-SECBINFHSA-N 1 0 297.807 3.967 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CC3(CCC3)CO2)c(O)c1C ZINC000886701333 1125709894 /nfs/dbraw/zinc/70/98/94/1125709894.db2.gz NWXLSVGBLBADDP-CABCVRRESA-N 1 0 289.419 3.619 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CC3(CCC3)CO2)c(O)c1C ZINC000886701334 1125710612 /nfs/dbraw/zinc/71/06/12/1125710612.db2.gz NWXLSVGBLBADDP-GJZGRUSLSA-N 1 0 289.419 3.619 20 10 CHCDRO CC[C@H]([NH2+]CC1(CCOC)CC1)c1ccc(N(C)C)cc1 ZINC000090536309 1125742259 /nfs/dbraw/zinc/74/22/59/1125742259.db2.gz PSRGPROTCIGSHI-KRWDZBQOSA-N 1 0 290.451 3.610 20 10 CHCDRO CC[C@@H]([NH2+]CCSCC(C)C)c1ccccc1O ZINC000397388033 1130216654 /nfs/dbraw/zinc/21/66/54/1130216654.db2.gz IQSJLGFYKLJFOA-CQSZACIVSA-N 1 0 267.438 3.822 20 10 CHCDRO Cc1cccc(C[NH2+][C@H](C)c2c(F)cccc2F)c1O ZINC000158112872 1126746787 /nfs/dbraw/zinc/74/67/87/1126746787.db2.gz PCHBXVQXMWJIBM-LLVKDONJSA-N 1 0 277.314 3.830 20 10 CHCDRO CC1([NH2+]Cc2ccc(N3CCCCC3)cc2)CCC1 ZINC000159920339 1126758790 /nfs/dbraw/zinc/75/87/90/1126758790.db2.gz SQXOOXXAEVYIAN-UHFFFAOYSA-N 1 0 258.409 3.709 20 10 CHCDRO C[C@@H]1CCC[N@H+](Cc2cccc(Br)c2[O-])[C@@H]1C ZINC000133713052 1126787262 /nfs/dbraw/zinc/78/72/62/1126787262.db2.gz BZRFDNOIEJTVHA-GHMZBOCLSA-N 1 0 298.224 3.775 20 10 CHCDRO CC(C)CCOC1CC[NH+](Cc2cc(F)ccc2O)CC1 ZINC000179944615 1126836747 /nfs/dbraw/zinc/83/67/47/1126836747.db2.gz MAPPQUNNUAMMMD-UHFFFAOYSA-N 1 0 295.398 3.558 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]C1(c2nccs2)CCCC1 ZINC000180740947 1126848227 /nfs/dbraw/zinc/84/82/27/1126848227.db2.gz UDJQMISOUOUSQQ-UHFFFAOYSA-N 1 0 292.379 3.547 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](C)[C@@H](C)c2ccccn2)cc1C ZINC000182067355 1126865479 /nfs/dbraw/zinc/86/54/79/1126865479.db2.gz AWKKSQODNOIXKL-AWEZNQCLSA-N 1 0 270.376 3.597 20 10 CHCDRO CC[C@](C)([NH2+]Cc1cccc(C)c1O)c1nc(C)cs1 ZINC000182226524 1126868854 /nfs/dbraw/zinc/86/88/54/1126868854.db2.gz UHERIJQHGVQSNB-INIZCTEOSA-N 1 0 290.432 3.881 20 10 CHCDRO C[C@H]([NH2+][C@@H](c1ccccc1)[C@@H]1CCCO1)c1ccccc1O ZINC000183467287 1126887476 /nfs/dbraw/zinc/88/74/76/1126887476.db2.gz WAWHYULJGQOWFP-JVPBZIDWSA-N 1 0 297.398 3.963 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCOc2ccccc21)c1ccccc1O ZINC000183504745 1126887494 /nfs/dbraw/zinc/88/74/94/1126887494.db2.gz NJDYZEUBTUQLHF-UONOGXRCSA-N 1 0 283.371 3.609 20 10 CHCDRO C[C@@H](C[C@@H](O)c1ccccc1)[NH2+][C@@H](C)c1ccccc1O ZINC000183587334 1126889631 /nfs/dbraw/zinc/88/96/31/1126889631.db2.gz FQERAZBIWBLTRS-SUNYJGFJSA-N 1 0 285.387 3.555 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](C)[C@H](C)c2ccncc2)cc1C ZINC000183705542 1126890913 /nfs/dbraw/zinc/89/09/13/1126890913.db2.gz NIDKJNXLXNNGLX-CQSZACIVSA-N 1 0 270.376 3.597 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1C[C@@H](C)O[C@@H](C)C1)c1ccc(N(C)C)cc1 ZINC000245584216 1129213063 /nfs/dbraw/zinc/21/30/63/1129213063.db2.gz IQCVLLGJQGYALP-CXHZTBPHSA-N 1 0 290.451 3.749 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCSC1)c1ccc(N2CCCCC2)cc1 ZINC000271422919 1127079373 /nfs/dbraw/zinc/07/93/73/1127079373.db2.gz ASNQFTSPWVRJPX-GOEBONIOSA-N 1 0 290.476 3.833 20 10 CHCDRO Oc1ccc(F)c(Cl)c1C[NH+]1CCCCCCC1 ZINC001237126479 1131055686 /nfs/dbraw/zinc/05/56/86/1131055686.db2.gz LQUBUUQRRCFOAK-UHFFFAOYSA-N 1 0 271.763 3.951 20 10 CHCDRO Oc1ccc(F)c(Cl)c1C[N@@H+]1CCC[C@H](F)CC1 ZINC001237121380 1131055194 /nfs/dbraw/zinc/05/51/94/1131055194.db2.gz LUQZVDLYMNWUKM-VIFPVBQESA-N 1 0 275.726 3.509 20 10 CHCDRO CC[C@@H](CSC)[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000164073880 1127152287 /nfs/dbraw/zinc/15/22/87/1127152287.db2.gz DOLVABUXNKXONV-OCCSQVGLSA-N 1 0 266.454 3.545 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2cccc(Cl)c2[O-])C[C@@H]1C ZINC000164383100 1127161698 /nfs/dbraw/zinc/16/16/98/1127161698.db2.gz FCWFAEUQTAHYHO-MNOVXSKESA-N 1 0 253.773 3.524 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2CCC[C@](C)(F)C2)c1O ZINC001237681811 1131127409 /nfs/dbraw/zinc/12/74/09/1131127409.db2.gz SXMWVBGWTFZOLS-AWEZNQCLSA-N 1 0 271.763 3.678 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CCCc2ccccn2)c(O)c1 ZINC000285321100 1127222589 /nfs/dbraw/zinc/22/25/89/1127222589.db2.gz TWHSYARORIWOQF-OAHLLOKOSA-N 1 0 284.403 3.687 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2ccccc2N(C)C)c(O)c1 ZINC000285402775 1127225767 /nfs/dbraw/zinc/22/57/67/1127225767.db2.gz XHSGOAXOJYQJSL-HNNXBMFYSA-N 1 0 298.430 3.926 20 10 CHCDRO C[C@@]1(F)CCC[N@H+](Cc2cc(F)c(Cl)cc2[O-])CC1 ZINC001237935064 1131153697 /nfs/dbraw/zinc/15/36/97/1131153697.db2.gz PPMQWQPFTKOORI-CQSZACIVSA-N 1 0 289.753 3.899 20 10 CHCDRO C[C@@H]1C[C@@H](C)CC[N@@H+]1Cc1cc(F)c(Cl)cc1[O-] ZINC001237936590 1131153969 /nfs/dbraw/zinc/15/39/69/1131153969.db2.gz KPBCSRGMOGNYDQ-VHSXEESVSA-N 1 0 271.763 3.805 20 10 CHCDRO CC[C@@H]([NH2+]CCCC(C)(C)COC)c1ccccc1O ZINC000287043155 1127284289 /nfs/dbraw/zinc/28/42/89/1127284289.db2.gz MJXBOFRPECBLIA-OAHLLOKOSA-N 1 0 279.424 3.886 20 10 CHCDRO COCC(C)(C)CCC[NH2+][C@H](C)c1cc(OC)ccc1O ZINC000287148952 1127293213 /nfs/dbraw/zinc/29/32/13/1127293213.db2.gz SPTGCLYXMRNKOF-CYBMUJFWSA-N 1 0 295.423 3.504 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2C[C@H]3C[C@H]3C2)c1O ZINC000818360196 1131211502 /nfs/dbraw/zinc/21/15/02/1131211502.db2.gz OBEPEEFRTUQLJW-KQXIARHKSA-N 1 0 265.784 3.803 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCCCS1)c1ccc(N(C)C)cc1 ZINC000158084396 1127437007 /nfs/dbraw/zinc/43/70/07/1127437007.db2.gz OKERBGOTDFEXOR-CJNGLKHVSA-N 1 0 278.465 3.689 20 10 CHCDRO Cc1cccc(C[NH2+][C@H](c2ccccc2)C2CC2)c1O ZINC000158090638 1127437345 /nfs/dbraw/zinc/43/73/45/1127437345.db2.gz OIRFFHPAOIWZJQ-QGZVFWFLSA-N 1 0 267.372 3.942 20 10 CHCDRO COc1cc(Cl)cc(C[N@H+](C)Cc2ccsc2)c1O ZINC000761183457 1127507256 /nfs/dbraw/zinc/50/72/56/1127507256.db2.gz KMEZMKHWEYWSFM-UHFFFAOYSA-N 1 0 297.807 3.748 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2cccc(O)c2)c(O)c1 ZINC000293722894 1127515552 /nfs/dbraw/zinc/51/55/52/1127515552.db2.gz MOIIPOVGVSCWIH-ZDUSSCGKSA-N 1 0 271.360 3.565 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CCC[C@H]2C2CCC2)c1O ZINC000761195815 1127517947 /nfs/dbraw/zinc/51/79/47/1127517947.db2.gz OYZKPGXFHQCBIG-AWEZNQCLSA-N 1 0 295.810 3.819 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCc2cc(F)cc(F)c2)c(O)c1 ZINC000060717711 1127564987 /nfs/dbraw/zinc/56/49/87/1127564987.db2.gz FLJIBDQWGJTQMX-LBPRGKRZSA-N 1 0 291.341 3.872 20 10 CHCDRO COc1cc(Cl)cc(C[N@H+](CC(C)C)C(C)C)c1O ZINC000228629795 1127576212 /nfs/dbraw/zinc/57/62/12/1127576212.db2.gz ONQRJHHPJHYRKG-UHFFFAOYSA-N 1 0 285.815 3.921 20 10 CHCDRO COc1cc(Cl)cc(C[N@H+](C)[C@H](C)C(C)(C)C)c1O ZINC000228627022 1127576475 /nfs/dbraw/zinc/57/64/75/1127576475.db2.gz NTNZMYICGNEYAQ-SNVBAGLBSA-N 1 0 285.815 3.921 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CC[C@@H](C(C)C)C2)c1O ZINC000228667828 1127583209 /nfs/dbraw/zinc/58/32/09/1127583209.db2.gz NEYVAVZXSUWMFS-LLVKDONJSA-N 1 0 283.799 3.532 20 10 CHCDRO C[C@H](Cc1cccs1)[NH2+][C@H]1CCc2cccc(O)c21 ZINC000295974604 1129220725 /nfs/dbraw/zinc/22/07/25/1129220725.db2.gz MVIULIGRMYTHOM-RISCZKNCSA-N 1 0 273.401 3.662 20 10 CHCDRO C[C@H](CC(C)(C)O)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000295059326 1127617401 /nfs/dbraw/zinc/61/74/01/1127617401.db2.gz OCGXQXWBGLLTAJ-CQSZACIVSA-N 1 0 299.414 3.698 20 10 CHCDRO Oc1ccccc1C[NH2+]Cc1ccc(C(F)(F)F)cc1 ZINC000060942022 1127624751 /nfs/dbraw/zinc/62/47/51/1127624751.db2.gz KIJWKWNBVAOUNG-UHFFFAOYSA-N 1 0 281.277 3.701 20 10 CHCDRO C[C@H]([NH2+]Cc1cccc(C(F)(F)F)n1)c1ccccc1O ZINC000296256772 1127666977 /nfs/dbraw/zinc/66/69/77/1127666977.db2.gz DBXYBZSUZSRRBC-JTQLQIEISA-N 1 0 296.292 3.657 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@H]1CCOc3ccc(F)cc31)CC2 ZINC000296799831 1127683130 /nfs/dbraw/zinc/68/31/30/1127683130.db2.gz LJWYPCFBVSDCMC-LSDHHAIUSA-N 1 0 299.345 3.632 20 10 CHCDRO Cc1cccnc1CCC[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000296636604 1127679287 /nfs/dbraw/zinc/67/92/87/1127679287.db2.gz XTAQCNSJWNEKJX-ZDUSSCGKSA-N 1 0 288.366 3.518 20 10 CHCDRO CN(C)c1ccc(C[NH+]2CCC(c3ccccn3)CC2)cc1 ZINC000371412526 1127765556 /nfs/dbraw/zinc/76/55/56/1127765556.db2.gz VQMRYKPBHOGRJP-UHFFFAOYSA-N 1 0 295.430 3.527 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCS[C@@H]3CCCC[C@H]32)c1 ZINC000245755530 1129222336 /nfs/dbraw/zinc/22/23/36/1129222336.db2.gz ONDZUCMEOFNYOJ-GDBMZVCRSA-N 1 0 277.433 3.561 20 10 CHCDRO C[C@H](CCCO)C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000296577967 1129222517 /nfs/dbraw/zinc/22/25/17/1129222517.db2.gz UBTPESOIDBLCAL-ZIAGYGMSSA-N 1 0 287.403 3.605 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H](C)Cc2ccco2)cc1 ZINC000035254448 1127908479 /nfs/dbraw/zinc/90/84/79/1127908479.db2.gz BXGTUVFLYFLCMC-OAHLLOKOSA-N 1 0 286.419 3.847 20 10 CHCDRO CCCCCC[NH2+][C@H](C)c1ccc(N2CCOCC2)cc1 ZINC000151867399 1128080555 /nfs/dbraw/zinc/08/05/55/1128080555.db2.gz WMUGKUZPYRIVGR-MRXNPFEDSA-N 1 0 290.451 3.754 20 10 CHCDRO CC(C)OC1CCC([NH2+]Cc2c(O)cccc2Cl)CC1 ZINC000130197572 1128102643 /nfs/dbraw/zinc/10/26/43/1128102643.db2.gz KEERNDJBEHZGLE-UHFFFAOYSA-N 1 0 297.826 3.871 20 10 CHCDRO C[C@@H]1CCC[N@H+](Cc2cc(Br)ccc2O)[C@H]1C ZINC000252151797 1128115612 /nfs/dbraw/zinc/11/56/12/1128115612.db2.gz MPKSUGGPLSTEDZ-MNOVXSKESA-N 1 0 298.224 3.775 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)C1CC1)c1cc(Br)ccc1O ZINC000134911256 1128115644 /nfs/dbraw/zinc/11/56/44/1128115644.db2.gz ODLPJSHVCBVSKT-DTWKUNHWSA-N 1 0 284.197 3.604 20 10 CHCDRO Cc1noc(C)c1[C@@H](C)[NH2+]CCCSc1nccs1 ZINC000925092303 1128121411 /nfs/dbraw/zinc/12/14/11/1128121411.db2.gz BGHGQDJCSVZIJA-SECBINFHSA-N 1 0 297.449 3.581 20 10 CHCDRO CCCC(CCC)[N@@H+]1CCCc2cc(O)c(O)cc2C1 ZINC001257341405 1128252931 /nfs/dbraw/zinc/25/29/31/1128252931.db2.gz ZUANRQAULJARGZ-UHFFFAOYSA-N 1 0 277.408 3.815 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1C[C@H]1C(F)(F)F)c1cc(Cl)ccc1O ZINC000926951917 1128205811 /nfs/dbraw/zinc/20/58/11/1128205811.db2.gz ZUYISKOKWGWNAO-VHSKPIJISA-N 1 0 293.716 3.895 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1C[C@H]1C(F)(F)F)c1cc(Cl)ccc1O ZINC000926951916 1128206057 /nfs/dbraw/zinc/20/60/57/1128206057.db2.gz ZUYISKOKWGWNAO-DKCNOQQISA-N 1 0 293.716 3.895 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2C[C@H]2C(F)(F)F)c(O)c1C ZINC000926951314 1128206079 /nfs/dbraw/zinc/20/60/79/1128206079.db2.gz PQNRGUMUYSZDOU-NTZNESFSSA-N 1 0 287.325 3.858 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCS[C@H](C)C1)c1cc(Cl)ccc1O ZINC000927028457 1128208701 /nfs/dbraw/zinc/20/87/01/1128208701.db2.gz ADDHDUFTMDCXMQ-FOGDFJRCSA-N 1 0 285.840 3.980 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCCc2cccnc21)c1ccccc1O ZINC000927059713 1128212461 /nfs/dbraw/zinc/21/24/61/1128212461.db2.gz LNEUGJUJQYVZDS-IUODEOHRSA-N 1 0 268.360 3.515 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@@H]2CCCc3cccnc32)c1O ZINC000927062999 1128213560 /nfs/dbraw/zinc/21/35/60/1128213560.db2.gz RJIQJWBQMUHIDR-IUODEOHRSA-N 1 0 298.386 3.524 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCCc3cccnc32)c1 ZINC000927063244 1128213649 /nfs/dbraw/zinc/21/36/49/1128213649.db2.gz ASPFPMVBLCABBQ-BBRMVZONSA-N 1 0 282.387 3.824 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H](C2CC2)[C@H]2CCCOC2)c(O)c1 ZINC000927069474 1128215780 /nfs/dbraw/zinc/21/57/80/1128215780.db2.gz MZIWWHFHWUWBIW-DHSIGJKJSA-N 1 0 289.419 3.556 20 10 CHCDRO CCc1onc(C)c1C[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000927133370 1128221466 /nfs/dbraw/zinc/22/14/66/1128221466.db2.gz CITJDOIEFNMLMQ-VIFPVBQESA-N 1 0 294.782 3.755 20 10 CHCDRO C[C@@H](Cc1cccc(F)c1)[N@@H+]1CCc2cccc(O)c2C1 ZINC001168497272 1128329892 /nfs/dbraw/zinc/32/98/92/1128329892.db2.gz NGUAWEHJEURNIZ-ZDUSSCGKSA-N 1 0 285.362 3.521 20 10 CHCDRO C[C@H](Cc1cccc(F)c1)[N@@H+]1CCc2cccc(O)c2C1 ZINC001168497265 1128329938 /nfs/dbraw/zinc/32/99/38/1128329938.db2.gz NGUAWEHJEURNIZ-CYBMUJFWSA-N 1 0 285.362 3.521 20 10 CHCDRO C[C@H]([NH2+]CCN1CCCCC1)c1ccc2ccccc2c1O ZINC000193684322 1128330518 /nfs/dbraw/zinc/33/05/18/1128330518.db2.gz WMTOJLIAQLDWIW-HNNXBMFYSA-N 1 0 298.430 3.682 20 10 CHCDRO COc1cc(C[NH+]2CCCCC2)c(O)c(C(C)(C)C)c1 ZINC000915790261 1128337930 /nfs/dbraw/zinc/33/79/30/1128337930.db2.gz VPKONHYVHRUJGH-UHFFFAOYSA-N 1 0 277.408 3.684 20 10 CHCDRO COc1cc(C[N@@H+]2CCC[C@H](C)C2)c(O)c(C(C)(C)C)c1 ZINC000915790404 1128338688 /nfs/dbraw/zinc/33/86/88/1128338688.db2.gz ICTVYRPCRYBFBL-ZDUSSCGKSA-N 1 0 291.435 3.930 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@H+](C)Cc2ccccc2C)c1 ZINC000915810551 1128340323 /nfs/dbraw/zinc/34/03/23/1128340323.db2.gz AIZWBZUYGQZRIZ-UHFFFAOYSA-N 1 0 269.388 3.949 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)Cc2cccs2)cc1C ZINC000915809686 1128340472 /nfs/dbraw/zinc/34/04/72/1128340472.db2.gz ZXAHJZACOGEVCR-UHFFFAOYSA-N 1 0 261.390 3.703 20 10 CHCDRO CCc1ccc(C[N@H+](C)Cc2cc(C)cc(OC)c2O)cc1 ZINC000915807303 1128340769 /nfs/dbraw/zinc/34/07/69/1128340769.db2.gz DCHCRUKVCAGCIS-UHFFFAOYSA-N 1 0 299.414 3.904 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCOC1)c1ccc(N2CCCCCC2)cc1 ZINC000090774533 1128393904 /nfs/dbraw/zinc/39/39/04/1128393904.db2.gz MOSHDOYEOGRCDG-DOTOQJQBSA-N 1 0 288.435 3.507 20 10 CHCDRO COc1cccc(O)c1C[N@H+](C)Cc1cc(C)ccc1C ZINC000763378890 1128427044 /nfs/dbraw/zinc/42/70/44/1128427044.db2.gz GEHPFRVWUBSUKC-UHFFFAOYSA-N 1 0 285.387 3.650 20 10 CHCDRO COc1ccc(C[NH2+][C@H](c2ccncc2)C2CC2)cc1C ZINC000934701451 1128467411 /nfs/dbraw/zinc/46/74/11/1128467411.db2.gz POMSHWUSUFJLLF-SFHVURJKSA-N 1 0 282.387 3.640 20 10 CHCDRO c1ccc2c(c1)CCC[C@@H]2C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000917393710 1128497236 /nfs/dbraw/zinc/49/72/36/1128497236.db2.gz JWAXTGSSJMPCFB-GOSISDBHSA-N 1 0 293.410 3.831 20 10 CHCDRO COc1cccc(C[N@H+](Cc2ccccc2)C(C)C)c1O ZINC000154666487 1128539363 /nfs/dbraw/zinc/53/93/63/1128539363.db2.gz SXDFFACNTJLVJU-UHFFFAOYSA-N 1 0 285.387 3.811 20 10 CHCDRO CCOc1cccc(C[NH2+]C[C@@H]2CCCC[C@H]2C)c1O ZINC000042857217 1128587640 /nfs/dbraw/zinc/58/76/40/1128587640.db2.gz PYMOMRGWASGQAJ-KGLIPLIRSA-N 1 0 277.408 3.707 20 10 CHCDRO CCCC[C@H](COC)[NH2+][C@H](CC)c1ccccc1O ZINC000155902564 1128618676 /nfs/dbraw/zinc/61/86/76/1128618676.db2.gz QGRVAMHXXVSULJ-UKRRQHHQSA-N 1 0 265.397 3.638 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CCO)C1CCCCC1)c1ccccc1O ZINC000156410926 1128635891 /nfs/dbraw/zinc/63/58/91/1128635891.db2.gz YBIXAVSRZXDXAC-SJORKVTESA-N 1 0 291.435 3.764 20 10 CHCDRO C[C@@H]1c2ccsc2CC[N@H+]1Cc1cc(F)ccc1O ZINC000778995537 1128674860 /nfs/dbraw/zinc/67/48/60/1128674860.db2.gz ZBNLVSWCSSGRQI-SNVBAGLBSA-N 1 0 277.364 3.712 20 10 CHCDRO CC1(C)C[N@H+](Cc2ccccc2O)[C@H]1c1ccccc1 ZINC000778998904 1128675406 /nfs/dbraw/zinc/67/54/06/1128675406.db2.gz FEKWABHUIMDREI-KRWDZBQOSA-N 1 0 267.372 3.975 20 10 CHCDRO Oc1ccc(F)cc1C[N@H+](Cc1ccccc1F)C1CC1 ZINC000778995150 1128675822 /nfs/dbraw/zinc/67/58/22/1128675822.db2.gz RAKFCAPRQYIPLX-UHFFFAOYSA-N 1 0 289.325 3.835 20 10 CHCDRO CC(C)(C)[C@@H]1CCC[N@@H+]1Cc1cc(F)ccc1O ZINC000779010359 1128677115 /nfs/dbraw/zinc/67/71/15/1128677115.db2.gz ULETZOWZSBQRCV-AWEZNQCLSA-N 1 0 251.345 3.542 20 10 CHCDRO Cc1cc(Br)cc([C@@H](C)[NH2+]C2CC(C)C2)c1O ZINC000779036711 1128697506 /nfs/dbraw/zinc/69/75/06/1128697506.db2.gz QLHQQJNWVIFVCA-KRBLXSNTSA-N 1 0 298.224 3.912 20 10 CHCDRO CC(C)C[C@@H](C)C[C@@H](C)[NH2+]CCc1ccc(O)c(O)c1 ZINC001258056572 1128714452 /nfs/dbraw/zinc/71/44/52/1128714452.db2.gz QBDFUECEUALOFH-ZIAGYGMSSA-N 1 0 279.424 3.691 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H]2CCC(C)(C)O2)cc1 ZINC000779080195 1128723912 /nfs/dbraw/zinc/72/39/12/1128723912.db2.gz VBAQVCCTESSJIJ-YOEHRIQHSA-N 1 0 290.451 3.751 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCC[C@H]1CCO)c1cc(Cl)ccc1O ZINC000779089655 1128726762 /nfs/dbraw/zinc/72/67/62/1128726762.db2.gz VDXZVYGFVZWRIV-CQDKDKBSSA-N 1 0 297.826 3.637 20 10 CHCDRO COc1cc(C[N@H+](C2CC2)C2CCCC2)c(O)cc1C ZINC000159786909 1128728527 /nfs/dbraw/zinc/72/85/27/1128728527.db2.gz MCSPTKJAEVKOES-UHFFFAOYSA-N 1 0 275.392 3.616 20 10 CHCDRO CCS[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(N(C)C)cc1 ZINC000233847634 1128737282 /nfs/dbraw/zinc/73/72/82/1128737282.db2.gz GNJKVTOCQWEYEN-HZPDHXFCSA-N 1 0 278.465 3.516 20 10 CHCDRO C[C@@H]([NH2+]CCCNc1ccccc1)c1cc(F)ccc1O ZINC000185489598 1117830136 /nfs/dbraw/zinc/83/01/36/1117830136.db2.gz GNSUMTYSJDWQQL-CYBMUJFWSA-N 1 0 288.366 3.684 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1cc(OC)ccc1O)C1CCC1 ZINC000325046174 1117843767 /nfs/dbraw/zinc/84/37/67/1117843767.db2.gz NZGCRJSVGCZQQV-IAQYHMDHSA-N 1 0 263.381 3.630 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCOCc2ccccc2)c1 ZINC000185633055 1117860266 /nfs/dbraw/zinc/86/02/66/1117860266.db2.gz GIHFGBWIKFVDGM-HNNXBMFYSA-N 1 0 285.387 3.568 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCC(C)(C)CO1)c1ccc(N(C)C)cc1 ZINC001307695767 1117935551 /nfs/dbraw/zinc/93/55/51/1117935551.db2.gz PCKBIXMJNYPABP-WMLDXEAASA-N 1 0 290.451 3.608 20 10 CHCDRO CO[C@@H](C[NH2+][C@@H](C)c1cc(C)ccc1O)C1CCCC1 ZINC000692973476 1117938129 /nfs/dbraw/zinc/93/81/29/1117938129.db2.gz CAGUHXWXGDAEGL-GUYCJALGSA-N 1 0 277.408 3.556 20 10 CHCDRO C[N@@H+](Cc1c(O)cccc1Cl)CC1CCCC1 ZINC000211491369 1118063369 /nfs/dbraw/zinc/06/33/69/1118063369.db2.gz IPGREWFLIDHTBS-UHFFFAOYSA-N 1 0 253.773 3.668 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CC[C@H](C)F)cc1 ZINC000815646015 1118128084 /nfs/dbraw/zinc/12/80/84/1118128084.db2.gz XANBXTZKRGXFGP-STQMWFEESA-N 1 0 252.377 3.541 20 10 CHCDRO CO[C@H](C)C[NH2+][C@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000188123788 1128760409 /nfs/dbraw/zinc/76/04/09/1128760409.db2.gz CQNQKCDZIFTIAC-HZPDHXFCSA-N 1 0 290.451 3.753 20 10 CHCDRO C[C@@H](CC1CCC1)[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC000765476614 1118154260 /nfs/dbraw/zinc/15/42/60/1118154260.db2.gz YVLGRJGQUDWXCW-LBPRGKRZSA-N 1 0 264.388 3.560 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC2CCC(F)CC2)c(O)c1 ZINC000842928299 1118170327 /nfs/dbraw/zinc/17/03/27/1118170327.db2.gz JBDYRZAJMPYNOG-IYXRBSQSSA-N 1 0 265.372 3.880 20 10 CHCDRO c1cc2c(o1)CCC[C@@H]2[NH2+]Cc1ccc2c(c1)CCCO2 ZINC000921527876 1118171534 /nfs/dbraw/zinc/17/15/34/1118171534.db2.gz PIRKSYIWXLBBHH-INIZCTEOSA-N 1 0 283.371 3.772 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccc2c(c1)COC2 ZINC000765607977 1118181438 /nfs/dbraw/zinc/18/14/38/1118181438.db2.gz GCUHAFMTKLMDKN-CYBMUJFWSA-N 1 0 295.382 3.503 20 10 CHCDRO CS[C@@H](C)C[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000186156940 1118199452 /nfs/dbraw/zinc/19/94/52/1118199452.db2.gz IUHJRRNQKVEAJK-NWDGAFQWSA-N 1 0 279.449 3.673 20 10 CHCDRO COc1ccc([C@H](C)[NH2+]Cc2ccc3c(c2)CCCO3)cc1 ZINC000921621183 1118226545 /nfs/dbraw/zinc/22/65/45/1118226545.db2.gz LQPJTDLTMJZUBA-AWEZNQCLSA-N 1 0 297.398 3.871 20 10 CHCDRO CCC[C@H](C)[NH2+]Cc1ccc(OC)c(COCC)c1 ZINC001648824828 1118234748 /nfs/dbraw/zinc/23/47/48/1118234748.db2.gz QDSSJDLNJQOROG-ZDUSSCGKSA-N 1 0 265.397 3.510 20 10 CHCDRO C[C@H]([NH2+]Cc1cccc(OC(F)F)c1)c1ccccc1O ZINC000179888138 1128765060 /nfs/dbraw/zinc/76/50/60/1128765060.db2.gz NCXNSMFIFJVPPC-NSHDSACASA-N 1 0 293.313 3.844 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]CCCOc1ccccc1 ZINC000083551611 1118356688 /nfs/dbraw/zinc/35/66/88/1118356688.db2.gz WBGYLLOXUHOGSH-UHFFFAOYSA-N 1 0 291.778 3.604 20 10 CHCDRO C[C@H]([NH2+][C@@H]1COCC1(C)C)c1ccc2ccccc2c1O ZINC000313016790 1118525076 /nfs/dbraw/zinc/52/50/76/1118525076.db2.gz GZFGIPRPQVLJSI-BLLLJJGKSA-N 1 0 285.387 3.621 20 10 CHCDRO C[C@@H]([NH2+]CC1CCC(F)(F)CC1)c1ccccc1O ZINC000693335944 1118545219 /nfs/dbraw/zinc/54/52/19/1118545219.db2.gz REZYZKCLZQGZSX-LLVKDONJSA-N 1 0 269.335 3.868 20 10 CHCDRO CC[C@H]([NH2+]CC[C@H]1CCCCO1)c1ccc(N(C)C)cc1 ZINC000180255672 1128784606 /nfs/dbraw/zinc/78/46/06/1128784606.db2.gz SNDJBTSBLYVSLX-MSOLQXFVSA-N 1 0 290.451 3.753 20 10 CHCDRO CCCCCC[NH2+]Cc1c(O)cccc1Br ZINC000706875091 1118558776 /nfs/dbraw/zinc/55/87/76/1118558776.db2.gz NCVDMUKQEIOXTG-UHFFFAOYSA-N 1 0 286.213 3.825 20 10 CHCDRO COC1(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)CCCC1 ZINC000834813940 1118570550 /nfs/dbraw/zinc/57/05/50/1118570550.db2.gz BBJXGJXMWDYTAF-AWEZNQCLSA-N 1 0 277.408 3.619 20 10 CHCDRO CC[C@H](C)[C@@H](C[NH2+][C@@H](C)c1ccc(C)c(C)c1O)OC ZINC000834856010 1118586499 /nfs/dbraw/zinc/58/64/99/1118586499.db2.gz KDWVZWSNDBWKDN-HZUKXOBISA-N 1 0 279.424 3.721 20 10 CHCDRO C[C@H]1CCCC[C@H]1C[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000109935215 1118590775 /nfs/dbraw/zinc/59/07/75/1118590775.db2.gz NTBABMMAXOTFEX-YJBOKZPZSA-N 1 0 286.463 3.985 20 10 CHCDRO C[C@H]1CCSCC[N@@H+]1Cc1c(O)ccc2ccccc21 ZINC000189915048 1128787948 /nfs/dbraw/zinc/78/79/48/1128787948.db2.gz UGPIMMWAJUXHDC-ZDUSSCGKSA-N 1 0 287.428 3.873 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCOC(C)(C)C2)c(O)c1C ZINC000834910340 1118628170 /nfs/dbraw/zinc/62/81/70/1118628170.db2.gz OEFGBMQIGUOEHV-HUUCEWRRSA-N 1 0 291.435 3.865 20 10 CHCDRO CC[N@@H+](Cc1cccc(C)c1O)C[C@@H](O)c1ccc(C)cc1 ZINC000180419821 1128791060 /nfs/dbraw/zinc/79/10/60/1128791060.db2.gz ZBXDJISERTUCGE-GOSISDBHSA-N 1 0 299.414 3.565 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@@H+]2CC[C@H](c3ccco3)C2)c1 ZINC000754725995 1118646002 /nfs/dbraw/zinc/64/60/02/1118646002.db2.gz JKNJJWNXEHJQLQ-AWEZNQCLSA-N 1 0 271.360 3.592 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@@H+]2CC[C@@H]2c2ccccc2)c1 ZINC000754725989 1118646565 /nfs/dbraw/zinc/64/65/65/1118646565.db2.gz KAJIYEGUXOJXBV-QGZVFWFLSA-N 1 0 267.372 3.956 20 10 CHCDRO CC[C@@H]1CCCC[N@@H+]1Cc1c(O)cccc1Br ZINC000707145496 1118647494 /nfs/dbraw/zinc/64/74/94/1118647494.db2.gz GLXPAGVLPWBOCL-LLVKDONJSA-N 1 0 298.224 3.919 20 10 CHCDRO C[C@H]1CCC[C@H](C)[NH+]1Cc1c(O)cccc1Br ZINC000707147258 1118648047 /nfs/dbraw/zinc/64/80/47/1118648047.db2.gz WDBZUJBMAUEOFX-QWRGUYRKSA-N 1 0 298.224 3.918 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C(C)(C)c2cccc(F)c2)cc1 ZINC000076902024 1128792162 /nfs/dbraw/zinc/79/21/62/1128792162.db2.gz GIPRJRXBSRIVJP-UHFFFAOYSA-N 1 0 286.394 3.917 20 10 CHCDRO CC(C)(C)CC(C)(C)[NH2+]Cc1cc(F)ccc1O ZINC000083396566 1118728871 /nfs/dbraw/zinc/72/88/71/1118728871.db2.gz NYRJUNDBAKFAAT-UHFFFAOYSA-N 1 0 253.361 3.836 20 10 CHCDRO COc1cc(C[N@@H+]2C[C@H](C)[C@H]3CCCC[C@H]32)c(O)cc1C ZINC000782278913 1118741081 /nfs/dbraw/zinc/74/10/81/1118741081.db2.gz ZMMXCAZGJJSYTH-NUEKZKHPSA-N 1 0 289.419 3.720 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]C1(c2ccccc2)CCC1 ZINC000180545551 1128798201 /nfs/dbraw/zinc/79/82/01/1128798201.db2.gz HFCBBRDQKBTIPW-UHFFFAOYSA-N 1 0 271.335 3.700 20 10 CHCDRO CCSCC[C@H](C)[N@H+](C)Cc1cccc(C)c1O ZINC000180670734 1128801218 /nfs/dbraw/zinc/80/12/18/1128801218.db2.gz AZQPJDPTKOMXCR-ZDUSSCGKSA-N 1 0 267.438 3.664 20 10 CHCDRO COc1cccc(O)c1C[NH2+]CC(C)(C)C1=CCCC1 ZINC000835061050 1118837758 /nfs/dbraw/zinc/83/77/58/1118837758.db2.gz WHIQFKFWDJFVJX-UHFFFAOYSA-N 1 0 275.392 3.627 20 10 CHCDRO CCC(C)(C)OCC[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000308747713 1118855339 /nfs/dbraw/zinc/85/53/39/1118855339.db2.gz SHLYIKWEGHHWRP-ZDUSSCGKSA-N 1 0 265.397 3.556 20 10 CHCDRO CCOc1cccc(C[NH2+]C2(c3ccccc3)CC2)c1O ZINC000068980121 1128814617 /nfs/dbraw/zinc/81/46/17/1128814617.db2.gz UFJUGRRUDGCUSY-UHFFFAOYSA-N 1 0 283.371 3.570 20 10 CHCDRO CC[C@H](C)N(C)CC[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC000230660520 1119020842 /nfs/dbraw/zinc/02/08/42/1119020842.db2.gz AIDLNCRQKAJWOX-QLFBSQMISA-N 1 0 290.451 3.569 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCc3ccccc3C2)c1 ZINC000051630815 1119061871 /nfs/dbraw/zinc/06/18/71/1119061871.db2.gz DJDXTTSHSDXZLI-RHSMWYFYSA-N 1 0 281.399 3.909 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@@H]1CC=CCC1 ZINC000226512114 1119074901 /nfs/dbraw/zinc/07/49/01/1119074901.db2.gz CKTJWYOUHVQFLN-MGPQQGTHSA-N 1 0 257.377 3.947 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccsc1)c1ccc(N(C)C)cc1 ZINC000049153465 1119087319 /nfs/dbraw/zinc/08/73/19/1119087319.db2.gz VEIBPKMCDORIHT-CYBMUJFWSA-N 1 0 274.433 3.707 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)Cc2ccsc2)c1 ZINC000049154890 1119087398 /nfs/dbraw/zinc/08/73/98/1119087398.db2.gz WSSNLLDDFKOYDP-VXGBXAGGSA-N 1 0 291.416 3.744 20 10 CHCDRO CCOCC[N@H+](Cc1ccccc1O)[C@@H](C)c1ccccc1 ZINC000176673068 1119092197 /nfs/dbraw/zinc/09/21/97/1119092197.db2.gz CNGKRBQFXIGULQ-INIZCTEOSA-N 1 0 299.414 3.992 20 10 CHCDRO COc1ccc(C[NH2+][C@H]2CCc3ccccc3C2)cc1C ZINC000049943267 1119133045 /nfs/dbraw/zinc/13/30/45/1119133045.db2.gz JLMMADBUIBMOCY-SFHVURJKSA-N 1 0 281.399 3.651 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CCc3ccccc3C2)cc1C ZINC000049943266 1119133176 /nfs/dbraw/zinc/13/31/76/1119133176.db2.gz JLMMADBUIBMOCY-GOSISDBHSA-N 1 0 281.399 3.651 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CCC[C@@H]2CCCC[C@@H]21 ZINC000226561826 1119157333 /nfs/dbraw/zinc/15/73/33/1119157333.db2.gz AWPDXFIRAFBXBC-WFASDCNBSA-N 1 0 263.356 3.686 20 10 CHCDRO COc1cccc(CNc2cc[nH+]c3cc(F)ccc23)c1O ZINC000091479174 1119234512 /nfs/dbraw/zinc/23/45/12/1119234512.db2.gz TVWKYBFPAHBCLJ-UHFFFAOYSA-N 1 0 298.317 3.700 20 10 CHCDRO CC[C@H]([NH2+]Cc1cnc(C)s1)c1ccc(N(C)C)cc1 ZINC000123704354 1119301543 /nfs/dbraw/zinc/30/15/43/1119301543.db2.gz RDTNNYAZHQVDCR-INIZCTEOSA-N 1 0 289.448 3.758 20 10 CHCDRO CC[C@@H]([NH2+]CCCC(F)(F)F)c1ccccc1O ZINC000148647749 1119375660 /nfs/dbraw/zinc/37/56/60/1119375660.db2.gz OVANGZRELOZRBI-LLVKDONJSA-N 1 0 261.287 3.775 20 10 CHCDRO CCOc1cccc(C[N@@H+]2C[C@H](C)C[C@H](C)[C@@H]2C)c1O ZINC000168247397 1119427308 /nfs/dbraw/zinc/42/73/08/1119427308.db2.gz IFLUVVTVPFGWLX-RDBSUJKOSA-N 1 0 277.408 3.657 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]C[C@@H](C)C1CC1 ZINC000168745538 1119474528 /nfs/dbraw/zinc/47/45/28/1119474528.db2.gz MNRDALCVTOWBAY-YRGRVCCFSA-N 1 0 259.393 3.885 20 10 CHCDRO CSC(C)(C)C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC000168813822 1119478137 /nfs/dbraw/zinc/47/81/37/1119478137.db2.gz VSZAXQYQNBZJPM-VXGBXAGGSA-N 1 0 279.449 3.980 20 10 CHCDRO Oc1ccccc1C[NH+]1CCC(COc2ccccc2)CC1 ZINC000179563424 1119751646 /nfs/dbraw/zinc/75/16/46/1119751646.db2.gz VKKFIFBCWWCKAQ-UHFFFAOYSA-N 1 0 297.398 3.683 20 10 CHCDRO CC[N@H+](Cc1cccs1)Cc1cc(C)ccc1O ZINC000179720847 1119757995 /nfs/dbraw/zinc/75/79/95/1119757995.db2.gz DZLGWMZFCNDQEA-UHFFFAOYSA-N 1 0 261.390 3.784 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2CCC23CCCC3)cc1 ZINC000694340113 1119859164 /nfs/dbraw/zinc/85/91/64/1119859164.db2.gz NPAOPKXZDPPYME-MRXNPFEDSA-N 1 0 258.409 3.565 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCCC1(C)C)c1ccc(N(C)C)cc1 ZINC000094321269 1119911941 /nfs/dbraw/zinc/91/19/41/1119911941.db2.gz INGBGSJPTZRLBK-CZUORRHYSA-N 1 0 260.425 3.982 20 10 CHCDRO C[C@H]([NH2+]C[C@@]1(C)CC1(F)F)c1ccc(Cl)cc1O ZINC000850536156 1119973029 /nfs/dbraw/zinc/97/30/29/1119973029.db2.gz HPMWFPDXXMFWGO-QPUJVOFHSA-N 1 0 275.726 3.742 20 10 CHCDRO Cc1ccc(O)c(C[N@H+](C)CCc2ccc(F)cc2)c1 ZINC000092162126 1119975822 /nfs/dbraw/zinc/97/58/22/1119975822.db2.gz XBNHBADFTOSLMU-UHFFFAOYSA-N 1 0 273.351 3.514 20 10 CHCDRO Cc1cccc(OC2CC[NH+](Cc3ccccc3O)CC2)c1 ZINC001203558568 1120036098 /nfs/dbraw/zinc/03/60/98/1120036098.db2.gz NBZSWFIMLIFKMI-UHFFFAOYSA-N 1 0 297.398 3.744 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2cc(F)ccc2F)c(O)c1 ZINC000107929041 1120062658 /nfs/dbraw/zinc/06/26/58/1120062658.db2.gz SHFNFUSABBXYFE-LLVKDONJSA-N 1 0 277.314 3.830 20 10 CHCDRO C[C@H]([NH2+]CCCCF)c1cc(Br)ccc1O ZINC000309475626 1120085830 /nfs/dbraw/zinc/08/58/30/1120085830.db2.gz RVXILUIXUSCUOP-VIFPVBQESA-N 1 0 290.176 3.555 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCCC(F)(F)C2)c(O)c1 ZINC000695125322 1120110586 /nfs/dbraw/zinc/11/05/86/1120110586.db2.gz ICGFJGDPFLDWGR-NWDGAFQWSA-N 1 0 269.335 3.929 20 10 CHCDRO CO[C@H](C[NH2+][C@@H](C)c1ccccc1O)C1CCCCC1 ZINC000695159890 1120128504 /nfs/dbraw/zinc/12/85/04/1120128504.db2.gz HHEXYGLCFPWORI-SUMWQHHRSA-N 1 0 277.408 3.638 20 10 CHCDRO COCCCCC[N@H+](Cc1ccc(N(C)C)cc1)C1CC1 ZINC000728688423 1120138866 /nfs/dbraw/zinc/13/88/66/1120138866.db2.gz OWUXASPDQMDCKT-UHFFFAOYSA-N 1 0 290.451 3.534 20 10 CHCDRO CCC(CC)[C@@H](O)C[NH2+][C@H](C)c1ccc(N(C)CC)cc1 ZINC000765921782 1120210416 /nfs/dbraw/zinc/21/04/16/1120210416.db2.gz LTMFHHFBPYMVLD-KDOFPFPSSA-N 1 0 292.467 3.590 20 10 CHCDRO CCC(CC)[C@@H](O)C[NH2+][C@H](CC)c1ccc(N(C)C)cc1 ZINC000765929602 1120213936 /nfs/dbraw/zinc/21/39/36/1120213936.db2.gz WHLOSUCXYONRHG-MSOLQXFVSA-N 1 0 292.467 3.590 20 10 CHCDRO CC[C@H](C)[C@@](C)(O)C[NH2+][C@H](C)c1ccc(N(C)CC)cc1 ZINC000765945622 1120239426 /nfs/dbraw/zinc/23/94/26/1120239426.db2.gz LBCATBONRZWXET-DAYGRLMNSA-N 1 0 292.467 3.590 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CC(C)(C)OC2(C)C)c(O)c1 ZINC000186499967 1120241201 /nfs/dbraw/zinc/24/12/01/1120241201.db2.gz VRFHLJFEDKDPGI-WFASDCNBSA-N 1 0 277.408 3.697 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CC(C)(C)OC2(C)C)c(O)c1 ZINC000186499936 1120241227 /nfs/dbraw/zinc/24/12/27/1120241227.db2.gz VRFHLJFEDKDPGI-SWLSCSKDSA-N 1 0 277.408 3.697 20 10 CHCDRO CCCCN(C)CC[NH2+][C@H](CC)c1ccc(N(C)C)cc1 ZINC000765953811 1120281246 /nfs/dbraw/zinc/28/12/46/1120281246.db2.gz UINOFJGDQVKRTF-GOSISDBHSA-N 1 0 291.483 3.525 20 10 CHCDRO CCOc1cccc(C[N@H+](CC)CC(C)(C)C)c1O ZINC000312089824 1120293045 /nfs/dbraw/zinc/29/30/45/1120293045.db2.gz YRUYFDSSWQQQCY-UHFFFAOYSA-N 1 0 265.397 3.659 20 10 CHCDRO CC1CCN(c2ccc(C[NH2+]CC3(C)CC3)cc2)CC1 ZINC000785458467 1120306097 /nfs/dbraw/zinc/30/60/97/1120306097.db2.gz BFVGQXLYAOYJPL-UHFFFAOYSA-N 1 0 272.436 3.813 20 10 CHCDRO CCc1cnccc1[C@H](C)[NH2+]Cc1ccc2c(c1)CCCO2 ZINC000921964079 1120308471 /nfs/dbraw/zinc/30/84/71/1120308471.db2.gz NQMRJUUHUDXLGF-AWEZNQCLSA-N 1 0 296.414 3.820 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@](C)(O)CCC(C)C)c1 ZINC000185527819 1120378458 /nfs/dbraw/zinc/37/84/58/1120378458.db2.gz MCJPFXYVFMTXDH-YOEHRIQHSA-N 1 0 279.424 3.538 20 10 CHCDRO C[C@@H](c1ccccc1Cl)[N@H+](C)Cc1cc(O)ccc1O ZINC001141161177 1120418321 /nfs/dbraw/zinc/41/83/21/1120418321.db2.gz BBPFMNOHINGUIM-NSHDSACASA-N 1 0 291.778 3.944 20 10 CHCDRO COc1cccc(C[NH2+][C@H]2CCC[C@H](C(C)C)C2)c1O ZINC000728777071 1120457316 /nfs/dbraw/zinc/45/73/16/1120457316.db2.gz YAQOUPLUVLNKJD-ZFWWWQNUSA-N 1 0 277.408 3.705 20 10 CHCDRO C[C@@H]([NH2+]C[C@@](C)(O)C1CCCCC1)c1ccc(F)cc1[O-] ZINC000188667849 1120461218 /nfs/dbraw/zinc/46/12/18/1120461218.db2.gz XZKRVNIBKCFOLZ-SJKOYZFVSA-N 1 0 295.398 3.513 20 10 CHCDRO Cc1ncc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCCO3)s1 ZINC000922307959 1120504807 /nfs/dbraw/zinc/50/48/07/1120504807.db2.gz UKJZFZCXSXNHHN-LLVKDONJSA-N 1 0 288.416 3.627 20 10 CHCDRO CCN1CCCC[C@@H]1C[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000756565187 1120531783 /nfs/dbraw/zinc/53/17/83/1120531783.db2.gz WIJFHZXBQPGNHH-TZMCWYRMSA-N 1 0 296.842 3.571 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2ccccc2)c1 ZINC000019878469 1120542448 /nfs/dbraw/zinc/54/24/48/1120542448.db2.gz UWIMAOKJYMYHKY-STQMWFEESA-N 1 0 271.360 3.813 20 10 CHCDRO C[C@H]([NH2+]CCc1ccc(F)cc1F)c1cc(F)ccc1O ZINC000756578867 1120551925 /nfs/dbraw/zinc/55/19/25/1120551925.db2.gz XHSFXGNGQJXJQO-JTQLQIEISA-N 1 0 295.304 3.703 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](c2ccccn2)C2CC2)cc1C ZINC000922586038 1120558262 /nfs/dbraw/zinc/55/82/62/1120558262.db2.gz JPFJHLZROHCOTC-GOSISDBHSA-N 1 0 282.387 3.640 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccccc1O)c1cc(F)ccc1OC ZINC000922620742 1120564888 /nfs/dbraw/zinc/56/48/88/1120564888.db2.gz XJTVYANGHNGUBR-HNNXBMFYSA-N 1 0 289.350 3.781 20 10 CHCDRO Cc1cccc(C[N@H+]2CC[C@]3(CC[C@@H](C)C3)C2)c1O ZINC000781928995 1120581700 /nfs/dbraw/zinc/58/17/00/1120581700.db2.gz OLUABMXWDQCXJK-DYVFJYSZSA-N 1 0 259.393 3.713 20 10 CHCDRO c1cc(C[NH2+][C@H]2CCSC3(CCC3)C2)cc2c1OCC2 ZINC000922843518 1120610473 /nfs/dbraw/zinc/61/04/73/1120610473.db2.gz VENUAWOHNHCPIP-HNNXBMFYSA-N 1 0 289.444 3.529 20 10 CHCDRO Oc1cccc2c1C[N@@H+]([C@@H]1Cc3cccc(Cl)c3C1)CC2 ZINC001168737648 1120633201 /nfs/dbraw/zinc/63/32/01/1120633201.db2.gz BQTATGUSJNYJBY-CQSZACIVSA-N 1 0 299.801 3.571 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CSc2ccccc21 ZINC000766030567 1120673818 /nfs/dbraw/zinc/67/38/18/1120673818.db2.gz UGBAPTMOVSMVDA-KRWDZBQOSA-N 1 0 298.455 3.998 20 10 CHCDRO CCC(CC)(CC)[NH2+]Cc1ccc(N2CCOCC2)cc1 ZINC000086642406 1120698891 /nfs/dbraw/zinc/69/88/91/1120698891.db2.gz TYCDDAADGDGHKH-UHFFFAOYSA-N 1 0 290.451 3.582 20 10 CHCDRO C[C@@H]1C[C@@H]([NH2+][C@@H]2CCOC(C)(C)C2)c2c1c(F)ccc2O ZINC000756771225 1120821633 /nfs/dbraw/zinc/82/16/33/1120821633.db2.gz SQHLXDNLAJETPX-NQBHXWOUSA-N 1 0 293.382 3.627 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCSC1)c1ccc2ccccc2c1O ZINC000228557408 1120969722 /nfs/dbraw/zinc/96/97/22/1120969722.db2.gz CNILKSJFFKQRKM-CHWSQXEVSA-N 1 0 287.428 3.949 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCCC1(C)C)c1ccc(N(C)C)cc1 ZINC000094321271 1120999961 /nfs/dbraw/zinc/99/99/61/1120999961.db2.gz INGBGSJPTZRLBK-CJNGLKHVSA-N 1 0 260.425 3.982 20 10 CHCDRO CCOCc1cc(C[NH2+][C@@H]2CCC(F)(F)C2)ccc1OC ZINC000763520801 1128960698 /nfs/dbraw/zinc/96/06/98/1128960698.db2.gz IQLWOQRFAWRXBD-CQSZACIVSA-N 1 0 299.361 3.509 20 10 CHCDRO C[C@@H]([NH2+]C1CC2(CCC2)C1)c1ccc(N(C)C)cc1 ZINC000700085702 1121077657 /nfs/dbraw/zinc/07/76/57/1121077657.db2.gz RNEYFHYQXOEUEV-CYBMUJFWSA-N 1 0 258.409 3.736 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(F)cc1)c1cc(F)ccc1O ZINC000094616717 1121086456 /nfs/dbraw/zinc/08/64/56/1121086456.db2.gz MVWAJYILTUIJON-JTQLQIEISA-N 1 0 263.287 3.521 20 10 CHCDRO CC1(C)C[C@H](C[NH2+]Cc2c(O)cccc2Cl)C(C)(C)O1 ZINC000709708733 1121129262 /nfs/dbraw/zinc/12/92/62/1121129262.db2.gz YGQSZGHJLOXEOP-LLVKDONJSA-N 1 0 297.826 3.729 20 10 CHCDRO C[C@@H]([NH2+]CC1CC(C)(C)C1)c1cc(F)ccc1O ZINC000701945122 1121174142 /nfs/dbraw/zinc/17/41/42/1121174142.db2.gz OROLRWBMCDSMAL-SNVBAGLBSA-N 1 0 251.345 3.618 20 10 CHCDRO CC(C)O[C@@H]1C[C@H]([NH2+]Cc2c(O)cccc2Cl)C1(C)C ZINC000766089322 1121210011 /nfs/dbraw/zinc/21/00/11/1121210011.db2.gz QAPKBNUDGCWRSH-LSDHHAIUSA-N 1 0 297.826 3.727 20 10 CHCDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]CCCOC(C)C ZINC000020198229 1121233567 /nfs/dbraw/zinc/23/35/67/1121233567.db2.gz IMSSTSORPFRVAI-KBPBESRZSA-N 1 0 277.408 3.654 20 10 CHCDRO C[C@H]([NH2+]Cc1ccncc1Cl)c1ccc(N(C)C)cc1 ZINC000704394254 1121342297 /nfs/dbraw/zinc/34/22/97/1121342297.db2.gz KZFVFWTULMOMAD-LBPRGKRZSA-N 1 0 289.810 3.652 20 10 CHCDRO CC[C@@H]([NH2+]CC[C@H]1CCSC1)c1ccccc1O ZINC000704777410 1121367740 /nfs/dbraw/zinc/36/77/40/1121367740.db2.gz TZKPJKZLLYEKMG-GXTWGEPZSA-N 1 0 265.422 3.576 20 10 CHCDRO CCCC[C@H]1CCC[C@@H]1[NH2+]Cc1cccc(OC)c1O ZINC000236884536 1121368568 /nfs/dbraw/zinc/36/85/68/1121368568.db2.gz RQJLNXRDKZSTFI-ZFWWWQNUSA-N 1 0 277.408 3.849 20 10 CHCDRO CCC[C@H](C[NH2+][C@@H](C)c1ccc(C)cc1O)OCC ZINC000705319225 1121396264 /nfs/dbraw/zinc/39/62/64/1121396264.db2.gz XMMMDEOIACUOOH-UONOGXRCSA-N 1 0 265.397 3.556 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCSC[C@@H]2C(C)(C)C)cc1 ZINC001175697398 1121416909 /nfs/dbraw/zinc/41/69/09/1121416909.db2.gz CKWWOOCLJHQWEZ-MRXNPFEDSA-N 1 0 292.492 3.716 20 10 CHCDRO CC(=O)c1cc(Cl)cc(C[N@@H+]2CCC[C@@H]2C2CC2)c1O ZINC000706681799 1121434489 /nfs/dbraw/zinc/43/44/89/1121434489.db2.gz XXZJRXPUMCPULN-OAHLLOKOSA-N 1 0 293.794 3.623 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H](C)C2(C)CC2)cc1 ZINC000706827933 1121440859 /nfs/dbraw/zinc/44/08/59/1121440859.db2.gz VNKWJJVVZXPWOG-CQSZACIVSA-N 1 0 260.425 3.811 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[NH2+][C@H]1CCCC12CC2 ZINC000706941704 1121445873 /nfs/dbraw/zinc/44/58/73/1121445873.db2.gz KMLQVRMJYDUSPK-KRWDZBQOSA-N 1 0 270.420 3.709 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]C[C@@H]1CCCC13CC3)CC2 ZINC000707057386 1121448494 /nfs/dbraw/zinc/44/84/94/1121448494.db2.gz KCNFUJJVFZPTNR-KBPBESRZSA-N 1 0 257.377 3.549 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@]2(C)CCOc3ccccc32)cc1 ZINC000923023793 1121514115 /nfs/dbraw/zinc/51/41/15/1121514115.db2.gz BKGSTNKWULLYCG-IBGZPJMESA-N 1 0 296.414 3.540 20 10 CHCDRO Cc1cc(Nc2cc(Cl)cc(Cl)c2O)cc(C)[nH+]1 ZINC001176055832 1121542073 /nfs/dbraw/zinc/54/20/73/1121542073.db2.gz LJDCJLNMGSLOTN-UHFFFAOYSA-N 1 0 283.158 3.876 20 10 CHCDRO C[N@H+](C/C=C\c1ccc(F)cc1)Cc1ccccc1O ZINC000254970737 1121690776 /nfs/dbraw/zinc/69/07/76/1121690776.db2.gz RQHNJRRRPVVDAT-PLNGDYQASA-N 1 0 271.335 3.677 20 10 CHCDRO COCCC[NH2+][C@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000020550957 1121699304 /nfs/dbraw/zinc/69/93/04/1121699304.db2.gz IIZIOAWKJKCNTF-CQSZACIVSA-N 1 0 294.414 3.503 20 10 CHCDRO COc1cc(C)cc(C[NH2+][C@@H](C)c2ccc(C)s2)c1O ZINC000894201286 1121732133 /nfs/dbraw/zinc/73/21/33/1121732133.db2.gz XMJMFODOVYDHRQ-LBPRGKRZSA-N 1 0 291.416 3.930 20 10 CHCDRO C[C@H]1CC(C)(C)C[C@@H]1[NH2+]Cc1ccc2c(c1)CCCN2C ZINC001177529988 1121735848 /nfs/dbraw/zinc/73/58/48/1121735848.db2.gz XSQNAIZFCLIEHR-YOEHRIQHSA-N 1 0 286.463 3.983 20 10 CHCDRO CCOCc1cc(C[NH2+]CC2(C)CCCC2)ccc1OC ZINC001177790342 1121748882 /nfs/dbraw/zinc/74/88/82/1121748882.db2.gz CAVUGTWKLQUVRJ-UHFFFAOYSA-N 1 0 291.435 3.902 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CCC[C@H]2c2cc(C)no2)cc1 ZINC000773731735 1121773672 /nfs/dbraw/zinc/77/36/72/1121773672.db2.gz WRBFAVQINFZNOR-KRWDZBQOSA-N 1 0 299.418 3.776 20 10 CHCDRO CC[C@H](CSC)[NH2+]Cc1ccc(N(CC)CC)c(F)c1 ZINC001178365598 1121783387 /nfs/dbraw/zinc/78/33/87/1121783387.db2.gz NFHAMNGQRFTXNF-CQSZACIVSA-N 1 0 298.471 3.903 20 10 CHCDRO CCN(C)c1ccc(C[N@H+](C)CCc2cccs2)cc1 ZINC000773753974 1121798648 /nfs/dbraw/zinc/79/86/48/1121798648.db2.gz ODTNYTLVRIETDW-UHFFFAOYSA-N 1 0 288.460 3.879 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CCC3(CCC3)C2)cc1 ZINC000773765478 1121808776 /nfs/dbraw/zinc/80/87/76/1121808776.db2.gz LKBCCHHQLRPAQF-UHFFFAOYSA-N 1 0 258.409 3.519 20 10 CHCDRO CCN(C)c1ccc(C[N@H+](C)[C@@H](C)CCSC)cc1 ZINC000773772910 1121823488 /nfs/dbraw/zinc/82/34/88/1121823488.db2.gz MCCFPWGVTQZWNJ-AWEZNQCLSA-N 1 0 280.481 3.716 20 10 CHCDRO CCN(C)c1ccc(C[N@H+](C)[C@H](C)c2ccccn2)cc1 ZINC000773802876 1121856160 /nfs/dbraw/zinc/85/61/60/1121856160.db2.gz AGKHQMDBXJMFFM-OAHLLOKOSA-N 1 0 283.419 3.731 20 10 CHCDRO C[N@H+](Cc1cc(-c2ccccc2)no1)Cc1ccccc1O ZINC000731842812 1121887928 /nfs/dbraw/zinc/88/79/28/1121887928.db2.gz GWTKNXPVHCRWSY-UHFFFAOYSA-N 1 0 294.354 3.679 20 10 CHCDRO c1cc2c(cc1C[NH2+]C1CCC=CCC1)CCCO2 ZINC001179615812 1121894294 /nfs/dbraw/zinc/89/42/94/1121894294.db2.gz GGUVUNPIXULEPP-UHFFFAOYSA-N 1 0 257.377 3.600 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[NH2+][C@@H]1C[C@@H]2CCC[C@@H]12 ZINC001179767647 1121906121 /nfs/dbraw/zinc/90/61/21/1121906121.db2.gz BXRPPCAVXVFYOG-CGTJXYLNSA-N 1 0 270.420 3.565 20 10 CHCDRO Cc1cc(C[N@H+](Cc2ccccc2O)C2CCCC2)no1 ZINC000732204634 1121911844 /nfs/dbraw/zinc/91/18/44/1121911844.db2.gz PRDMGKHVENDBJV-UHFFFAOYSA-N 1 0 286.375 3.633 20 10 CHCDRO COCC[N@H+](Cc1c(O)cc(C)cc1Cl)C1CCCC1 ZINC001179859936 1121920495 /nfs/dbraw/zinc/92/04/95/1121920495.db2.gz WXIJWSMAGVVUMX-UHFFFAOYSA-N 1 0 297.826 3.745 20 10 CHCDRO CC(C)[C@@](C)(O)C[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000732818174 1121939043 /nfs/dbraw/zinc/93/90/43/1121939043.db2.gz ZKVXUEDWBTXQTM-IBGZPJMESA-N 1 0 299.414 3.556 20 10 CHCDRO CC[C@@H]1C[C@@H](C)C[N@@H+]1C/C=C/c1ccc(N(C)C)cc1 ZINC001180203297 1121963424 /nfs/dbraw/zinc/96/34/24/1121963424.db2.gz OFHJXFDUKUCKMF-RUBBHVMPSA-N 1 0 272.436 3.886 20 10 CHCDRO CC[N@@H+](Cc1cc(Cl)c(C)cc1O)CC1CC1 ZINC001180291366 1121977381 /nfs/dbraw/zinc/97/73/81/1121977381.db2.gz AFUOLOKLNWXWTQ-UHFFFAOYSA-N 1 0 253.773 3.586 20 10 CHCDRO C[C@@]1(C[NH2+]Cc2cc(-c3ccccc3)ccc2O)CCOC1 ZINC000733328291 1121977778 /nfs/dbraw/zinc/97/77/78/1121977778.db2.gz SSFIYIFNYKBKJS-IBGZPJMESA-N 1 0 297.398 3.575 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C2(c3ccccc3)CC2)cc1F ZINC000733328104 1121978160 /nfs/dbraw/zinc/97/81/60/1121978160.db2.gz NTGCZRXXMVYKQH-UHFFFAOYSA-N 1 0 284.378 3.671 20 10 CHCDRO CC[N@H+](Cc1cc(C)co1)Cc1ccc(N(C)C)cc1 ZINC001180480226 1121989707 /nfs/dbraw/zinc/98/97/07/1121989707.db2.gz WYLZDOBJEHJBAO-UHFFFAOYSA-N 1 0 272.392 3.676 20 10 CHCDRO CC(C)c1ccc(O)c(C[NH2+]C23CCC(CC2)C3)c1 ZINC001180833487 1122016049 /nfs/dbraw/zinc/01/60/49/1122016049.db2.gz CGBPMAMLAJXWOC-UHFFFAOYSA-N 1 0 259.393 3.938 20 10 CHCDRO CC[C@@H]1[C@H](C)CC[N@@H+]1Cc1ccc(Cl)cc1O ZINC001181102185 1122032441 /nfs/dbraw/zinc/03/24/41/1122032441.db2.gz JNAVLPFLUDFZJQ-ZWNOBZJWSA-N 1 0 253.773 3.666 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H]1CC[C@@H]1C1CCC1 ZINC001181446290 1122055194 /nfs/dbraw/zinc/05/51/94/1122055194.db2.gz XDHSVXFIKDRWMD-QZTJIDSGSA-N 1 0 272.436 3.940 20 10 CHCDRO CC(C)c1ccc(O)c(C[N@@H+]2CCSC[C@H]2C2CC2)c1 ZINC001181901155 1122093751 /nfs/dbraw/zinc/09/37/51/1122093751.db2.gz QTYJFXWITLAVCK-INIZCTEOSA-N 1 0 291.460 3.843 20 10 CHCDRO Cc1ccc(C[NH+]2CCC(C)(C3CC3)CC2)c(O)c1 ZINC001182125485 1122111812 /nfs/dbraw/zinc/11/18/12/1122111812.db2.gz AOSCGJOJMVODTH-UHFFFAOYSA-N 1 0 259.393 3.713 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2ccc3c(c2)OCO3)c1 ZINC000192751161 1129034091 /nfs/dbraw/zinc/03/40/91/1129034091.db2.gz OQRNDLBTGKRUQS-OLZOCXBDSA-N 1 0 299.370 3.841 20 10 CHCDRO CC(C)[N@H+](Cc1cc(C(C)(C)C)cc(O)c1O)C1CC1 ZINC000192795746 1129036139 /nfs/dbraw/zinc/03/61/39/1129036139.db2.gz LJESDSCCNWKJFT-UHFFFAOYSA-N 1 0 277.408 3.768 20 10 CHCDRO COc1cccc(C[NH2+][C@@H](C)[C@@H](C)c2ccccc2)c1O ZINC000271834519 1122178359 /nfs/dbraw/zinc/17/83/59/1122178359.db2.gz PORHVRLIPDODJB-KGLIPLIRSA-N 1 0 285.387 3.683 20 10 CHCDRO COc1ccc(C[N@@H+]2CCC[C@H]2c2cccs2)c(O)c1 ZINC000162717585 1122203662 /nfs/dbraw/zinc/20/36/62/1122203662.db2.gz PEOHLFCCAJHLAM-AWEZNQCLSA-N 1 0 289.400 3.799 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]CC(C)(C)C(C)(F)F ZINC001183354781 1122218151 /nfs/dbraw/zinc/21/81/51/1122218151.db2.gz GXNWXCSPGHEONK-UHFFFAOYSA-N 1 0 284.394 3.832 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2cccc(F)c2)c(O)c1C ZINC000273391901 1122231096 /nfs/dbraw/zinc/23/10/96/1122231096.db2.gz KXTDISZFEBBHQE-ZDUSSCGKSA-N 1 0 273.351 3.999 20 10 CHCDRO COCC[C@@H]([NH2+][C@@H](C)c1ccc(C)cc1O)c1ccco1 ZINC000273431088 1122232531 /nfs/dbraw/zinc/23/25/31/1122232531.db2.gz LCGWRLHBSMHXTF-DZGCQCFKSA-N 1 0 289.375 3.722 20 10 CHCDRO CC(C)[C@H]1C[C@H]([NH2+][C@@H](C)c2cc(Cl)ccc2O)CCO1 ZINC000273482409 1122234775 /nfs/dbraw/zinc/23/47/75/1122234775.db2.gz MGVVBLHMWWBDQO-NORZTCDRSA-N 1 0 297.826 3.900 20 10 CHCDRO CC(C)[C@@H]1C[C@@H]([NH2+][C@@H](C)c2cc(Cl)ccc2O)CCO1 ZINC000273482410 1122235187 /nfs/dbraw/zinc/23/51/87/1122235187.db2.gz MGVVBLHMWWBDQO-RBOXIYTFSA-N 1 0 297.826 3.900 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCO[C@@H](C(C)(C)C)C2)c(O)c1 ZINC000273503336 1122236033 /nfs/dbraw/zinc/23/60/33/1122236033.db2.gz QMXILWBGWYPVMH-GRDNDAEWSA-N 1 0 291.435 3.945 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCO[C@H](C(C)(C)C)C1)c1cc(F)ccc1O ZINC000273530926 1122237159 /nfs/dbraw/zinc/23/71/59/1122237159.db2.gz WHUCKDVBJGVNDK-GHJWDPDVSA-N 1 0 295.398 3.776 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC2(CCO)CCCC2)c(O)c1C ZINC000273563025 1122238378 /nfs/dbraw/zinc/23/83/78/1122238378.db2.gz IRRPINLGJADWBT-HNNXBMFYSA-N 1 0 291.435 3.602 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC2(CCO)CCCC2)c(O)c1C ZINC000273563027 1122239124 /nfs/dbraw/zinc/23/91/24/1122239124.db2.gz IRRPINLGJADWBT-OAHLLOKOSA-N 1 0 291.435 3.602 20 10 CHCDRO C[C@H]([NH2+]CCc1ccncc1)c1cc2c(cc1O)CCCC2 ZINC000273565965 1122239221 /nfs/dbraw/zinc/23/92/21/1122239221.db2.gz JMHXOUKDGWMQMT-AWEZNQCLSA-N 1 0 296.414 3.559 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCCSC1)c1cc(Cl)ccc1O ZINC000273586203 1122239946 /nfs/dbraw/zinc/23/99/46/1122239946.db2.gz NWPCCDFMIOXBIT-ONGXEEELSA-N 1 0 271.813 3.592 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCc3c2cccc3O)c1 ZINC000273578139 1122240025 /nfs/dbraw/zinc/24/00/25/1122240025.db2.gz MFFWYQJZVKVKRG-BLLLJJGKSA-N 1 0 283.371 3.744 20 10 CHCDRO CCc1cnc(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)s1 ZINC000273621760 1122241294 /nfs/dbraw/zinc/24/12/94/1122241294.db2.gz ZGSGPCMTTHCXDQ-GFCCVEGCSA-N 1 0 290.432 3.879 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@@H]2C[C@@H]2[C@H]2C[C@H]2C)cc1Cl ZINC001183822050 1122242454 /nfs/dbraw/zinc/24/24/54/1122242454.db2.gz AUGTUBVTEVLQDS-OJDJGZDQSA-N 1 0 279.811 3.736 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](c1ccccc1)N(C)C)c1ccccc1O ZINC000192907375 1129046249 /nfs/dbraw/zinc/04/62/49/1129046249.db2.gz XQMRTVSJKPDIMO-ROUUACIJSA-N 1 0 298.430 3.736 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H](c2ccccc2)N(C)C)c(O)c1 ZINC000192907576 1129046731 /nfs/dbraw/zinc/04/67/31/1129046731.db2.gz UIRNPGWWSRBRFJ-MAUKXSAKSA-N 1 0 298.430 3.654 20 10 CHCDRO C[C@H]([NH2+]CCc1cccc(Cl)c1)c1ccccc1O ZINC000183383210 1129049003 /nfs/dbraw/zinc/04/90/03/1129049003.db2.gz XJEYXFVJASFHLL-LBPRGKRZSA-N 1 0 275.779 3.939 20 10 CHCDRO C[C@]1(F)CCCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC001203650876 1122415334 /nfs/dbraw/zinc/41/53/34/1122415334.db2.gz FMJDSDNEUMFEPV-AWEZNQCLSA-N 1 0 271.763 3.760 20 10 CHCDRO C[C@H]([NH2+]CCOc1ccccc1Cl)c1ccccc1O ZINC000775135078 1122437614 /nfs/dbraw/zinc/43/76/14/1122437614.db2.gz CWDAZWLZDGGYDQ-LBPRGKRZSA-N 1 0 291.778 3.775 20 10 CHCDRO COc1ccc(O)c(C[N@H+](C)[C@H](C)Cc2ccccc2C)c1 ZINC000775203722 1122478602 /nfs/dbraw/zinc/47/86/02/1122478602.db2.gz HISZMSHDAKRCFY-OAHLLOKOSA-N 1 0 299.414 3.772 20 10 CHCDRO Cc1ccc(OCCC[NH2+][C@H](C)c2ccccc2O)cc1 ZINC000183478578 1129057704 /nfs/dbraw/zinc/05/77/04/1129057704.db2.gz XYKLMEGFXFKNIO-OAHLLOKOSA-N 1 0 285.387 3.820 20 10 CHCDRO CC(C)c1cccc(C[NH2+]Cc2ccccc2O)c1 ZINC000775325262 1122516878 /nfs/dbraw/zinc/51/68/78/1122516878.db2.gz BVNOJMROZJRBEV-UHFFFAOYSA-N 1 0 255.361 3.805 20 10 CHCDRO Cc1ccc(O[C@H](C)C[NH2+][C@H](C)c2ccccc2O)cc1 ZINC000183534527 1129061174 /nfs/dbraw/zinc/06/11/74/1129061174.db2.gz PQYHTDDFJCKIMF-HUUCEWRRSA-N 1 0 285.387 3.819 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(C)ccc1OC)c1ccccc1O ZINC000775413774 1122556554 /nfs/dbraw/zinc/55/65/54/1122556554.db2.gz AWYKSJSIBJQHHA-INIZCTEOSA-N 1 0 285.387 3.950 20 10 CHCDRO CCS[C@H]1CCCC[N@H+](Cc2ccc(N(C)C)cc2)C1 ZINC001190935116 1122560552 /nfs/dbraw/zinc/56/05/52/1122560552.db2.gz QEZFNWNIKGIJIX-KRWDZBQOSA-N 1 0 292.492 3.860 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]CC(C)(C)c2ccccc2)c1 ZINC000071408179 1129062810 /nfs/dbraw/zinc/06/28/10/1129062810.db2.gz CVVMRWVIEOTLHU-UHFFFAOYSA-N 1 0 269.388 3.768 20 10 CHCDRO C[C@@H]1CCC[C@H](C)C[N@H+]1Cc1ccc(N(C)C)cc1 ZINC001191068041 1122568462 /nfs/dbraw/zinc/56/84/62/1122568462.db2.gz AIMOLYJGAOLHCH-LSDHHAIUSA-N 1 0 260.425 3.763 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1COc2ccccc2C1)c1ccccc1O ZINC000775487493 1122618227 /nfs/dbraw/zinc/61/82/27/1122618227.db2.gz CHYMYUQCQRVMGS-YOEHRIQHSA-N 1 0 297.398 3.684 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1CCCOC1)c1cc(Cl)ccc1O ZINC000775490652 1122620365 /nfs/dbraw/zinc/62/03/65/1122620365.db2.gz CVUJNVFPFIBKDF-SMDDNHRTSA-N 1 0 283.799 3.513 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](C)N(C)C1CC1)c1cc(Cl)ccc1O ZINC000775501740 1122628481 /nfs/dbraw/zinc/62/84/81/1122628481.db2.gz KTDWBYZGDNWZGU-IAQYHMDHSA-N 1 0 296.842 3.569 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCCc2nc(C)ncc21)c1ccccc1O ZINC000775508735 1122629666 /nfs/dbraw/zinc/62/96/66/1122629666.db2.gz WSAUITUDUMSDJS-DOTOQJQBSA-N 1 0 297.402 3.609 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1cnn(C)c1)c1cc(Cl)ccc1O ZINC000775508582 1122630182 /nfs/dbraw/zinc/63/01/82/1122630182.db2.gz CVEDUGRDNDCINM-YGRLFVJLSA-N 1 0 293.798 3.581 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](COC)C(C)C)c1cc(Cl)ccc1O ZINC000775510284 1122631414 /nfs/dbraw/zinc/63/14/14/1122631414.db2.gz ZQZQDEKWBMMKBS-KGLIPLIRSA-N 1 0 285.815 3.757 20 10 CHCDRO CC[C@@H]([NH2+][C@H](COC)Cc1ccccc1)c1ccccc1O ZINC000775514083 1122634286 /nfs/dbraw/zinc/63/42/86/1122634286.db2.gz VOWLLTHNEYUTBV-FUHWJXTLSA-N 1 0 299.414 3.691 20 10 CHCDRO CC[C@@H]([NH2+]C1CC(C)C1)c1cc(Cl)ccc1O ZINC000775525138 1122641710 /nfs/dbraw/zinc/64/17/10/1122641710.db2.gz DJPAGDFCIJSIIE-QEIKUCIBSA-N 1 0 253.773 3.885 20 10 CHCDRO C[C@H](CN(C)Cc1ccccc1)[NH2+][C@@H](C)c1ccccc1O ZINC000183645431 1129075808 /nfs/dbraw/zinc/07/58/08/1129075808.db2.gz XSSFRKFGOUIHHY-CVEARBPZSA-N 1 0 298.430 3.563 20 10 CHCDRO CCC[N@H+](Cc1cc(Cl)cc(C)c1O)C1CC1 ZINC000775652205 1122866060 /nfs/dbraw/zinc/86/60/60/1122866060.db2.gz IBSZFFHLWMDDBG-UHFFFAOYSA-N 1 0 253.773 3.728 20 10 CHCDRO COc1ccc(O)c(C[N@H+](C2CC2)C2CCCCC2)c1 ZINC000775651657 1122869052 /nfs/dbraw/zinc/86/90/52/1122869052.db2.gz PPQLWUBBRQWZDY-UHFFFAOYSA-N 1 0 275.392 3.698 20 10 CHCDRO COc1ccc(N(C)CC[N@H+](C)C[C@@H](C)CC(C)C)cc1 ZINC001195791179 1122889125 /nfs/dbraw/zinc/88/91/25/1122889125.db2.gz YJIWSMMDIGNSNC-INIZCTEOSA-N 1 0 292.467 3.745 20 10 CHCDRO CCCC[N@H+](Cc1[nH]nc(C)c1C)Cc1ccccc1O ZINC000894678442 1122890280 /nfs/dbraw/zinc/89/02/80/1122890280.db2.gz BLQJLNCBUKAEAF-UHFFFAOYSA-N 1 0 287.407 3.534 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCc3cccc(F)c3[C@@H]2C)c1O ZINC000775700264 1122911724 /nfs/dbraw/zinc/91/17/24/1122911724.db2.gz LYDOXGQIHSVYJJ-ZDUSSCGKSA-N 1 0 285.362 3.959 20 10 CHCDRO Cc1cccc(C[N@H+]2Cc3ccccc3C[C@@H]2C)c1O ZINC000775716072 1122922278 /nfs/dbraw/zinc/92/22/78/1122922278.db2.gz BDMZGDZQEZWERI-AWEZNQCLSA-N 1 0 267.372 3.647 20 10 CHCDRO Cc1cccc(C[N@@H+]2CC[C@@H]2Cc2ccccc2)c1O ZINC000775726505 1122926177 /nfs/dbraw/zinc/92/61/77/1122926177.db2.gz WDGWALTZPWWVSA-QGZVFWFLSA-N 1 0 267.372 3.518 20 10 CHCDRO Cc1ccc(O)c(C[N@H+]2CCC[C@H](C(F)(F)F)[C@H]2C)c1 ZINC000776013695 1123035806 /nfs/dbraw/zinc/03/58/06/1123035806.db2.gz NLMAAOJOKCYSSO-YPMHNXCESA-N 1 0 287.325 3.863 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]CCc1c(F)cccc1F ZINC000776023487 1123040564 /nfs/dbraw/zinc/04/05/64/1123040564.db2.gz NFSHCQPJEUNCBQ-UHFFFAOYSA-N 1 0 297.732 3.656 20 10 CHCDRO COc1cccc(Cl)c1C[NH2+]Cc1cccc(C)c1O ZINC000188280688 1123056189 /nfs/dbraw/zinc/05/61/89/1123056189.db2.gz NESUMDGNYAQKCI-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO Cc1ccc2c(c1)[C@@H]([NH2+]Cc1cc(C)ccc1O)CC2 ZINC000776174348 1123101743 /nfs/dbraw/zinc/10/17/43/1123101743.db2.gz JPCNODCNCDTKCY-KRWDZBQOSA-N 1 0 267.372 3.786 20 10 CHCDRO COc1cccc(C[NH2+][C@H](C)CCC2CCCC2)c1O ZINC000776213325 1123150188 /nfs/dbraw/zinc/15/01/88/1123150188.db2.gz ASGNNRVZSWAHBK-CYBMUJFWSA-N 1 0 277.408 3.849 20 10 CHCDRO CCC(CC)C[NH2+]Cc1cc(Cl)cc(OC)c1O ZINC000169084928 1123158284 /nfs/dbraw/zinc/15/82/84/1123158284.db2.gz SGMLOZJVCATVFO-UHFFFAOYSA-N 1 0 271.788 3.580 20 10 CHCDRO CC(C)[NH+](CCCNCc1c(O)cccc1Cl)C(C)C ZINC000776233042 1123172203 /nfs/dbraw/zinc/17/22/03/1123172203.db2.gz XSNUQUFJVOJIAU-UHFFFAOYSA-N 1 0 298.858 3.644 20 10 CHCDRO Cc1cccc2[nH]c(C[NH2+]Cc3ccc(N(C)C)cc3)cc21 ZINC000850010887 1123237099 /nfs/dbraw/zinc/23/70/99/1123237099.db2.gz IFHNETZZEYFCTQ-UHFFFAOYSA-N 1 0 293.414 3.832 20 10 CHCDRO C[C@@H](C[NH2+]C/C=C/c1ccc(N(C)C)cc1)c1ccccn1 ZINC000850342300 1123254811 /nfs/dbraw/zinc/25/48/11/1123254811.db2.gz KPLTVXCSSJGUKU-MOEXGYKKSA-N 1 0 295.430 3.554 20 10 CHCDRO CCOCc1cc(C[NH2+][C@@](C)(CC)C2CC2)ccc1OC ZINC000850384527 1123261061 /nfs/dbraw/zinc/26/10/61/1123261061.db2.gz WNMCMRHMSKSSRH-SFHVURJKSA-N 1 0 291.435 3.900 20 10 CHCDRO CCSC1(C[NH2+]C/C=C\c2ccc(N(C)C)cc2)CC1 ZINC000850394303 1123262037 /nfs/dbraw/zinc/26/20/37/1123262037.db2.gz PFLJRYPSZCSRRD-WAYWQWQTSA-N 1 0 290.476 3.641 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H](C)C2CCC(F)CC2)c1 ZINC000850396091 1123262789 /nfs/dbraw/zinc/26/27/89/1123262789.db2.gz PEXLBNHRLCLYNS-OPFPJEHXSA-N 1 0 265.372 3.707 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CCCc2ccco2)c(Cl)c1 ZINC000850407608 1123263766 /nfs/dbraw/zinc/26/37/66/1123263766.db2.gz KYZOMCAQYRTBTL-UHFFFAOYSA-N 1 0 279.767 3.669 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H]2[C@@H]3Cc4cc(F)ccc4[C@@H]32)cc1C ZINC000850409150 1123264082 /nfs/dbraw/zinc/26/40/82/1123264082.db2.gz MJEDSIJZGOCTDT-NZSAHSFTSA-N 1 0 297.373 3.576 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)c2cc3cnccc3o2)cc1C ZINC000850430835 1123266121 /nfs/dbraw/zinc/26/61/21/1123266121.db2.gz VFEDPZPSJACJSC-ZDUSSCGKSA-N 1 0 296.370 3.996 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCc2noc3ccccc23)c1 ZINC000850482623 1123273104 /nfs/dbraw/zinc/27/31/04/1123273104.db2.gz KPOOFNPFPLUTBO-ZDUSSCGKSA-N 1 0 296.370 3.735 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCc2noc3ccccc23)c(O)c1 ZINC000850483689 1123274512 /nfs/dbraw/zinc/27/45/12/1123274512.db2.gz QYOFOSOHTGUBRZ-ZDUSSCGKSA-N 1 0 296.370 3.735 20 10 CHCDRO CC[C@H](COCC1CC1)[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000850492250 1123274591 /nfs/dbraw/zinc/27/45/91/1123274591.db2.gz CFCMKAQSEYPUDQ-BXUZGUMPSA-N 1 0 297.826 3.901 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2C=CCC2)c1O ZINC000850506963 1123277099 /nfs/dbraw/zinc/27/70/99/1123277099.db2.gz HCBSXVSUEPAWLJ-CMPLNLGQSA-N 1 0 251.757 3.723 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CCc2cnccc2C)cc1 ZINC000850507990 1123277355 /nfs/dbraw/zinc/27/73/55/1123277355.db2.gz QONRDIDBPSSUIA-INIZCTEOSA-N 1 0 297.446 3.739 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2cscn2)c(O)c1C ZINC000850511502 1123277757 /nfs/dbraw/zinc/27/77/57/1123277757.db2.gz GTUZBSLCDNCBRM-VXGBXAGGSA-N 1 0 276.405 3.877 20 10 CHCDRO Cc1cc(Br)cc([C@H](C)[NH2+][C@H]2C=CCC2)c1O ZINC000850510676 1123278348 /nfs/dbraw/zinc/27/83/48/1123278348.db2.gz WEXZPLARJXEVSE-JQWIXIFHSA-N 1 0 296.208 3.832 20 10 CHCDRO CCO[C@H]1C[C@H]([NH2+][C@@H](CC)c2cc(Cl)ccc2O)C1 ZINC000850515530 1123278773 /nfs/dbraw/zinc/27/87/73/1123278773.db2.gz YBLKXNMEQURLDY-OBJOEFQTSA-N 1 0 283.799 3.654 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1COC2(CCC2)C1)c1cc(Cl)ccc1O ZINC000850523337 1123280142 /nfs/dbraw/zinc/28/01/42/1123280142.db2.gz GRWJSSJMLZZKPN-GXTWGEPZSA-N 1 0 295.810 3.798 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1COC2(CCC2)C1)c1ccc(N(C)C)cc1 ZINC000850524298 1123281386 /nfs/dbraw/zinc/28/13/86/1123281386.db2.gz GCKYPRPWEDKZEC-NVXWUHKLSA-N 1 0 288.435 3.505 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCC(C)(C)F)c(O)c1C ZINC000850531904 1123284886 /nfs/dbraw/zinc/28/48/86/1123284886.db2.gz NSLYQDLDSQNZAZ-GFCCVEGCSA-N 1 0 253.361 3.798 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccoc1)c1ccc(C)cc1O ZINC000850532591 1123285750 /nfs/dbraw/zinc/28/57/50/1123285750.db2.gz WFPYLBFMPFZWAM-OAHLLOKOSA-N 1 0 259.349 3.577 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@]2(C)CC2(F)F)cc1 ZINC000850535382 1123287183 /nfs/dbraw/zinc/28/71/83/1123287183.db2.gz VSJOXUNQSPWIQD-WFASDCNBSA-N 1 0 282.378 3.839 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@]2(C)CC2(F)F)c(O)c1C ZINC000850538011 1123288065 /nfs/dbraw/zinc/28/80/65/1123288065.db2.gz ZYGOZQLISMGWJG-SMDDNHRTSA-N 1 0 269.335 3.705 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCc3ccc(O)cc32)c(O)c1 ZINC000850543311 1123289183 /nfs/dbraw/zinc/28/91/83/1123289183.db2.gz HPEUNDOTHRSVMN-YVEFUNNKSA-N 1 0 283.371 3.744 20 10 CHCDRO CCSC1(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)CC1 ZINC000850551795 1123289874 /nfs/dbraw/zinc/28/98/74/1123289874.db2.gz JVIXSFMTDPHUPN-ZDUSSCGKSA-N 1 0 279.449 3.945 20 10 CHCDRO CCSC1(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)CC1 ZINC000850552339 1123289882 /nfs/dbraw/zinc/28/98/82/1123289882.db2.gz MLZORWOVNDGKNC-JQWIXIFHSA-N 1 0 295.423 3.955 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCc2cccc(O)c21)C1CCC(F)CC1 ZINC000850555774 1123291167 /nfs/dbraw/zinc/29/11/67/1123291167.db2.gz QDERRIUOCIIBSI-DGLGBPBLSA-N 1 0 277.383 3.886 20 10 CHCDRO C[C@@H]([NH2+]CC1SCCS1)c1ccc(Cl)cc1O ZINC000850562533 1123292828 /nfs/dbraw/zinc/29/28/28/1123292828.db2.gz WMMZTGACYZBXLT-MRVPVSSYSA-N 1 0 289.853 3.502 20 10 CHCDRO C[C@@H]1C[C@@H]([NH2+]CCCc2ccco2)c2c1c(F)ccc2O ZINC000850570551 1123294264 /nfs/dbraw/zinc/29/42/64/1123294264.db2.gz WDXUNHXUMDJPEC-BXUZGUMPSA-N 1 0 289.350 3.895 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@H]2CCOC2(C)C)c1O ZINC000850570413 1123294576 /nfs/dbraw/zinc/29/45/76/1123294576.db2.gz GYLIRWZCUDAAAC-VXGBXAGGSA-N 1 0 297.826 3.820 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2CCc3c2cccc3F)cc1 ZINC000110058844 1123369006 /nfs/dbraw/zinc/36/90/06/1123369006.db2.gz UKRGETBBQJKFBH-GOSISDBHSA-N 1 0 284.378 3.669 20 10 CHCDRO Oc1ccccc1C[N@@H+](Cc1ccco1)CC1CC=CC1 ZINC000851841694 1123385032 /nfs/dbraw/zinc/38/50/32/1123385032.db2.gz WPZJYOMGEGJYEB-UHFFFAOYSA-N 1 0 283.371 3.954 20 10 CHCDRO CCCC[N@H+](Cc1cccc(F)n1)Cc1ccccc1O ZINC000852018474 1123393010 /nfs/dbraw/zinc/39/30/10/1123393010.db2.gz NITVSGANSYFURF-UHFFFAOYSA-N 1 0 288.366 3.729 20 10 CHCDRO CCCCN1CCCC[C@H]1C[NH2+][C@H](C)c1ccccc1O ZINC000783509871 1123400988 /nfs/dbraw/zinc/40/09/88/1123400988.db2.gz VHMLXFCEYFXTER-CVEARBPZSA-N 1 0 290.451 3.697 20 10 CHCDRO CC(C)n1cc([C@@H](C)[NH2+][C@H](C)c2ccccc2O)cn1 ZINC000783511466 1123407517 /nfs/dbraw/zinc/40/75/17/1123407517.db2.gz ZPCQXKSGOXYMSD-CHWSQXEVSA-N 1 0 273.380 3.581 20 10 CHCDRO CCC[N@H+](Cc1ccccc1O)Cc1ccccc1F ZINC000110738509 1123410528 /nfs/dbraw/zinc/41/05/28/1123410528.db2.gz VNFMOHDGPOQECG-UHFFFAOYSA-N 1 0 273.351 3.944 20 10 CHCDRO CN(C)c1ccc(C[NH2+]CC(C)(C)CC(F)(F)F)cc1 ZINC000853096208 1123423743 /nfs/dbraw/zinc/42/37/43/1123423743.db2.gz SEKJFPHXTQJDFR-UHFFFAOYSA-N 1 0 288.357 3.821 20 10 CHCDRO CC1(C)C[C@]1([NH2+]Cc1ccccc1O)c1ccccc1 ZINC000853091739 1123423903 /nfs/dbraw/zinc/42/39/03/1123423903.db2.gz OYSXGDBHXNRZDW-SFHVURJKSA-N 1 0 267.372 3.807 20 10 CHCDRO c1ccc([C@@H]2C[C@H]2C[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC000111398677 1123442482 /nfs/dbraw/zinc/44/24/82/1123442482.db2.gz KIMHWAMCOSFRCN-ROUUACIJSA-N 1 0 279.383 3.515 20 10 CHCDRO COc1cccc(C[NH2+][C@@H]2CCC[C@H]2c2ccccc2)c1O ZINC000111413014 1123444064 /nfs/dbraw/zinc/44/40/64/1123444064.db2.gz FBEXTOMGGBZFDI-DLBZAZTESA-N 1 0 297.398 3.827 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)CCc2ccc(O)cc2)cc1C ZINC000237258334 1123460196 /nfs/dbraw/zinc/46/01/96/1123460196.db2.gz FWDXOLXRPHGQOD-HNNXBMFYSA-N 1 0 299.414 3.820 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCc3cc(N)ccc32)c(O)c1C ZINC000854226134 1123478042 /nfs/dbraw/zinc/47/80/42/1123478042.db2.gz OMRMZVDFRFTSEU-SCLBCKFNSA-N 1 0 296.414 3.929 20 10 CHCDRO C[C@H]([NH2+]Cc1cccc2c1NCCC2)c1ccccc1O ZINC000895459778 1123482126 /nfs/dbraw/zinc/48/21/26/1123482126.db2.gz IJDCXNHUAADCFK-ZDUSSCGKSA-N 1 0 282.387 3.601 20 10 CHCDRO COc1cc(C)cc(C[NH2+]CC[C@H]2CCCC2(F)F)c1O ZINC000895544820 1123489922 /nfs/dbraw/zinc/48/99/22/1123489922.db2.gz NXMJKYLCGGXUAM-CYBMUJFWSA-N 1 0 299.361 3.624 20 10 CHCDRO CC[C@@H]1CCC[N@@H+]1Cc1c(O)ccc2ccccc21 ZINC000112465874 1123491631 /nfs/dbraw/zinc/49/16/31/1123491631.db2.gz KVAQZXRDXZYTRO-CQSZACIVSA-N 1 0 255.361 3.920 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(Cl)c(C)cc1O)[C@@H]1CCCOC1 ZINC000895664130 1123503384 /nfs/dbraw/zinc/50/33/84/1123503384.db2.gz PWMSNOHNLNHQNW-DOMZBBRYSA-N 1 0 297.826 3.649 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2CCc3ccccc32)cc1F ZINC000113316564 1123518367 /nfs/dbraw/zinc/51/83/67/1123518367.db2.gz NWJKITWQCPYSQV-QGZVFWFLSA-N 1 0 284.378 3.669 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1O)[C@H]1COc2ccccc2C1 ZINC000895851041 1123521546 /nfs/dbraw/zinc/52/15/46/1123521546.db2.gz IIJUPZQVTPKIFR-IJEWVQPXSA-N 1 0 297.398 3.683 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C[C@H]2CCc3ccccc32)c1 ZINC000113340936 1123522015 /nfs/dbraw/zinc/52/20/15/1123522015.db2.gz ALPLYARYPBPHAQ-OAHLLOKOSA-N 1 0 267.372 3.520 20 10 CHCDRO COc1ccc(F)c(C[NH2+][C@@H](C)c2cc(F)ccc2O)c1 ZINC000857082529 1123585599 /nfs/dbraw/zinc/58/55/99/1123585599.db2.gz WXHWCBYUUCREJM-JTQLQIEISA-N 1 0 293.313 3.530 20 10 CHCDRO C[N@H+](Cc1sccc1Cl)Cc1ccccc1O ZINC000194345426 1129133472 /nfs/dbraw/zinc/13/34/72/1129133472.db2.gz ACBZFHAJXLGNSB-UHFFFAOYSA-N 1 0 267.781 3.739 20 10 CHCDRO COc1ccc([C@H](C)[NH2+]Cc2ccc(C)cc2O)cc1C ZINC000896802860 1123628668 /nfs/dbraw/zinc/62/86/68/1123628668.db2.gz DTTYTZVDEREWJN-AWEZNQCLSA-N 1 0 285.387 3.868 20 10 CHCDRO Cc1ccccc1C[NH2+]Cc1cc(F)c(N(C)C)cc1F ZINC000858088233 1123630122 /nfs/dbraw/zinc/63/01/22/1123630122.db2.gz VUPSHZZFNDGDJY-UHFFFAOYSA-N 1 0 290.357 3.629 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2cc(F)c(N(C)C)cc2F)s1 ZINC000858098447 1123631083 /nfs/dbraw/zinc/63/10/83/1123631083.db2.gz MFYDKMXKYOZCKP-UHFFFAOYSA-N 1 0 296.386 3.691 20 10 CHCDRO COc1ccc(C[NH2+]Cc2cc(C)ccc2O)c(Cl)c1 ZINC000858237373 1123639107 /nfs/dbraw/zinc/63/91/07/1123639107.db2.gz LELZOJSIYIWELU-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO CCC(F)(F)C(C)(C)C[NH2+]Cc1c(O)cccc1OC ZINC000858271008 1123641691 /nfs/dbraw/zinc/64/16/91/1123641691.db2.gz SZTGVFMYNITJKG-UHFFFAOYSA-N 1 0 287.350 3.562 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)c1cc(Cl)ccc1O)c1ccns1 ZINC000858577896 1123665095 /nfs/dbraw/zinc/66/50/95/1123665095.db2.gz SEIHRKBYSSUFOR-IUCAKERBSA-N 1 0 282.796 3.914 20 10 CHCDRO C[N@H+](Cc1ccc(C(F)F)cc1)Cc1ccccc1O ZINC000183967518 1129137325 /nfs/dbraw/zinc/13/73/25/1129137325.db2.gz WTMSWSLAGAHZBA-UHFFFAOYSA-N 1 0 277.314 3.962 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc(O)ccc1Cl)c1ccccc1O ZINC000859233313 1123691875 /nfs/dbraw/zinc/69/18/75/1123691875.db2.gz QZQHVWRWNJSFPQ-OAHLLOKOSA-N 1 0 291.778 3.992 20 10 CHCDRO CS[C@@H]1CCC[C@H]([NH2+]Cc2ccc(N(C)C)cc2)C1 ZINC000117394264 1123728682 /nfs/dbraw/zinc/72/86/82/1123728682.db2.gz CTXYTDAIMFVXEK-GOEBONIOSA-N 1 0 278.465 3.516 20 10 CHCDRO COc1ccc(O)c(C[NH2+]Cc2ccc(C)c(Cl)c2)c1 ZINC000195443238 1129145490 /nfs/dbraw/zinc/14/54/90/1129145490.db2.gz WXKBTORHURCIMT-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2cc(Cl)cc(C)c2O)c1 ZINC000862475924 1123812443 /nfs/dbraw/zinc/81/24/43/1123812443.db2.gz BWLMHBAVQRNESM-UHFFFAOYSA-N 1 0 291.778 3.658 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2cc(Cl)c(C)cc2O)c1 ZINC000862478635 1123812511 /nfs/dbraw/zinc/81/25/11/1123812511.db2.gz KMIMNIGUFYEQKB-UHFFFAOYSA-N 1 0 291.778 3.658 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H]2CS[C@H](C(C)(C)C)C2)c1 ZINC000862478477 1123813414 /nfs/dbraw/zinc/81/34/14/1123813414.db2.gz HYWJDXHLJJPRMC-HIFRSBDPSA-N 1 0 279.449 3.710 20 10 CHCDRO Cc1cc(O)c(C[NH+]2CC(Cc3cccs3)C2)cc1C ZINC000862538081 1123816698 /nfs/dbraw/zinc/81/66/98/1123816698.db2.gz MGEWKIYDWOUOBL-UHFFFAOYSA-N 1 0 287.428 3.745 20 10 CHCDRO CCc1cccc(C[N@@H+]2CC[C@H](c3ccc(O)cc3)C2)c1O ZINC000862541223 1123818354 /nfs/dbraw/zinc/81/83/54/1123818354.db2.gz QZCHBXLLHUKVQF-INIZCTEOSA-N 1 0 297.398 3.650 20 10 CHCDRO Oc1ccccc1CNc1ccc(C[NH+]2CCCCC2)cc1 ZINC000076262609 1129149404 /nfs/dbraw/zinc/14/94/04/1129149404.db2.gz VGFJWYBFHHVADC-UHFFFAOYSA-N 1 0 296.414 3.990 20 10 CHCDRO COc1ccc(C[NH2+]CCc2ccc(C)cc2)cc1C ZINC000083514829 1129150137 /nfs/dbraw/zinc/15/01/37/1129150137.db2.gz ZXZPJACLHYGWBR-UHFFFAOYSA-N 1 0 269.388 3.644 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@H]2C[C@H](C)O[C@H]2C)c1O ZINC000840872991 1123870699 /nfs/dbraw/zinc/87/06/99/1123870699.db2.gz OTNKXXFAVLSNPF-CYDGBPFRSA-N 1 0 297.826 3.818 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1COc2ccccc2C1)c1ccc(C)cc1O ZINC000794802504 1123950335 /nfs/dbraw/zinc/95/03/35/1123950335.db2.gz FVTYRDCTIWFCSQ-NVXWUHKLSA-N 1 0 297.398 3.745 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](C)N1CCCCC1)c1ccc(C)cc1O ZINC000794798641 1123950341 /nfs/dbraw/zinc/95/03/41/1123950341.db2.gz XNKVGSIDHHKRGE-RDJZCZTQSA-N 1 0 290.451 3.616 20 10 CHCDRO CC[C@@H]([NH2+]CC1(O)CCCCCC1)c1ccc(C)cc1O ZINC000794801043 1123950494 /nfs/dbraw/zinc/95/04/94/1123950494.db2.gz HSSLBUVGKDMPFZ-MRXNPFEDSA-N 1 0 291.435 3.827 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccc(C)cc1O ZINC000794803387 1123953148 /nfs/dbraw/zinc/95/31/48/1123953148.db2.gz ISFWJQQZUHGAIK-QGZVFWFLSA-N 1 0 297.398 3.876 20 10 CHCDRO CC[C@H](C[C@H](C)CO)[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000794803674 1123954069 /nfs/dbraw/zinc/95/40/69/1123954069.db2.gz ROHLLAQICFWWSD-LZWOXQAQSA-N 1 0 279.424 3.538 20 10 CHCDRO CC[C@@H]([NH2+]CCNc1ccccc1)c1ccc(C)cc1O ZINC000794808346 1123954656 /nfs/dbraw/zinc/95/46/56/1123954656.db2.gz ADUOYLZAWURUMX-QGZVFWFLSA-N 1 0 284.403 3.853 20 10 CHCDRO CC[C@H]([NH2+]C1C[C@@H](C)O[C@H](C)C1)c1ccc(C)cc1O ZINC000794814333 1123957191 /nfs/dbraw/zinc/95/71/91/1123957191.db2.gz CYMNHXYNXDRQSJ-IOASZLSFSA-N 1 0 277.408 3.697 20 10 CHCDRO CCC(CC)[C@H](O)C[NH2+][C@H](CC)c1ccc(C)cc1O ZINC000794809112 1123957542 /nfs/dbraw/zinc/95/75/42/1123957542.db2.gz QJILAAXDZXXUAD-NVXWUHKLSA-N 1 0 279.424 3.538 20 10 CHCDRO CC[C@H]([NH2+]Cc1cncc(C)c1)c1ccc(C)cc1O ZINC000794815303 1123957965 /nfs/dbraw/zinc/95/79/65/1123957965.db2.gz JUIVHCWKSQSWII-INIZCTEOSA-N 1 0 270.376 3.645 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)C[C@@H]1CCOC1)c1ccc(C)cc1O ZINC000794811920 1123959458 /nfs/dbraw/zinc/95/94/58/1123959458.db2.gz UTNHRGDYIKGPQR-DZKIICNBSA-N 1 0 277.408 3.556 20 10 CHCDRO CC[C@@H]([NH2+][C@H](CO)CC(C)(C)C)c1ccc(C)cc1O ZINC000794818328 1123959722 /nfs/dbraw/zinc/95/97/22/1123959722.db2.gz RVUKBZYAEOYGAK-DZGCQCFKSA-N 1 0 279.424 3.538 20 10 CHCDRO CC[C@H]1CCC[C@@H]([NH2+]Cc2ccc3c(c2)CCO3)C1 ZINC000085064335 1129156131 /nfs/dbraw/zinc/15/61/31/1129156131.db2.gz HFNYRIQITCQIHP-XJKSGUPXSA-N 1 0 259.393 3.680 20 10 CHCDRO C[C@@H]([NH2+]CCC1(C)CC1)c1ccc(Br)cc1O ZINC000794829997 1123962135 /nfs/dbraw/zinc/96/21/35/1123962135.db2.gz XEYJUBQPKKBKLX-SNVBAGLBSA-N 1 0 298.224 3.996 20 10 CHCDRO COC1(C[NH2+][C@H](C)c2ccc(C)cc2O)CCC(C)CC1 ZINC000794834342 1123970668 /nfs/dbraw/zinc/97/06/68/1123970668.db2.gz MWWIAJBZMQMCAL-NSWWBONSSA-N 1 0 291.435 3.947 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]Cc2cccnc2F)cc1 ZINC000794837846 1123981078 /nfs/dbraw/zinc/98/10/78/1123981078.db2.gz VWDCIBHLFUVFSD-ZDUSSCGKSA-N 1 0 287.382 3.528 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](C)Cc2cc(Cl)cn2C)cc1C ZINC000121003193 1124053362 /nfs/dbraw/zinc/05/33/62/1124053362.db2.gz NMJNEDUUSCSSTN-UHFFFAOYSA-N 1 0 292.810 3.633 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+]CC[C@H]2CCSC2)c2c1c(F)ccc2O ZINC000866402377 1124063152 /nfs/dbraw/zinc/06/31/52/1124063152.db2.gz JQWUGAGBTGJQLZ-MDZLAQPJSA-N 1 0 295.423 3.812 20 10 CHCDRO Cc1ncc([C@H](C)[NH2+][C@H](C)c2ccc(C)cc2O)s1 ZINC000866454571 1124067903 /nfs/dbraw/zinc/06/79/03/1124067903.db2.gz CXVJUBLFQZMYQJ-MNOVXSKESA-N 1 0 276.405 3.877 20 10 CHCDRO Cc1ncc([C@@H](C)[NH2+][C@H](C)c2ccc(C)cc2O)s1 ZINC000866454570 1124067977 /nfs/dbraw/zinc/06/79/77/1124067977.db2.gz CXVJUBLFQZMYQJ-GHMZBOCLSA-N 1 0 276.405 3.877 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(C)o1)c1ccc(N(C)C)cc1 ZINC000866479619 1124070681 /nfs/dbraw/zinc/07/06/81/1124070681.db2.gz XQWPYSYEIQOVCN-KRWDZBQOSA-N 1 0 272.392 3.895 20 10 CHCDRO C[C@H]([NH2+][C@@H](C1CCC1)[C@H]1CCCO1)c1cc(F)ccc1O ZINC000866491473 1124072975 /nfs/dbraw/zinc/07/29/75/1124072975.db2.gz RWQGTOCNMZXTJZ-JECHBYEQSA-N 1 0 293.382 3.530 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1C[C@H]1C(F)(F)F)c1ccc(C)cc1O ZINC000866501263 1124073711 /nfs/dbraw/zinc/07/37/11/1124073711.db2.gz ZXIWPSHZNFOGFS-GRYCIOLGSA-N 1 0 273.298 3.692 20 10 CHCDRO CC[C@@H]([NH2+]CCC(C)(C)OC)c1ccc(C)cc1O ZINC000866505541 1124074108 /nfs/dbraw/zinc/07/41/08/1124074108.db2.gz OBLKAQWOEPNSGE-CQSZACIVSA-N 1 0 265.397 3.556 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](C2CCC2)[C@@H]2CCOC2)c(O)c1 ZINC000866513010 1124075883 /nfs/dbraw/zinc/07/58/83/1124075883.db2.gz RADDFZCHHPJQLN-JOQOYGCGSA-N 1 0 289.419 3.556 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1CCC12CCOCC2)c1ccccc1O ZINC000866528947 1124078251 /nfs/dbraw/zinc/07/82/51/1124078251.db2.gz KVBGSSJPSRJZDH-GDBMZVCRSA-N 1 0 289.419 3.640 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2c3ccccc3CN2C)c1 ZINC000866564455 1124083336 /nfs/dbraw/zinc/08/33/36/1124083336.db2.gz VPFVXIJHIYTZCQ-RDTXWAMCSA-N 1 0 296.414 3.538 20 10 CHCDRO C[C@H]([NH2+][C@@H](CF)c1ccc(F)cc1)c1ccccc1O ZINC000866597212 1124086073 /nfs/dbraw/zinc/08/60/73/1124086073.db2.gz ZDVBBEOXCJWVFN-NHYWBVRUSA-N 1 0 277.314 3.893 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1ccnn1C)c1cc(Cl)ccc1O ZINC000866613876 1124088362 /nfs/dbraw/zinc/08/83/62/1124088362.db2.gz JRXYJMDZQTZVEH-MFKMUULPSA-N 1 0 293.798 3.581 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1ccnn1C)c1cc(Cl)ccc1O ZINC000866613875 1124088889 /nfs/dbraw/zinc/08/88/89/1124088889.db2.gz JRXYJMDZQTZVEH-GXFFZTMASA-N 1 0 293.798 3.581 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H]2CCCn3nccc32)cc1 ZINC000866633495 1124092395 /nfs/dbraw/zinc/09/23/95/1124092395.db2.gz WCIBVSLPOCIBLJ-WMLDXEAASA-N 1 0 298.434 3.525 20 10 CHCDRO CCCC[C@H]1CCC[C@@H]1[NH2+]CCc1ccc(N)cc1 ZINC000841035852 1124110905 /nfs/dbraw/zinc/11/09/05/1124110905.db2.gz PLLVPLNBNDLLSF-RDJZCZTQSA-N 1 0 260.425 3.760 20 10 CHCDRO CCC[C@@H]1CCCC[N@@H+]1Cc1cc(OC)c(OC)cc1O ZINC000184232639 1129178094 /nfs/dbraw/zinc/17/80/94/1129178094.db2.gz WDNHNJAAKHGTPS-CQSZACIVSA-N 1 0 293.407 3.564 20 10 CHCDRO C[C@@H]([NH2+]C1CCC2(CCCO2)CC1)c1ccccc1O ZINC001119247958 1131247980 /nfs/dbraw/zinc/24/79/80/1131247980.db2.gz BDKMFWXDTMAMHI-TUBUQKNSSA-N 1 0 275.392 3.535 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccccc1O)c1cccc(F)c1F ZINC000121930189 1124450635 /nfs/dbraw/zinc/45/06/35/1124450635.db2.gz JQIPBZBZWYQULN-SNVBAGLBSA-N 1 0 263.287 3.521 20 10 CHCDRO FC(F)CCC[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC001119678986 1131261954 /nfs/dbraw/zinc/26/19/54/1131261954.db2.gz VYGCSECJAVQZFG-UHFFFAOYSA-N 1 0 282.378 3.812 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCc2ccc(F)cc21 ZINC000122741045 1124529335 /nfs/dbraw/zinc/52/93/35/1124529335.db2.gz MJEQAKRKYKBLIK-LJQANCHMSA-N 1 0 298.405 3.977 20 10 CHCDRO C/C(Cl)=C\C[N@@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000528419750 1124658441 /nfs/dbraw/zinc/65/84/41/1124658441.db2.gz PGNBAEAHRIIZQO-NRUITVPNSA-N 1 0 295.810 3.516 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1C[C@@H]2CCC[C@H]2O1)c1ccc(Cl)cc1O ZINC000872108973 1124685298 /nfs/dbraw/zinc/68/52/98/1124685298.db2.gz ZORNIJYGFAYDPJ-XALPAYFRSA-N 1 0 295.810 3.654 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2C[C@@H]3CCC[C@H]3O2)c(O)c1C ZINC000872109333 1124686092 /nfs/dbraw/zinc/68/60/92/1124686092.db2.gz LMEUYRBBZIUGSL-QBYUYEEZSA-N 1 0 289.419 3.617 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1C[C@@H]2CCC[C@H]2O1)c1cc(Cl)ccc1O ZINC000872110043 1124686393 /nfs/dbraw/zinc/68/63/93/1124686393.db2.gz VJWXYKSLFAAPAA-XALPAYFRSA-N 1 0 295.810 3.654 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H](C)Cc1ccoc1 ZINC000449294073 1124689610 /nfs/dbraw/zinc/68/96/10/1124689610.db2.gz KFBSMYHSIJAFQA-CYBMUJFWSA-N 1 0 282.387 3.801 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1nccnc1C)c1ccc(N(C)C)cc1 ZINC000872135041 1124693397 /nfs/dbraw/zinc/69/33/97/1124693397.db2.gz UUKZYYPWJJBMEO-YOEHRIQHSA-N 1 0 298.434 3.653 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1nccnc1C)c1ccc(N(C)C)cc1 ZINC000872135039 1124694054 /nfs/dbraw/zinc/69/40/54/1124694054.db2.gz UUKZYYPWJJBMEO-WMLDXEAASA-N 1 0 298.434 3.653 20 10 CHCDRO CCC[N@H+](Cc1nc2ccccc2[nH]1)Cc1ccccc1O ZINC000124041784 1124704729 /nfs/dbraw/zinc/70/47/29/1124704729.db2.gz XFPNHRWWYMVDFC-UHFFFAOYSA-N 1 0 295.386 3.681 20 10 CHCDRO CCCOc1ccc(C[NH2+]CCc2cscn2)cc1C ZINC000873054640 1124736987 /nfs/dbraw/zinc/73/69/87/1124736987.db2.gz RDSXCBNRXCOVDQ-UHFFFAOYSA-N 1 0 290.432 3.573 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CC[C@H](C[NH3+])CC1)c1cccc(Cl)c1[O-] ZINC000873239101 1124754935 /nfs/dbraw/zinc/75/49/35/1124754935.db2.gz NUNYSFPKJZAGND-HUBLWGQQSA-N 1 0 296.842 3.604 20 10 CHCDRO C[C@H]([NH2+]CCCN(C)c1ccccc1)c1ccccc1O ZINC000019906528 1124768291 /nfs/dbraw/zinc/76/82/91/1124768291.db2.gz ANAOUOZTLLFAPH-HNNXBMFYSA-N 1 0 284.403 3.569 20 10 CHCDRO Cc1cccc(C[NH2+]CCSc2ccccc2)c1O ZINC000124670066 1124803520 /nfs/dbraw/zinc/80/35/20/1124803520.db2.gz RFYRSEUVJULQQQ-UHFFFAOYSA-N 1 0 273.401 3.583 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2ccc(F)cc2)c1 ZINC000020095659 1124805190 /nfs/dbraw/zinc/80/51/90/1124805190.db2.gz KNLOQMIBPZDQRL-NEPJUHHUSA-N 1 0 289.350 3.952 20 10 CHCDRO CCOc1cccc(C[NH2+][C@H](C)CCC(C)C)c1O ZINC000020122909 1124806505 /nfs/dbraw/zinc/80/65/05/1124806505.db2.gz ZQHOKDOTQSOTBH-CYBMUJFWSA-N 1 0 265.397 3.705 20 10 CHCDRO CSC1(C[NH2+]Cc2cc(Cl)c(C)cc2O)CCC1 ZINC000825726059 1124831873 /nfs/dbraw/zinc/83/18/73/1124831873.db2.gz DPRMRANNBFNUPY-UHFFFAOYSA-N 1 0 285.840 3.729 20 10 CHCDRO C[C@H]([NH2+]CCCOC1CCCC1)c1ccc(N(C)C)cc1 ZINC000125250380 1124877083 /nfs/dbraw/zinc/87/70/83/1124877083.db2.gz GOARXOXYIXLFFV-HNNXBMFYSA-N 1 0 290.451 3.753 20 10 CHCDRO CC[C@H]([NH2+]CC1(N(C)C)CCCCC1)c1ccccc1O ZINC000021040213 1124893521 /nfs/dbraw/zinc/89/35/21/1124893521.db2.gz QNMFERXWYYCNCG-INIZCTEOSA-N 1 0 290.451 3.697 20 10 CHCDRO CC(C)[N@H+](CCC[C@@H]1CCO1)Cc1ccc(N(C)C)cc1 ZINC000876584718 1124964843 /nfs/dbraw/zinc/96/48/43/1124964843.db2.gz NFGAIXHXGAXRNI-GOSISDBHSA-N 1 0 290.451 3.532 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H]2COc3c2ccc(C)c3C)c(O)c1 ZINC000876876777 1124987081 /nfs/dbraw/zinc/98/70/81/1124987081.db2.gz UQCCKGXOSDHGBP-MRXNPFEDSA-N 1 0 283.371 3.541 20 10 CHCDRO CCOc1ccc([C@H](C)[NH2+]Cc2ccc(C)cc2O)cc1 ZINC000876908088 1124989788 /nfs/dbraw/zinc/98/97/88/1124989788.db2.gz ZGAJFDIGPMTPPP-AWEZNQCLSA-N 1 0 285.387 3.950 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2ccccc2OC(F)F)c(O)c1 ZINC000876909797 1124990089 /nfs/dbraw/zinc/99/00/89/1124990089.db2.gz IINTUTIPGKXBQX-UHFFFAOYSA-N 1 0 293.313 3.592 20 10 CHCDRO COc1ccc([C@@H](C)[NH2+]Cc2ccc(C)cc2O)cc1 ZINC000876988321 1124995128 /nfs/dbraw/zinc/99/51/28/1124995128.db2.gz BUKPFBCNDVMXTD-CYBMUJFWSA-N 1 0 271.360 3.560 20 10 CHCDRO CC[C@](C)([NH2+]Cc1ccc(C)cc1O)c1nc(C)cs1 ZINC000877045485 1125001364 /nfs/dbraw/zinc/00/13/64/1125001364.db2.gz XBHLWAHENHFZGB-INIZCTEOSA-N 1 0 290.432 3.881 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]C[C@@H]1CCCO[C@H]1C(C)(C)C ZINC000877038842 1125001791 /nfs/dbraw/zinc/00/17/91/1125001791.db2.gz ZGROBPVXOFXJOQ-WMLDXEAASA-N 1 0 291.435 3.632 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H]2CCCc3sccc32)c(O)c1 ZINC000877388180 1125026739 /nfs/dbraw/zinc/02/67/39/1125026739.db2.gz XAKHVXDOAADHSE-CQSZACIVSA-N 1 0 273.401 3.929 20 10 CHCDRO Cc1ccoc1C[NH2+]Cc1cc(Cl)c(C)cc1O ZINC000825975144 1125035780 /nfs/dbraw/zinc/03/57/80/1125035780.db2.gz KKRPZIMPXUNVCR-UHFFFAOYSA-N 1 0 265.740 3.545 20 10 CHCDRO CC(C)[C@H]1C[C@@H]([NH2+][C@H](C)c2ccccc2O)CS1 ZINC000877755648 1125072003 /nfs/dbraw/zinc/07/20/03/1125072003.db2.gz JRPUOBGIXFNZLH-LALPHHSUSA-N 1 0 265.422 3.573 20 10 CHCDRO C[C@@H]([NH2+]Cc1cnc(C(C)(C)C)s1)c1ccccc1O ZINC000877756505 1125072106 /nfs/dbraw/zinc/07/21/06/1125072106.db2.gz NTHLNUSEAJRALV-LLVKDONJSA-N 1 0 290.432 3.997 20 10 CHCDRO CC(C)[C@H]1C[C@H]([NH2+][C@H](C)c2ccccc2O)CS1 ZINC000877755649 1125072160 /nfs/dbraw/zinc/07/21/60/1125072160.db2.gz JRPUOBGIXFNZLH-TYNCELHUSA-N 1 0 265.422 3.573 20 10 CHCDRO CO[C@@H](c1ccccc1)[C@H](C)[NH2+][C@@H](C)c1ccccc1O ZINC000877758246 1125073815 /nfs/dbraw/zinc/07/38/15/1125073815.db2.gz PBHIDNUGCHXHRW-SUNYJGFJSA-N 1 0 285.387 3.819 20 10 CHCDRO C[C@H]([NH2+]Cc1cnc(C(C)(C)C)s1)c1ccccc1O ZINC000877757205 1125074115 /nfs/dbraw/zinc/07/41/15/1125074115.db2.gz NTHLNUSEAJRALV-NSHDSACASA-N 1 0 290.432 3.997 20 10 CHCDRO C[C@H](CCC(F)(F)F)[NH2+][C@@H](C)c1ccccc1O ZINC000877757141 1125074718 /nfs/dbraw/zinc/07/47/18/1125074718.db2.gz IUYDFVRXPOUCER-ZJUUUORDSA-N 1 0 261.287 3.774 20 10 CHCDRO Cc1cc(C[NH2+][C@@H](C)c2ccccc2O)cnc1Cl ZINC000877757181 1125075280 /nfs/dbraw/zinc/07/52/80/1125075280.db2.gz LWRXEIFXVRVBAI-NSHDSACASA-N 1 0 276.767 3.600 20 10 CHCDRO COc1cc(C[N@@H+]2CC[C@H]2C2CC2)c(O)c(C(C)(C)C)c1 ZINC000826043625 1125158265 /nfs/dbraw/zinc/15/82/65/1125158265.db2.gz MSTUQJHWBQESRC-INIZCTEOSA-N 1 0 289.419 3.683 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@@H]2CCCC2(F)F)cc1Cl ZINC000826061869 1125167797 /nfs/dbraw/zinc/16/77/97/1125167797.db2.gz FAQJAVXXQNCMMZ-NSHDSACASA-N 1 0 289.753 3.879 20 10 CHCDRO CO[C@@H]1CC[N@H+](Cc2cc(Cl)c(C)cc2O)CC1(C)C ZINC000826062421 1125168700 /nfs/dbraw/zinc/16/87/00/1125168700.db2.gz RIIXKFIENOMBCO-OAHLLOKOSA-N 1 0 297.826 3.601 20 10 CHCDRO COc1cncc(/C=C\CC[NH2+][C@H](C)c2ccccc2O)c1 ZINC000879648914 1125222253 /nfs/dbraw/zinc/22/22/53/1125222253.db2.gz GBZMMWAWEBULFB-BRLPQQTGSA-N 1 0 298.386 3.550 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccccc1OC1CC1)c1ccccc1O ZINC000879648888 1125222761 /nfs/dbraw/zinc/22/27/61/1125222761.db2.gz FDZZRRFTQJOJQF-CYBMUJFWSA-N 1 0 283.371 3.784 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]CC2(C)CCCC2)c1O ZINC000228673996 1125250695 /nfs/dbraw/zinc/25/06/95/1125250695.db2.gz SAOVJVLWPHWGFU-UHFFFAOYSA-N 1 0 283.799 3.724 20 10 CHCDRO C[N@H+](Cc1cc2c(cc1O)OCO2)C1CCC(C)(C)CC1 ZINC000211304086 1125300186 /nfs/dbraw/zinc/30/01/86/1125300186.db2.gz DPSDWAAPBHYZIW-UHFFFAOYSA-N 1 0 291.391 3.522 20 10 CHCDRO COc1ccc(C2CC2)cc1C[NH2+]Cc1ccccc1O ZINC000883258692 1125386704 /nfs/dbraw/zinc/38/67/04/1125386704.db2.gz LKRYFZCPKIKKNW-UHFFFAOYSA-N 1 0 283.371 3.568 20 10 CHCDRO CCOc1ccc(C[NH2+]CC[C@@H]2CCCC2(F)F)c(O)c1 ZINC000883265638 1125388807 /nfs/dbraw/zinc/38/88/07/1125388807.db2.gz HCFBOIVPZPNWLS-ZDUSSCGKSA-N 1 0 299.361 3.706 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2cc(C)c(C)cc2O)c(Cl)n1 ZINC000883292547 1125392218 /nfs/dbraw/zinc/39/22/18/1125392218.db2.gz RDQJPVMYMARHIO-UHFFFAOYSA-N 1 0 290.794 3.656 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1C[C@@H](COC)C1)c1cc(Cl)ccc1O ZINC000883319425 1125395623 /nfs/dbraw/zinc/39/56/23/1125395623.db2.gz BIDNMOBSGIHWET-SCDSUCTJSA-N 1 0 283.799 3.511 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2cc(O)ccc2Cl)c(O)c1 ZINC000883325657 1125397374 /nfs/dbraw/zinc/39/73/74/1125397374.db2.gz HRBSXCQRSMKKDC-NSHDSACASA-N 1 0 291.778 3.910 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1ccc(C)c(C)c1O)[C@H]1CCCOC1 ZINC000883351893 1125399055 /nfs/dbraw/zinc/39/90/55/1125399055.db2.gz NYPAGTPCSQMZEL-ZOBUZTSGSA-N 1 0 291.435 3.865 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1cc(Cl)ccc1O)[C@H]1CCCOC1 ZINC000883353587 1125400160 /nfs/dbraw/zinc/40/01/60/1125400160.db2.gz XXEWIPKXASMTEJ-XUJVJEKNSA-N 1 0 297.826 3.901 20 10 CHCDRO C[C@H](N[C@@H](C)C(F)F)c1cccc(C(F)(F)F)c1O ZINC000883400745 1125409168 /nfs/dbraw/zinc/40/91/68/1125409168.db2.gz UHXKZBKBBAFBFU-BQBZGAKWSA-N 1 0 283.240 3.715 20 10 CHCDRO COC[C@@H](C)[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000131868868 1125410355 /nfs/dbraw/zinc/41/03/55/1125410355.db2.gz BGYAXMZDXUSCGH-KGLIPLIRSA-N 1 0 294.414 3.502 20 10 CHCDRO CCOc1cccc(C[NH+]2CCCCCCC2)c1O ZINC000131984013 1125412697 /nfs/dbraw/zinc/41/26/97/1125412697.db2.gz OAPCTFKBAZFUCI-UHFFFAOYSA-N 1 0 263.381 3.557 20 10 CHCDRO CC[C@H]([NH2+]CCCSc1nccs1)C(C)C ZINC000132253504 1125416888 /nfs/dbraw/zinc/41/68/88/1125416888.db2.gz QNRXHSFXLXRBRF-NSHDSACASA-N 1 0 258.456 3.650 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]CC2=CCCCC2)cc1 ZINC001202594913 1125441916 /nfs/dbraw/zinc/44/19/16/1125441916.db2.gz BQTRQSCUWDRVDB-TWGQIWQCSA-N 1 0 270.420 3.856 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CCC[C@@H]3CCC[C@H]32)c1 ZINC000245565703 1129211873 /nfs/dbraw/zinc/21/18/73/1129211873.db2.gz SAQDSZMRMKUTLL-XJKSGUPXSA-N 1 0 275.392 3.555 20 10 CHCDRO COc1ccc(O)c(C[NH2+]C[C@]2(C)CC[C@H](C)C2(C)C)c1 ZINC001206604266 1129216848 /nfs/dbraw/zinc/21/68/48/1129216848.db2.gz BVEWYPYJXURGJC-UGSOOPFHSA-N 1 0 291.435 3.953 20 10 CHCDRO C[C@@H]1CC(CC[NH2+]Cc2cc(Cl)ccc2O)C[C@@H](C)O1 ZINC000801732430 1129217778 /nfs/dbraw/zinc/21/77/78/1129217778.db2.gz KLXQAPISWBBURV-VXGBXAGGSA-N 1 0 297.826 3.729 20 10 CHCDRO CCOc1cccc(C[N@@H+]2C[C@H](C)[C@H]2c2ccccc2)c1O ZINC000245762173 1129224045 /nfs/dbraw/zinc/22/40/45/1129224045.db2.gz PZVHFWPBAYRNFV-KSSFIOAISA-N 1 0 297.398 3.984 20 10 CHCDRO Cc1cccc(C[N@H+]2C[C@@H](C)OC[C@H]2c2ccccc2)c1O ZINC000245859431 1129229848 /nfs/dbraw/zinc/22/98/48/1129229848.db2.gz OKPFWYRNUGWYSC-QAPCUYQASA-N 1 0 297.398 3.663 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]CCC2=CCCC2)c1O ZINC000184710631 1129238103 /nfs/dbraw/zinc/23/81/03/1129238103.db2.gz JAAHJIMILWAYGL-UHFFFAOYSA-N 1 0 281.783 3.644 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(F)c(C)c2)c1 ZINC000184911742 1129261608 /nfs/dbraw/zinc/26/16/08/1129261608.db2.gz NKQFXFRGJSVOTK-LBPRGKRZSA-N 1 0 289.350 3.699 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC000037770569 1129267375 /nfs/dbraw/zinc/26/73/75/1129267375.db2.gz KYTYFCGLLSHHKQ-CQSZACIVSA-N 1 0 267.372 3.781 20 10 CHCDRO Cc1ncc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)s1 ZINC000090417267 1129289445 /nfs/dbraw/zinc/28/94/45/1129289445.db2.gz UHZUWFMAPIIURQ-GFCCVEGCSA-N 1 0 289.448 3.677 20 10 CHCDRO Oc1ccc2ccncc2c1C[NH+](CC1CC1)CC1CC1 ZINC000734477499 1129310613 /nfs/dbraw/zinc/31/06/13/1129310613.db2.gz FNUHUNHILICUFL-UHFFFAOYSA-N 1 0 282.387 3.562 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](C)SC)c1ccc(N(C)C)cc1 ZINC000090725667 1129326299 /nfs/dbraw/zinc/32/62/99/1129326299.db2.gz RKWTWTWVWBGHLY-IUODEOHRSA-N 1 0 266.454 3.545 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H]2CSc3ccccc32)c1 ZINC000735508548 1129348551 /nfs/dbraw/zinc/34/85/51/1129348551.db2.gz DMQPZSCVQBHWGF-CQSZACIVSA-N 1 0 271.385 3.637 20 10 CHCDRO CC(C)[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccccn1 ZINC000736647624 1129378736 /nfs/dbraw/zinc/37/87/36/1129378736.db2.gz KGFMYLLAGVUGIY-SFHVURJKSA-N 1 0 282.387 3.503 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CCCC[C@@H](SC)C2)c1 ZINC000092064250 1129379527 /nfs/dbraw/zinc/37/95/27/1129379527.db2.gz XZPMMFMWNAFUPM-OAHLLOKOSA-N 1 0 295.448 3.508 20 10 CHCDRO COc1ccc([C@@H]2CC[N@H+](Cc3cc(C)ccc3O)C2)cc1 ZINC000092783530 1129407484 /nfs/dbraw/zinc/40/74/84/1129407484.db2.gz OCBIRTRAIZSUOE-MRXNPFEDSA-N 1 0 297.398 3.699 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2cc(C)ccc2O)s1 ZINC000093049410 1129416058 /nfs/dbraw/zinc/41/60/58/1129416058.db2.gz WYONTUVDZBLYFB-UHFFFAOYSA-N 1 0 261.390 3.703 20 10 CHCDRO COc1ccc2ccc(O)c(C[N@@H+]3C[C@H](C)C[C@@H]3C)c2c1 ZINC000740860578 1129420866 /nfs/dbraw/zinc/42/08/66/1129420866.db2.gz QWHCKEBXBPBETR-OLZOCXBDSA-N 1 0 285.387 3.784 20 10 CHCDRO C[C@@H]1C[C@H](C)C[N@H+]1Cc1cc(C(C)(C)C)cc(O)c1O ZINC000740860282 1129420965 /nfs/dbraw/zinc/42/09/65/1129420965.db2.gz CMXMZNZOJUXAMD-NWDGAFQWSA-N 1 0 277.408 3.626 20 10 CHCDRO Cc1cc(C)cc(CC[NH2+]Cc2cc(Cl)ccc2O)c1 ZINC000740900674 1129423574 /nfs/dbraw/zinc/42/35/74/1129423574.db2.gz UXGRBTOKBXKRQH-UHFFFAOYSA-N 1 0 289.806 3.995 20 10 CHCDRO COc1cccc(C[N@H+](C)Cc2cc3ccccc3o2)c1O ZINC000093689212 1129426943 /nfs/dbraw/zinc/42/69/43/1129426943.db2.gz WVVMZXWVTKVZIZ-UHFFFAOYSA-N 1 0 297.354 3.779 20 10 CHCDRO Cc1ccc2c(c1)C[N@@H+](Cc1cc(C)cc(C)c1O)CCO2 ZINC000795710757 1129436501 /nfs/dbraw/zinc/43/65/01/1129436501.db2.gz NERMFFYAKIXDBR-UHFFFAOYSA-N 1 0 297.398 3.712 20 10 CHCDRO CCCN(Cc1cc(F)ccc1F)c1ccc(C[NH3+])cc1 ZINC000094622389 1129448242 /nfs/dbraw/zinc/44/82/42/1129448242.db2.gz BRFQWNPUQHDSJC-UHFFFAOYSA-N 1 0 290.357 3.840 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCc2ccccc2C1)c1cc(F)ccc1O ZINC000094618070 1129448417 /nfs/dbraw/zinc/44/84/17/1129448417.db2.gz VUKXPMSTGKLXQJ-WBMJQRKESA-N 1 0 285.362 3.739 20 10 CHCDRO Cc1cccc(CC[NH2+][C@H](C)c2cc(F)ccc2O)c1 ZINC000094618074 1129448430 /nfs/dbraw/zinc/44/84/30/1129448430.db2.gz PGGNVBJGOFWQIX-CYBMUJFWSA-N 1 0 273.351 3.733 20 10 CHCDRO Cc1cc(O)c(C[NH+]2CCC(C(C)C)CC2)cc1C ZINC000742170127 1129468554 /nfs/dbraw/zinc/46/85/54/1129468554.db2.gz XGVNPRVTSNFLJC-UHFFFAOYSA-N 1 0 261.409 3.877 20 10 CHCDRO c1cc(C[NH2+][C@@H]2CC[C@H]3CCC[C@@H]3C2)cc2c1OCC2 ZINC000742379334 1129476248 /nfs/dbraw/zinc/47/62/48/1129476248.db2.gz VNAOUZLLABGIDP-BFYDXBDKSA-N 1 0 271.404 3.680 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CC[C@H](C)C[C@H]2C)cc1C ZINC000250869876 1129501282 /nfs/dbraw/zinc/50/12/82/1129501282.db2.gz ATWBKMRBXNDJMR-WOSRLPQWSA-N 1 0 261.409 3.918 20 10 CHCDRO CN(C)c1ccc(C[NH2+]Cc2ccc3occc3c2)cc1 ZINC000796257797 1129501854 /nfs/dbraw/zinc/50/18/54/1129501854.db2.gz NYSVBESCIKOHKL-UHFFFAOYSA-N 1 0 280.371 3.789 20 10 CHCDRO CCC[C@]1(C)CCC[N@H+](Cc2cc3c(cc2O)OCO3)C1 ZINC000743404038 1129522897 /nfs/dbraw/zinc/52/28/97/1129522897.db2.gz GVNXWJPMKNNBSO-QGZVFWFLSA-N 1 0 291.391 3.523 20 10 CHCDRO CO[C@@H](C[NH2+]Cc1cc(-c2ccccc2)ccc1O)C(C)C ZINC000744449083 1129577978 /nfs/dbraw/zinc/57/79/78/1129577978.db2.gz RVXKVXKJJKGDIU-IBGZPJMESA-N 1 0 299.414 3.820 20 10 CHCDRO CCCN(Cc1cc(F)cc(F)c1)c1ccc(C[NH3+])cc1 ZINC000097900506 1129628700 /nfs/dbraw/zinc/62/87/00/1129628700.db2.gz SPDKOZVXORIWJP-UHFFFAOYSA-N 1 0 290.357 3.840 20 10 CHCDRO CC[N@@H+](Cc1c(O)ccc2ccccc21)C[C@@H]1CCCO1 ZINC000098051745 1129642317 /nfs/dbraw/zinc/64/23/17/1129642317.db2.gz YANKRJIUYATYGF-HNNXBMFYSA-N 1 0 285.387 3.546 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1ccc(N(C)C)cc1)C1CCOCC1 ZINC000766387788 1129663858 /nfs/dbraw/zinc/66/38/58/1129663858.db2.gz HZSYELASHQEISW-KSSFIOAISA-N 1 0 290.451 3.608 20 10 CHCDRO C[N@H+](Cc1cc(C(C)(C)C)cc(O)c1O)CC(C)(C)C ZINC000738100333 1129665603 /nfs/dbraw/zinc/66/56/03/1129665603.db2.gz UKJDTPJIQVBMHU-UHFFFAOYSA-N 1 0 279.424 3.873 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@H](C)c2ccncc2)cc1 ZINC000766491246 1129669383 /nfs/dbraw/zinc/66/93/83/1129669383.db2.gz YREXPOQKJCFWAL-JKSUJKDBSA-N 1 0 297.446 3.992 20 10 CHCDRO COC1CCC(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)CC1 ZINC000766496108 1129672654 /nfs/dbraw/zinc/67/26/54/1129672654.db2.gz RWENBLYVURIXMK-SYJJWHGVSA-N 1 0 290.451 3.608 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H]2C[C@H](OC)C2(C)C)cc1 ZINC000766531198 1129684096 /nfs/dbraw/zinc/68/40/96/1129684096.db2.gz ZQNWCPHIJDKYFY-JQFCIGGWSA-N 1 0 290.451 3.607 20 10 CHCDRO COc1ccc(Cl)cc1C[NH2+]Cc1cc(C)ccc1O ZINC000113329643 1129836581 /nfs/dbraw/zinc/83/65/81/1129836581.db2.gz DRDMQLZTAXDBIJ-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO CCC(CC)C[N@@H+](Cc1ccccc1O)C[C@@H]1CCCO1 ZINC000768160857 1129837280 /nfs/dbraw/zinc/83/72/80/1129837280.db2.gz AYPNQUSSXBHFLQ-KRWDZBQOSA-N 1 0 291.435 3.809 20 10 CHCDRO C[C@@H]([NH2+]CC[C@@H]1CC1(Cl)Cl)c1ccccc1O ZINC000822812690 1131400854 /nfs/dbraw/zinc/40/08/54/1131400854.db2.gz KOOYSADABAENAR-NXEZZACHSA-N 1 0 274.191 3.627 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCC[C@@H]2Cc2ccccc2)c1 ZINC000768231116 1129845535 /nfs/dbraw/zinc/84/55/35/1129845535.db2.gz VGYDOGFDHZLLHF-GOSISDBHSA-N 1 0 281.399 3.908 20 10 CHCDRO C[N@@H+](Cc1cc(-c2ccccc2)ccc1O)C[C@@H]1CCCO1 ZINC000768249336 1129847548 /nfs/dbraw/zinc/84/75/48/1129847548.db2.gz RWIHNFJHSKQPNU-SFHVURJKSA-N 1 0 297.398 3.670 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1cc(C)ccc1O)[C@@H]1CCCOC1 ZINC000723991085 1129851361 /nfs/dbraw/zinc/85/13/61/1129851361.db2.gz ZANHWFQCEXIXJZ-LZWOXQAQSA-N 1 0 277.408 3.556 20 10 CHCDRO C[N@H+](Cc1cc(-c2ccccc2)ccc1O)C1CC1 ZINC000768336544 1129852888 /nfs/dbraw/zinc/85/28/88/1129852888.db2.gz VPUNUDVIQLMCEJ-UHFFFAOYSA-N 1 0 253.345 3.653 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CCC[C@@H]1c1ccccn1 ZINC000768359959 1129853602 /nfs/dbraw/zinc/85/36/02/1129853602.db2.gz HYHXUFWNCWETFR-OAHLLOKOSA-N 1 0 288.778 3.778 20 10 CHCDRO CC[N@H+](Cc1ccccc1)Cc1cc(OC)c(C)cc1O ZINC000768437602 1129857126 /nfs/dbraw/zinc/85/71/26/1129857126.db2.gz ARZJYICAQILFRK-UHFFFAOYSA-N 1 0 285.387 3.731 20 10 CHCDRO CCC[N@@H+](Cc1cc(OCC)ccc1O)CC(C)C ZINC000768477384 1129857901 /nfs/dbraw/zinc/85/79/01/1129857901.db2.gz ANYVLYGIDWAJBB-UHFFFAOYSA-N 1 0 265.397 3.659 20 10 CHCDRO Oc1cc2c(cc1C[N@@H+]1CC[C@H](c3ccco3)C1)CCCC2 ZINC000768446481 1129858073 /nfs/dbraw/zinc/85/80/73/1129858073.db2.gz KPSHVLHRRWDVIR-INIZCTEOSA-N 1 0 297.398 3.854 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2cc(-c3ccccc3)ccc2O)[C@@H](C)CO1 ZINC000768536270 1129861079 /nfs/dbraw/zinc/86/10/79/1129861079.db2.gz GXYXNOKJJIAITC-LSDHHAIUSA-N 1 0 297.398 3.668 20 10 CHCDRO CCCOc1cccc(C[N@H+](C)Cc2ccccc2O)c1 ZINC000768873687 1129878388 /nfs/dbraw/zinc/87/83/88/1129878388.db2.gz UKFOWCNKYDWDSG-UHFFFAOYSA-N 1 0 285.387 3.813 20 10 CHCDRO Cc1cc(Cl)nc(C[NH2+][C@@H](C)c2cc(F)ccc2O)c1 ZINC000800496820 1129880741 /nfs/dbraw/zinc/88/07/41/1129880741.db2.gz YLLYLMMWUNVFLU-JTQLQIEISA-N 1 0 294.757 3.739 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]CC2CCC(F)(F)CC2)c1 ZINC000800500785 1129881614 /nfs/dbraw/zinc/88/16/14/1129881614.db2.gz YNNXYQJMPJRVOA-NSHDSACASA-N 1 0 299.361 3.877 20 10 CHCDRO COc1cccc(O)c1C[N@@H+]1CCC[C@H]1C1CCCC1 ZINC000769006778 1129888363 /nfs/dbraw/zinc/88/83/63/1129888363.db2.gz IDSCCMZXIGVNHK-HNNXBMFYSA-N 1 0 275.392 3.555 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)C(C2CC2)C2CC2)cc1F ZINC000769192700 1129892330 /nfs/dbraw/zinc/89/23/30/1129892330.db2.gz UKIHNNKTAMXXPX-UHFFFAOYSA-N 1 0 276.399 3.512 20 10 CHCDRO CCC[N@H+](Cc1ccccc1O)Cc1ccccc1OC ZINC000769201628 1129896530 /nfs/dbraw/zinc/89/65/30/1129896530.db2.gz YIIBTFZMRAUKAK-UHFFFAOYSA-N 1 0 285.387 3.813 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC[C@H]2C2CCC2)cc1 ZINC000769246231 1129898149 /nfs/dbraw/zinc/89/81/49/1129898149.db2.gz XYWVVKOUGLBDIZ-KRWDZBQOSA-N 1 0 258.409 3.517 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H]2CC[C@H]2C2CCC2)cc1F ZINC000800969646 1129900649 /nfs/dbraw/zinc/90/06/49/1129900649.db2.gz SSBIJHMTWIKVPA-HOCLYGCPSA-N 1 0 276.399 3.560 20 10 CHCDRO COc1cccc(C[N@H+](CC2CC2)C2CCCCC2)c1O ZINC000769309151 1129901584 /nfs/dbraw/zinc/90/15/84/1129901584.db2.gz RMIRWDYBHDEFSZ-UHFFFAOYSA-N 1 0 289.419 3.946 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCc3ccccc3OC2)c(O)c1 ZINC000800986216 1129902668 /nfs/dbraw/zinc/90/26/68/1129902668.db2.gz CBIDWXXGRVLDHA-GDBMZVCRSA-N 1 0 297.398 3.745 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCc2ccccc2OC1)c1ccccc1O ZINC000800987125 1129902802 /nfs/dbraw/zinc/90/28/02/1129902802.db2.gz QBNLTTZVCNTCEL-RDJZCZTQSA-N 1 0 297.398 3.827 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCc2ccccc2OC1)c1ccccc1O ZINC000800987126 1129902979 /nfs/dbraw/zinc/90/29/79/1129902979.db2.gz QBNLTTZVCNTCEL-WBVHZDCISA-N 1 0 297.398 3.827 20 10 CHCDRO COc1cccc(O)c1C[NH+]1CCC2(CCCC2)CC1 ZINC000769331203 1129903036 /nfs/dbraw/zinc/90/30/36/1129903036.db2.gz CZLSPUPZBCHXIT-UHFFFAOYSA-N 1 0 275.392 3.557 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCc3ccccc3[C@H]2C)c1 ZINC000769353026 1129904396 /nfs/dbraw/zinc/90/43/96/1129904396.db2.gz RHHMCFYAKXONLH-CQSZACIVSA-N 1 0 267.372 3.820 20 10 CHCDRO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1cccc(OC)c1O ZINC000769428951 1129908457 /nfs/dbraw/zinc/90/84/57/1129908457.db2.gz XGHZVVQWIJTRGA-QGZVFWFLSA-N 1 0 297.398 3.910 20 10 CHCDRO COc1cccc(C[N@@H+]2CCCC[C@@H]2CC(C)C)c1O ZINC000769483993 1129909403 /nfs/dbraw/zinc/90/94/03/1129909403.db2.gz BFEZILGBIRTLJZ-OAHLLOKOSA-N 1 0 277.408 3.801 20 10 CHCDRO CCOc1ccc(C[N@H+](C(C)C)C2CCC2)c(O)c1 ZINC000769469630 1129912316 /nfs/dbraw/zinc/91/23/16/1129912316.db2.gz BRZJSPHZCGWCDM-UHFFFAOYSA-N 1 0 263.381 3.554 20 10 CHCDRO CC(C)[N@H+](Cc1ccc(N(C)C)c(F)c1)C1CCC1 ZINC000769470668 1129912562 /nfs/dbraw/zinc/91/25/62/1129912562.db2.gz NGZNWEZAKVCHDL-UHFFFAOYSA-N 1 0 264.388 3.655 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC[C@](C)(c3ccccc3)C2)c1 ZINC000769503411 1129914309 /nfs/dbraw/zinc/91/43/09/1129914309.db2.gz KKEGDHFJGAKGBX-IBGZPJMESA-N 1 0 281.399 3.864 20 10 CHCDRO CCCC[N@H+](Cc1ccc(CO)cc1)Cc1ccccc1O ZINC000801595528 1129930818 /nfs/dbraw/zinc/93/08/18/1129930818.db2.gz MVQPSFOKMBYXPL-UHFFFAOYSA-N 1 0 299.414 3.687 20 10 CHCDRO Oc1ccccc1C[NH2+]CC1CC(c2ccccc2)C1 ZINC000801730081 1129940567 /nfs/dbraw/zinc/94/05/67/1129940567.db2.gz DSBGHAODZQJOBM-UHFFFAOYSA-N 1 0 267.372 3.676 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CCC2C[C@H](C)O[C@@H](C)C2)cc1C ZINC000801730106 1129940638 /nfs/dbraw/zinc/94/06/38/1129940638.db2.gz FMVZCNGVSYMCPN-GJZGRUSLSA-N 1 0 291.435 3.692 20 10 CHCDRO C[C@@H]1[C@@H](C)CC[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC000770283064 1129942765 /nfs/dbraw/zinc/94/27/65/1129942765.db2.gz IEXVWJUGEKJLFR-JKSUJKDBSA-N 1 0 272.436 3.907 20 10 CHCDRO CC(C)[N@H+](Cc1cccs1)Cc1ccccc1O ZINC000770509173 1129947893 /nfs/dbraw/zinc/94/78/93/1129947893.db2.gz JDUUIOHLBWETSD-UHFFFAOYSA-N 1 0 261.390 3.864 20 10 CHCDRO C[C@H]1C[C@H](c2ccc(F)cc2)C[N@@H+]1Cc1ccccc1O ZINC000770510854 1129948847 /nfs/dbraw/zinc/94/88/47/1129948847.db2.gz SIXBAWJQQHFQHH-BBRMVZONSA-N 1 0 285.362 3.909 20 10 CHCDRO C[C@H]1CC[N@H+](Cc2c(O)ccc3ccncc32)CC12CCC2 ZINC000770670513 1129954135 /nfs/dbraw/zinc/95/41/35/1129954135.db2.gz LGMOXJDIOBBLGI-AWEZNQCLSA-N 1 0 296.414 3.953 20 10 CHCDRO CCOC1(C[NH2+][C@@H](C)c2cc(F)ccc2O)CCCC1 ZINC000383718259 1130019751 /nfs/dbraw/zinc/01/97/51/1130019751.db2.gz FRDMQUOAEIFWQQ-LBPRGKRZSA-N 1 0 281.371 3.531 20 10 CHCDRO CC1=CCC[C@H](C)[C@H]1C[N@H+](C)Cc1ccccc1O ZINC000785978261 1130070511 /nfs/dbraw/zinc/07/05/11/1130070511.db2.gz SNTRQCPGVUVARL-HOCLYGCPSA-N 1 0 259.393 3.816 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)[C@H](C)OC)c1cc(Cl)ccc1O ZINC000786576312 1130108882 /nfs/dbraw/zinc/10/88/82/1130108882.db2.gz SPHMAHKYWDHOEG-OUJBWJOFSA-N 1 0 271.788 3.510 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(-c2cncc(C[NH3+])c2)cc1 ZINC001239797035 1130111888 /nfs/dbraw/zinc/11/18/88/1130111888.db2.gz LSCYYSHYKKHTJX-UHFFFAOYSA-N 1 0 277.371 3.615 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]CCc1ccc(F)c(F)c1 ZINC000786818680 1130119232 /nfs/dbraw/zinc/11/92/32/1130119232.db2.gz LNZRCIYBXXLMOS-UHFFFAOYSA-N 1 0 297.732 3.656 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCc2cccc(O)c21)c1ccc2c(c1)CCO2 ZINC000903235238 1130134115 /nfs/dbraw/zinc/13/41/15/1130134115.db2.gz VTSOZLXUAJTAQP-WBMJQRKESA-N 1 0 295.382 3.665 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CC[C@H](C3CC3)O2)c(O)c1C ZINC000903250696 1130137088 /nfs/dbraw/zinc/13/70/88/1130137088.db2.gz CHDQPUMPHWUBFQ-YSVLISHTSA-N 1 0 289.419 3.617 20 10 CHCDRO CC(C)[N@H+](CCOC(C)(C)C)Cc1ccc(N(C)C)cc1 ZINC000746650795 1130138226 /nfs/dbraw/zinc/13/82/26/1130138226.db2.gz KHVBWGCZBLLKTK-UHFFFAOYSA-N 1 0 292.467 3.778 20 10 CHCDRO CC[N@H+](Cc1cc(Br)ccc1[O-])CC1(C)CC1 ZINC000787201217 1130139057 /nfs/dbraw/zinc/13/90/57/1130139057.db2.gz IITMNFLGQBJXDE-UHFFFAOYSA-N 1 0 298.224 3.777 20 10 CHCDRO CC[C@@H]([NH2+]C1CC2(C1)CO[C@H](C)C2)c1ccc(C)cc1O ZINC000903281487 1130144859 /nfs/dbraw/zinc/14/48/59/1130144859.db2.gz HDUOXBVIZDKHGH-GEMJLEDKSA-N 1 0 289.419 3.699 20 10 CHCDRO CC[C@H]([NH2+]C1CC2(C1)CO[C@H](C)C2)c1ccc(C)cc1O ZINC000903281488 1130145352 /nfs/dbraw/zinc/14/53/52/1130145352.db2.gz HDUOXBVIZDKHGH-KDWRMLKXSA-N 1 0 289.419 3.699 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](c2ccccn2)C2CC2)c(O)c1 ZINC000903335661 1130160343 /nfs/dbraw/zinc/16/03/43/1130160343.db2.gz RLCUJRDYZSFQNQ-SCLBCKFNSA-N 1 0 282.387 3.898 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCOC12CCCC2)c1cc(Cl)ccc1O ZINC000903382835 1130168492 /nfs/dbraw/zinc/16/84/92/1130168492.db2.gz JNOJYQNMXKXHNQ-NHYWBVRUSA-N 1 0 295.810 3.798 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCOC12CCCC2)c1ccc(Cl)cc1O ZINC000903388972 1130169777 /nfs/dbraw/zinc/16/97/77/1130169777.db2.gz NMQWBIRRIRANPE-NHYWBVRUSA-N 1 0 295.810 3.798 20 10 CHCDRO Cc1nc2ccccn2c1C[NH2+][C@H](C)c1cc(C)ccc1O ZINC000903421317 1130174394 /nfs/dbraw/zinc/17/43/94/1130174394.db2.gz GYDUSHWVVXLXEL-CYBMUJFWSA-N 1 0 295.386 3.508 20 10 CHCDRO C[C@H]([NH2+][C@@H](c1ccncc1)C1CC1)c1cc(F)ccc1O ZINC000903428980 1130175472 /nfs/dbraw/zinc/17/54/72/1130175472.db2.gz RIUFIUOFIMFPSP-APPDUMDISA-N 1 0 286.350 3.728 20 10 CHCDRO C[C@@H]([NH2+][C@@H](c1ccncc1)C1CC1)c1ccccc1O ZINC000903430050 1130176731 /nfs/dbraw/zinc/17/67/31/1130176731.db2.gz XGVUJECQWKQHGR-SJKOYZFVSA-N 1 0 268.360 3.589 20 10 CHCDRO C[C@@H]1C[C@@H]1C[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000788442230 1130186367 /nfs/dbraw/zinc/18/63/67/1130186367.db2.gz BVEWQVWMOBQWPA-NVXWUHKLSA-N 1 0 272.436 3.765 20 10 CHCDRO C[C@H]1C[C@@H]1C[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000788442224 1130186447 /nfs/dbraw/zinc/18/64/47/1130186447.db2.gz BVEWQVWMOBQWPA-DOTOQJQBSA-N 1 0 272.436 3.765 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccccc2)c(O)c1 ZINC000788500236 1130191330 /nfs/dbraw/zinc/19/13/30/1130191330.db2.gz ZNHHLWILHLZPSW-CQSZACIVSA-N 1 0 255.361 3.860 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@H](CC(C)C)N(C)C)c(O)c1 ZINC000788505286 1130191449 /nfs/dbraw/zinc/19/14/49/1130191449.db2.gz FYARVPHKFOICRS-CVEARBPZSA-N 1 0 292.467 3.636 20 10 CHCDRO Cc1ccc([C@H](O)C[NH2+][C@H](C)c2c(C)cc(C)cc2O)cc1 ZINC000788562947 1130194840 /nfs/dbraw/zinc/19/48/40/1130194840.db2.gz MJPILEKUWZENAW-CRAIPNDOSA-N 1 0 299.414 3.702 20 10 CHCDRO CSC1(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)CCC1 ZINC000788606950 1130197083 /nfs/dbraw/zinc/19/70/83/1130197083.db2.gz SJEMZUSTFPKZTL-CYBMUJFWSA-N 1 0 279.449 3.945 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@H]2CCC(C)(C)O2)c(O)c1 ZINC000788765386 1130207300 /nfs/dbraw/zinc/20/73/00/1130207300.db2.gz NSZMQIBFOCLKIB-ZIAGYGMSSA-N 1 0 277.408 3.617 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H]2CCC(C)(C)O2)c(O)c1 ZINC000788765384 1130207380 /nfs/dbraw/zinc/20/73/80/1130207380.db2.gz NSZMQIBFOCLKIB-KGLIPLIRSA-N 1 0 277.408 3.617 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+]CC[C@H]2CCO[C@H](C)C2)c1O ZINC000753585478 1130220040 /nfs/dbraw/zinc/22/00/40/1130220040.db2.gz HRABTRDSKFSLQN-OLZOCXBDSA-N 1 0 297.826 3.649 20 10 CHCDRO CC(C)(C)N1CC[C@H]([NH2+]Cc2ccc3ccccc3c2O)C1 ZINC000826868363 1130298988 /nfs/dbraw/zinc/29/89/88/1130298988.db2.gz RRZCWFPAYXRCGU-INIZCTEOSA-N 1 0 298.430 3.508 20 10 CHCDRO C[C@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ccc(N(C)C)cc1 ZINC000791580345 1130382968 /nfs/dbraw/zinc/38/29/68/1130382968.db2.gz ZZZDAFJNEJVSHX-FZMZJTMJSA-N 1 0 286.341 3.525 20 10 CHCDRO CC[C@@H]1C[C@@H]([N@H+](CC)Cc2ccc(N(C)C)cc2)CCO1 ZINC001170239927 1130466148 /nfs/dbraw/zinc/46/61/48/1130466148.db2.gz OIHHOOZBWYOPON-ZWKOTPCHSA-N 1 0 290.451 3.532 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(C=C2CC[NH2+]CC2)cc1 ZINC001240875049 1130499110 /nfs/dbraw/zinc/49/91/10/1130499110.db2.gz BLNCCEIAUCKTCQ-UHFFFAOYSA-N 1 0 266.388 3.861 20 10 CHCDRO C[C@H]1CCC[N@@H+]1Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000792821603 1130501000 /nfs/dbraw/zinc/50/10/00/1130501000.db2.gz YNZSAQPYYOXGTA-NSHDSACASA-N 1 0 286.341 3.756 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+]CCC2(C)CC2)c1O ZINC000793197652 1130529340 /nfs/dbraw/zinc/52/93/40/1130529340.db2.gz DTIZIJFIYPFEAH-UHFFFAOYSA-N 1 0 253.773 3.634 20 10 CHCDRO C[C@@H]1C[C@H](C)[N@H+]1Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000793220162 1130530935 /nfs/dbraw/zinc/53/09/35/1130530935.db2.gz KQWJGVZTTRYELJ-PHIMTYICSA-N 1 0 286.341 3.754 20 10 CHCDRO C[C@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1cc(Cl)ccc1O ZINC000793230925 1130533008 /nfs/dbraw/zinc/53/30/08/1130533008.db2.gz IVFFFVKFNKBJFA-GZMMTYOYSA-N 1 0 293.716 3.818 20 10 CHCDRO CC[C@H](C[C@@H](C)CC)[NH2+]Cc1ccc(OC)cc1O ZINC000793386274 1130551848 /nfs/dbraw/zinc/55/18/48/1130551848.db2.gz KESAAWDLAORWHN-GXTWGEPZSA-N 1 0 265.397 3.705 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccc2c[nH]nc2c1)c1ccccc1O ZINC000793576107 1130572147 /nfs/dbraw/zinc/57/21/47/1130572147.db2.gz XTTDBGIYBHOFPU-INIZCTEOSA-N 1 0 295.386 3.552 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2ccc(Cl)c(C)c2)c1 ZINC000758017385 1130593333 /nfs/dbraw/zinc/59/33/33/1130593333.db2.gz RCGKYTZNSTYKCJ-UHFFFAOYSA-N 1 0 275.779 3.952 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H](c2cccnc2)C2CC2)cc1C ZINC000758625422 1130619857 /nfs/dbraw/zinc/61/98/57/1130619857.db2.gz USHUQROEDWGZFV-SFHVURJKSA-N 1 0 282.387 3.645 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CC(C)(C)[C@H]2C2CC2)c1O ZINC000811513841 1130620514 /nfs/dbraw/zinc/62/05/14/1130620514.db2.gz SFGWDMBAVWDZRK-OAHLLOKOSA-N 1 0 295.810 3.675 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2c(O)ccc3ccncc32)CC1(C)C ZINC000758998407 1130632322 /nfs/dbraw/zinc/63/23/22/1130632322.db2.gz CAGSGWQUJCEHJB-CYBMUJFWSA-N 1 0 284.403 3.808 20 10 CHCDRO COc1ccc(O)c(CNc2cc[nH+]c3cc(F)ccc23)c1 ZINC000811805875 1130645699 /nfs/dbraw/zinc/64/56/99/1130645699.db2.gz FATNJVRBWVOELT-UHFFFAOYSA-N 1 0 298.317 3.700 20 10 CHCDRO COc1cc(C[N@@H+]2CCC[C@@H](C(C)C)C2)c(O)cc1C ZINC000780501178 1130681459 /nfs/dbraw/zinc/68/14/59/1130681459.db2.gz ZKZFSASIVBHSAA-CQSZACIVSA-N 1 0 277.408 3.577 20 10 CHCDRO CN(C)c1ccc(CNc2cc3c(c[nH+]2)CCCC3)cc1 ZINC000812345808 1130685695 /nfs/dbraw/zinc/68/56/95/1130685695.db2.gz PJPONNURTLWMLQ-UHFFFAOYSA-N 1 0 281.403 3.639 20 10 CHCDRO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1cc(F)ccc1O ZINC000780792584 1130692988 /nfs/dbraw/zinc/69/29/88/1130692988.db2.gz HPAIRVOVCTYCRM-MWLCHTKSSA-N 1 0 291.288 3.694 20 10 CHCDRO Cc1cccc(C[N@H+]2C[C@H](C(F)(F)F)CC[C@@H]2C)c1O ZINC000780793148 1130693134 /nfs/dbraw/zinc/69/31/34/1130693134.db2.gz KNCXXURSBXRSDP-WCQYABFASA-N 1 0 287.325 3.863 20 10 CHCDRO C[C@H]1CC[N@@H+]1Cc1cccc(-c2ccccc2)c1O ZINC001235000463 1130699722 /nfs/dbraw/zinc/69/97/22/1130699722.db2.gz IJXUREGAGDMYRP-ZDUSSCGKSA-N 1 0 253.345 3.653 20 10 CHCDRO CC1C[NH+](Cc2cccc(-c3ccccc3)c2O)C1 ZINC001234991586 1130700483 /nfs/dbraw/zinc/70/04/83/1130700483.db2.gz NICONVZVYJIDNK-UHFFFAOYSA-N 1 0 253.345 3.511 20 10 CHCDRO Oc1c(C[N@@H+]2CCC[C@@H]2CF)cccc1-c1ccccc1 ZINC001234997597 1130701055 /nfs/dbraw/zinc/70/10/55/1130701055.db2.gz BRIPEDNIJGJHQA-MRXNPFEDSA-N 1 0 285.362 3.993 20 10 CHCDRO COC[C@H]1CCC[N@@H+]1Cc1cccc(-c2ccccc2)c1O ZINC001234993224 1130701241 /nfs/dbraw/zinc/70/12/41/1130701241.db2.gz XIIPYNDOSRMBCB-QGZVFWFLSA-N 1 0 297.398 3.670 20 10 CHCDRO Oc1c(C[N@@H+]2C[C@@H]3C[C@@H]3C2)cccc1-c1ccccc1 ZINC001235003592 1130702052 /nfs/dbraw/zinc/70/20/52/1130702052.db2.gz WCMWOYIMRWSZAU-IYBDPMFKSA-N 1 0 265.356 3.511 20 10 CHCDRO CC[C@H]([NH2+]CCCCF)c1ccc(N(C)C)cc1 ZINC000812735733 1130709802 /nfs/dbraw/zinc/70/98/02/1130709802.db2.gz GFGBJIVNIFYPBO-HNNXBMFYSA-N 1 0 252.377 3.543 20 10 CHCDRO C=Cc1ccc(CC[NH2+][C@H](C)c2cc(OC)ccc2O)cc1 ZINC000812734309 1130709823 /nfs/dbraw/zinc/70/98/23/1130709823.db2.gz KZCQKGLIYMXVSC-CQSZACIVSA-N 1 0 297.398 3.937 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@](C)(OC)C1CC1)c1cc(Cl)ccc1O ZINC000812735272 1130710637 /nfs/dbraw/zinc/71/06/37/1130710637.db2.gz ZFVPAQLPJGDAQP-GDBMZVCRSA-N 1 0 297.826 3.901 20 10 CHCDRO CCc1cccc(C[NH2+][C@@H](CC)c2nccs2)c1O ZINC000691449343 1130711996 /nfs/dbraw/zinc/71/19/96/1130711996.db2.gz FBLSVMRBRBQMGS-ZDUSSCGKSA-N 1 0 276.405 3.652 20 10 CHCDRO COc1cc(C)cc(C[N@@H+]2CC[C@@]3(CC[C@H](C)C3)C2)c1O ZINC000781585432 1130728181 /nfs/dbraw/zinc/72/81/81/1130728181.db2.gz FTNSDNQVCLYOME-SCLBCKFNSA-N 1 0 289.419 3.721 20 10 CHCDRO COc1cc(C)cc(C[N@H+](C)C2CCCCCC2)c1O ZINC000813069268 1130734650 /nfs/dbraw/zinc/73/46/50/1130734650.db2.gz FBOYKEPQTTUWKX-UHFFFAOYSA-N 1 0 277.408 3.864 20 10 CHCDRO CC(C)O[C@@H]1CC[N@H+](Cc2ccc(C(C)(C)C)cc2O)C1 ZINC001235681093 1130767372 /nfs/dbraw/zinc/76/73/72/1130767372.db2.gz XXYPSTZDUWZFPN-MRXNPFEDSA-N 1 0 291.435 3.689 20 10 CHCDRO CO[C@H]1CCC[N@H+](Cc2ccc(C(C)(C)C)cc2O)CC1 ZINC001235679569 1130767410 /nfs/dbraw/zinc/76/74/10/1130767410.db2.gz PPILRLYJIZFTMT-INIZCTEOSA-N 1 0 291.435 3.691 20 10 CHCDRO CO[C@H]1CC[N@H+](Cc2ccc(C(C)(C)C)cc2O)[C@@H](C)C1 ZINC001235682380 1130767521 /nfs/dbraw/zinc/76/75/21/1130767521.db2.gz WTYZOFLAIUAOEV-BBRMVZONSA-N 1 0 291.435 3.689 20 10 CHCDRO Cc1ccoc1C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000813882619 1130793881 /nfs/dbraw/zinc/79/38/81/1130793881.db2.gz FILWEPABUYIDMC-PWSUYJOCSA-N 1 0 275.323 3.771 20 10 CHCDRO C[C@H]1CC[C@H]1[NH2+]Cc1ccc(N2CCC(C)CC2)cc1 ZINC000783241734 1130805713 /nfs/dbraw/zinc/80/57/13/1130805713.db2.gz XCCDPYNMPYXGRP-MAUKXSAKSA-N 1 0 272.436 3.811 20 10 CHCDRO C[C@H]([NH2+][C@H]1CC[C@@H](C)C1)c1ccc(Br)cc1O ZINC000783311589 1130815593 /nfs/dbraw/zinc/81/55/93/1130815593.db2.gz XQPVLJZEMSYELR-SCVCMEIPSA-N 1 0 298.224 3.994 20 10 CHCDRO Cc1ccc(OCC[NH2+][C@@H](C)c2ccccc2O)c(C)c1 ZINC000783501735 1130831258 /nfs/dbraw/zinc/83/12/58/1130831258.db2.gz PTEBANHTWCDZGI-HNNXBMFYSA-N 1 0 285.387 3.739 20 10 CHCDRO Cc1ccc(O)c(C[N@H+](C)Cc2cccc(C)c2C)c1 ZINC000814170529 1130840057 /nfs/dbraw/zinc/84/00/57/1130840057.db2.gz XWWMPASPLAZBML-UHFFFAOYSA-N 1 0 269.388 3.949 20 10 CHCDRO C[C@@H]([NH2+]CCC(C)(C)F)c1ccc(N(C)C)cc1 ZINC000698320939 1130880291 /nfs/dbraw/zinc/88/02/91/1130880291.db2.gz YAVBWGQYNSAWEJ-GFCCVEGCSA-N 1 0 252.377 3.541 20 10 CHCDRO Nc1ccc(C[N@@H+]2CCC[C@H]2c2c(F)cccc2F)cc1 ZINC001236189766 1130881548 /nfs/dbraw/zinc/88/15/48/1130881548.db2.gz MXYUZAXXLGVBGS-INIZCTEOSA-N 1 0 288.341 3.884 20 10 CHCDRO CC(C)N(Cc1cc2ccccc2cc1O)[C@@H]1CCC[NH2+]C1 ZINC001236470666 1130949507 /nfs/dbraw/zinc/94/95/07/1130949507.db2.gz LBSKWVNRAFXZSG-GOSISDBHSA-N 1 0 298.430 3.508 20 10 CHCDRO Cc1cc(C[N@H+](Cc2ccncc2)C2CC2)ccc1N(C)C ZINC000815077017 1130955953 /nfs/dbraw/zinc/95/59/53/1130955953.db2.gz RZFFQFJPASRQMT-UHFFFAOYSA-N 1 0 295.430 3.621 20 10 CHCDRO Cc1cc(C[N@@H+]2CCc3ccsc3C2)ccc1N(C)C ZINC000815078316 1130956257 /nfs/dbraw/zinc/95/62/57/1130956257.db2.gz WNEPJQLWRYFWQO-UHFFFAOYSA-N 1 0 286.444 3.681 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CCC[C@@H](CSC)C2)cc1 ZINC000815121210 1130960069 /nfs/dbraw/zinc/96/00/69/1130960069.db2.gz SLFIXNXMXCZGJO-MRXNPFEDSA-N 1 0 292.492 3.718 20 10 CHCDRO Cc1cc(C[N@@H+]2CCCC23CCC3)ccc1N(C)C ZINC000815103620 1130962574 /nfs/dbraw/zinc/96/25/74/1130962574.db2.gz WAGHFUFGVRHVLJ-UHFFFAOYSA-N 1 0 258.409 3.580 20 10 CHCDRO CCOc1ccc(C[NH2+]CCC(C)(C)C2CC2)c(O)c1 ZINC000815163892 1130964594 /nfs/dbraw/zinc/96/45/94/1130964594.db2.gz SDWCETQSYDHYNH-UHFFFAOYSA-N 1 0 277.408 3.707 20 10 CHCDRO CC1=C[C@H](C)C[N@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C1 ZINC000797415639 1130985963 /nfs/dbraw/zinc/98/59/63/1130985963.db2.gz DDEAOYXIEVWEBN-LBPRGKRZSA-N 1 0 289.419 3.793 20 10 CHCDRO Cc1ncsc1C[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000815576571 1131001448 /nfs/dbraw/zinc/00/14/48/1131001448.db2.gz TUJVNTPUDNGRFL-GFCCVEGCSA-N 1 0 276.405 3.625 20 10 CHCDRO Cc1cnc(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)s1 ZINC000815583534 1131002595 /nfs/dbraw/zinc/00/25/95/1131002595.db2.gz IFHNJRYNQXTKHJ-GFCCVEGCSA-N 1 0 276.405 3.625 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H](O)c2ccccc2C)c(O)c1 ZINC000815579937 1131002688 /nfs/dbraw/zinc/00/26/88/1131002688.db2.gz YUHKBMZNYAWOCO-MAUKXSAKSA-N 1 0 299.414 3.702 20 10 CHCDRO CO[C@H](C[NH2+][C@@H](C)c1c(C)cc(C)cc1O)C(C)(C)C ZINC000815585219 1131003668 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3.627 20 10 CHCDRO COc1cccc(C[NH2+]Cc2cccc(C3CC3)c2)c1O ZINC000817410250 1131160412 /nfs/dbraw/zinc/16/04/12/1131160412.db2.gz WUZXNSJREUSLFB-UHFFFAOYSA-N 1 0 283.371 3.568 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@H]2CC23CCSCC3)cc1C ZINC000817411387 1131160925 /nfs/dbraw/zinc/16/09/25/1131160925.db2.gz QTTABFGJWILWRX-OAHLLOKOSA-N 1 0 291.460 3.632 20 10 CHCDRO Cc1cc(F)cc(C[N@H+](C)Cc2cccc(F)c2)c1O ZINC001238055647 1131165405 /nfs/dbraw/zinc/16/54/05/1131165405.db2.gz BDAURVCXUCVYHQ-UHFFFAOYSA-N 1 0 277.314 3.611 20 10 CHCDRO Cc1cc(F)cc(C[N@@H+]2CCC[C@H]2c2ccccn2)c1O ZINC001238063420 1131166563 /nfs/dbraw/zinc/16/65/63/1131166563.db2.gz WDPMIRKUTBRFGG-INIZCTEOSA-N 1 0 286.350 3.572 20 10 CHCDRO CC1=C(C)C[N@H+](Cc2ccc(N3CCCC3)cc2)CC1 ZINC001116894262 1131169930 /nfs/dbraw/zinc/16/99/30/1131169930.db2.gz HFVOYFOIRRIQEF-UHFFFAOYSA-N 1 0 270.420 3.829 20 10 CHCDRO CO[C@H]1CCCC[C@@H]1[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C ZINC001116925142 1131171198 /nfs/dbraw/zinc/17/11/98/1131171198.db2.gz MIFZBAZGBKFMTC-AYDFFVQHSA-N 1 0 289.419 3.796 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2cc(C)nc(C)c2)c(O)c1 ZINC000817590425 1131175279 /nfs/dbraw/zinc/17/52/79/1131175279.db2.gz WTFMJETYYDHUGF-CQSZACIVSA-N 1 0 270.376 3.563 20 10 CHCDRO Cc1ccc([C@H]([NH2+]CCc2ccc(N)cc2)C2CC2)cc1 ZINC000817955962 1131190144 /nfs/dbraw/zinc/19/01/44/1131190144.db2.gz MEDYVPHXQBQLSX-IBGZPJMESA-N 1 0 280.415 3.861 20 10 CHCDRO Nc1ccc(CC[NH2+][C@H](CC2CC2)c2ccccc2)cc1 ZINC000817955420 1131190537 /nfs/dbraw/zinc/19/05/37/1131190537.db2.gz AIGIELAUZKPATQ-LJQANCHMSA-N 1 0 280.415 3.942 20 10 CHCDRO C[C@H]([NH2+]CCc1ccc(N)cc1)c1ccccc1Cl ZINC000817955975 1131190638 /nfs/dbraw/zinc/19/06/38/1131190638.db2.gz MRAJMFZKOMNOLE-LBPRGKRZSA-N 1 0 274.795 3.816 20 10 CHCDRO Nc1ccc(CC[NH2+][C@@H]2CC[C@H]3CCCC[C@H]3C2)cc1 ZINC000817955889 1131190645 /nfs/dbraw/zinc/19/06/45/1131190645.db2.gz KEJVTIDELLVKIC-SOLBZPMBSA-N 1 0 272.436 3.760 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccc(N)cc1)c1ccc(F)cc1 ZINC000817955445 1131190676 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CCCC[C@@H](CN)[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O ZINC000817963416 1131192905 /nfs/dbraw/zinc/19/29/05/1131192905.db2.gz UTMMSFSZUUUCAR-AAEUAGOBSA-N 1 0 284.831 3.522 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)CCCC[NH3+])c1cccc(Cl)c1[O-] ZINC000817975786 1131193476 /nfs/dbraw/zinc/19/34/76/1131193476.db2.gz BNSRCXRDPLCGTO-FZMZJTMJSA-N 1 0 284.831 3.604 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2cccc3c2CCCN3)c(O)c1 ZINC000817975035 1131194067 /nfs/dbraw/zinc/19/40/67/1131194067.db2.gz HYVZZBRGCPQAMV-AWEZNQCLSA-N 1 0 296.414 3.910 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCC(C)(C)C1)c1cc(F)ccc1O ZINC000168862009 1131202914 /nfs/dbraw/zinc/20/29/14/1131202914.db2.gz QICPOAXNPOPSIX-JQWIXIFHSA-N 1 0 251.345 3.761 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2C)[C@H](O)C(C)C ZINC001117945850 1131205991 /nfs/dbraw/zinc/20/59/91/1131205991.db2.gz VRQDSGARLKINCJ-UYAYXHRUSA-N 1 0 291.435 3.634 20 10 CHCDRO C[C@H]([NH2+][C@@H]1C[C@H]2C[C@H]2C1)c1ccc(Br)cc1O ZINC000818361268 1131211544 /nfs/dbraw/zinc/21/15/44/1131211544.db2.gz VZHGZSRIPCLMGA-GUDRVLHUSA-N 1 0 296.208 3.604 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H]2C[C@@H]3[C@H](C2)C3(F)F)c(O)c1C ZINC001118489346 1131228450 /nfs/dbraw/zinc/22/84/50/1131228450.db2.gz JVLIIGYHVKCSHV-MHDGFBEUSA-N 1 0 281.346 3.703 20 10 CHCDRO COC1CC[NH+](Cc2cc(C)n(-c3ccccc3)c2C)CC1 ZINC001137854339 1131424014 /nfs/dbraw/zinc/42/40/14/1131424014.db2.gz RSUTXVYPWUBNPI-UHFFFAOYSA-N 1 0 298.430 3.705 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CCC(C)(F)F)cc1F ZINC000824484069 1131470676 /nfs/dbraw/zinc/47/06/76/1131470676.db2.gz ZXKSJPYLKVPHCT-UHFFFAOYSA-N 1 0 288.357 3.807 20 10 CHCDRO c1ccc2c(c1)SC[C@H]2C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000824482924 1131470727 /nfs/dbraw/zinc/47/07/27/1131470727.db2.gz FAICJNHNKFJVBH-OAHLLOKOSA-N 1 0 297.423 3.601 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+][C@@H]1CCCc2c(F)cccc21 ZINC000824469043 1131471321 /nfs/dbraw/zinc/47/13/21/1131471321.db2.gz VMFAOOFAEBMFKQ-MRXNPFEDSA-N 1 0 289.325 3.838 20 10 CHCDRO CC1(C)OCC[C@@H]1[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000824625223 1131478007 /nfs/dbraw/zinc/47/80/07/1131478007.db2.gz HCAVTPZPADRXON-SFHVURJKSA-N 1 0 297.398 3.716 20 10 CHCDRO FC[C@@H]1CCC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC001138219527 1131478762 /nfs/dbraw/zinc/47/87/62/1131478762.db2.gz FSJZHPXIRRBIDM-KRWDZBQOSA-N 1 0 290.426 3.858 20 10 CHCDRO CC[C@@H]1CCC[N@@H+]1Cc1c2ccccc2n(C)c1C ZINC001138257124 1131482967 /nfs/dbraw/zinc/48/29/67/1131482967.db2.gz XGUFHVQKCSSTDU-CQSZACIVSA-N 1 0 256.393 3.861 20 10 CHCDRO Cc1c(C[N@H+]2C[C@H](C)CC23CC3)c2ccccc2n1C ZINC001138259086 1131483141 /nfs/dbraw/zinc/48/31/41/1131483141.db2.gz AHBNRVOMXKKWET-CYBMUJFWSA-N 1 0 268.404 3.861 20 10 CHCDRO CO[C@](C)(C[NH2+]Cc1cc(C)c(C)cc1O)c1ccccc1 ZINC000824780337 1131484360 /nfs/dbraw/zinc/48/43/60/1131484360.db2.gz KUWMGGQJOPYJLT-LJQANCHMSA-N 1 0 299.414 3.660 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]CC[C@@]2(C)CC2(Cl)Cl)c1 ZINC000824971671 1131492429 /nfs/dbraw/zinc/49/24/29/1131492429.db2.gz WOMFFWMCTCAMSU-ZDUSSCGKSA-N 1 0 288.218 3.764 20 10 CHCDRO CN1CCCc2cc(C[N@H+](C)Cc3ccccc3)ccc21 ZINC001138354535 1131493497 /nfs/dbraw/zinc/49/34/97/1131493497.db2.gz MRBYTEQHMYUWBD-UHFFFAOYSA-N 1 0 280.415 3.701 20 10 CHCDRO CCCC[N@H+](CC)Cc1ccc2c(c1)CCCN2C ZINC001138354995 1131494147 /nfs/dbraw/zinc/49/41/47/1131494147.db2.gz XWKOEMNPMIYBOV-UHFFFAOYSA-N 1 0 260.425 3.691 20 10 CHCDRO CCCc1ncc(C[NH2+][C@@H](CC)c2ccccc2O)o1 ZINC000825085455 1131499176 /nfs/dbraw/zinc/49/91/76/1131499176.db2.gz KVVFKHHXEHCMGH-AWEZNQCLSA-N 1 0 274.364 3.574 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H](C)c2cccc(O)c2)cc1Cl ZINC000825246447 1131504428 /nfs/dbraw/zinc/50/44/28/1131504428.db2.gz ASKJGHXBEJCRQU-NSHDSACASA-N 1 0 291.778 3.910 20 10 CHCDRO COc1cccc(C[N@H+](C)Cc2ccc(C)c(C)c2)c1O ZINC000825299361 1131505586 /nfs/dbraw/zinc/50/55/86/1131505586.db2.gz JAYWNGKOLBLXML-UHFFFAOYSA-N 1 0 285.387 3.650 20 10 CHCDRO CSCC[C@@H](C)[NH2+]Cc1cc(Cl)c(C)cc1O ZINC000825297518 1131505620 /nfs/dbraw/zinc/50/56/20/1131505620.db2.gz HDNDFOGSDMAGLU-SNVBAGLBSA-N 1 0 273.829 3.585 20 10 CHCDRO COCCC1(C[NH2+]Cc2cc(Cl)c(C)cc2O)CCC1 ZINC000825336443 1131507295 /nfs/dbraw/zinc/50/72/95/1131507295.db2.gz AHNQDTWLKZALTO-UHFFFAOYSA-N 1 0 297.826 3.650 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H]2CCO[C@@H](C(C)C)C2)cc1Cl ZINC000825406798 1131511219 /nfs/dbraw/zinc/51/12/19/1131511219.db2.gz YZNRRCVCYWKMOB-XJKSGUPXSA-N 1 0 297.826 3.647 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CC[C@H]2CCO[C@H](C)C2)cc1Cl ZINC000825497233 1131513001 /nfs/dbraw/zinc/51/30/01/1131513001.db2.gz DWGOMZGQGUYSCP-OLZOCXBDSA-N 1 0 297.826 3.649 20 10 CHCDRO Oc1cc2c(cc1C[N@@H+]1CCC[C@@]3(CC3(F)F)C1)CCC2 ZINC000844745766 1131595583 /nfs/dbraw/zinc/59/55/83/1131595583.db2.gz GJBKDQBIJNPQGN-MRXNPFEDSA-N 1 0 293.357 3.502 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@]3(CC3(F)F)C2)cc1C ZINC000844746396 1131595994 /nfs/dbraw/zinc/59/59/94/1131595994.db2.gz LJFNMARCSIMEMB-OAHLLOKOSA-N 1 0 281.346 3.630 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+][C@@H]2CNc3ccccc3C2)c(O)c1 ZINC000844919343 1131607103 /nfs/dbraw/zinc/60/71/03/1131607103.db2.gz FLFVBLVZUWGMNQ-ZBFHGGJFSA-N 1 0 296.414 3.696 20 10 CHCDRO Cc1cc(C[N@@H+]2CCC[C@](C)(F)CC2)ccc1N(C)C ZINC001139669956 1131626801 /nfs/dbraw/zinc/62/68/01/1131626801.db2.gz RKUVTDWHRHMBQM-KRWDZBQOSA-N 1 0 278.415 3.775 20 10 CHCDRO Cc1cc(O)cc(C)c1C[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC001139715534 1131632178 /nfs/dbraw/zinc/63/21/78/1131632178.db2.gz LCQHKJFUJSCDGI-UHFFFAOYSA-N 1 0 298.430 3.707 20 10 CHCDRO Oc1ccc(F)cc1C[NH+]1CCC2(CC(F)(F)C2)CC1 ZINC001140057860 1131660007 /nfs/dbraw/zinc/66/00/07/1131660007.db2.gz QJWUCAWKLMCIOH-UHFFFAOYSA-N 1 0 285.309 3.543 20 10 CHCDRO Oc1cccc(Br)c1C[NH+]1CC2(C1)CCCC2 ZINC001140100666 1131663833 /nfs/dbraw/zinc/66/38/33/1131663833.db2.gz YQWVKRDDJYULOD-UHFFFAOYSA-N 1 0 296.208 3.531 20 10 CHCDRO Cc1ccc(C)c(C[N@H+]2CCC[C@@H](C)[C@H](C)C2)c1O ZINC001140178696 1131672999 /nfs/dbraw/zinc/67/29/99/1131672999.db2.gz VBIJPIQVIMKICQ-IUODEOHRSA-N 1 0 261.409 3.877 20 10 CHCDRO Cc1ccc(C)c(C[N@H+](C)CCc2ccc(F)cc2)c1O ZINC001140181426 1131673147 /nfs/dbraw/zinc/67/31/47/1131673147.db2.gz AZYKGUWBZPCYBE-UHFFFAOYSA-N 1 0 287.378 3.823 20 10 CHCDRO COc1ccccc1CC[N@H+](C)Cc1c(C)ccc(C)c1O ZINC001140182078 1131673579 /nfs/dbraw/zinc/67/35/79/1131673579.db2.gz IAVMTHUOVQQMRL-UHFFFAOYSA-N 1 0 299.414 3.692 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)CCC(F)(F)F)c1 ZINC000845970869 1131673802 /nfs/dbraw/zinc/67/38/02/1131673802.db2.gz DUWRINQLHSTIFN-ZJUUUORDSA-N 1 0 291.313 3.782 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2C[C@H]2c2ccccc2C)c1 ZINC000846025001 1131678890 /nfs/dbraw/zinc/67/88/90/1131678890.db2.gz DLPMQPRBBZZPGH-DOPJRALCSA-N 1 0 297.398 3.916 20 10 CHCDRO CC(C)Oc1cccc(C[NH2+][C@H]2CCc3cccc(O)c32)c1 ZINC000834518631 1131680728 /nfs/dbraw/zinc/68/07/28/1131680728.db2.gz KYCVUJNFMCJNJN-KRWDZBQOSA-N 1 0 297.398 3.957 20 10 CHCDRO C[C@@H]1CCCC[C@@H]1OCC[NH2+][C@H]1CCc2cccc(O)c21 ZINC000834522361 1131680957 /nfs/dbraw/zinc/68/09/57/1131680957.db2.gz AOKDFOJHLCEYBX-KMFMINBZSA-N 1 0 289.419 3.564 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@H]1CSCc3ccccc31)CC2 ZINC000834545325 1131682419 /nfs/dbraw/zinc/68/24/19/1131682419.db2.gz YETYRCYXXDWMES-CVEARBPZSA-N 1 0 297.423 3.957 20 10 CHCDRO CCN(C)c1ccccc1C[NH2+][C@H]1CCc2cccc(O)c21 ZINC000834575504 1131683999 /nfs/dbraw/zinc/68/39/99/1131683999.db2.gz LUITYOSYFLKXBE-INIZCTEOSA-N 1 0 296.414 3.625 20 10 CHCDRO CC[C@H]([NH2+]Cc1cccc(OC)c1O)c1ccccc1F ZINC000846046101 1131684416 /nfs/dbraw/zinc/68/44/16/1131684416.db2.gz UVLMRANZFJVOJN-HNNXBMFYSA-N 1 0 289.350 3.781 20 10 CHCDRO CCC[C@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1ccccn1 ZINC000834566962 1131684385 /nfs/dbraw/zinc/68/43/85/1131684385.db2.gz WBHNYAPSQBTTAK-JKSUJKDBSA-N 1 0 282.387 3.906 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]CCCc1cccc(F)c1)CC2 ZINC000834578744 1131684826 /nfs/dbraw/zinc/68/48/26/1131684826.db2.gz XXOPUGDAWVSEGP-MRXNPFEDSA-N 1 0 285.362 3.741 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]CCCc1cccc(F)c1)CC2 ZINC000834578742 1131684957 /nfs/dbraw/zinc/68/49/57/1131684957.db2.gz XXOPUGDAWVSEGP-INIZCTEOSA-N 1 0 285.362 3.741 20 10 CHCDRO CCOc1ccccc1CC[NH2+][C@H]1CCc2cccc(O)c21 ZINC000834639815 1131690091 /nfs/dbraw/zinc/69/00/91/1131690091.db2.gz COKQNSYWDKVTCU-INIZCTEOSA-N 1 0 297.398 3.611 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]CCC[C@@H]2CC2(Cl)Cl)c1 ZINC000846105672 1131691338 /nfs/dbraw/zinc/69/13/38/1131691338.db2.gz VRBOHLVHEYPIJB-GFCCVEGCSA-N 1 0 288.218 3.764 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@H](c2cccnc2)C2CC2)c1O ZINC000846157646 1131692281 /nfs/dbraw/zinc/69/22/81/1131692281.db2.gz NPXGVWZTQZSLSL-PXAZEXFGSA-N 1 0 298.386 3.598 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H](C2CC2)C2CCC2)c1O ZINC000846168184 1131693882 /nfs/dbraw/zinc/69/38/82/1131693882.db2.gz HWWCIJKQVUIRII-ZBEGNZNMSA-N 1 0 275.392 3.630 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]Cc2ccc(Cl)s2)c1O ZINC000846141842 1131694587 /nfs/dbraw/zinc/69/45/87/1131694587.db2.gz AMQBUOMGMILCCB-VIFPVBQESA-N 1 0 297.807 3.967 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@@H](C)Cc2ccsc2)c1O ZINC000846143130 1131694908 /nfs/dbraw/zinc/69/49/08/1131694908.db2.gz HWQQTFXHSFEITH-NWDGAFQWSA-N 1 0 291.416 3.744 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)COCC1CC1)c1ccc(C)cc1O ZINC000846206213 1131695693 /nfs/dbraw/zinc/69/56/93/1131695693.db2.gz XPYFCHSLIYCXFD-CJNGLKHVSA-N 1 0 277.408 3.556 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)COCC1CC1)c1cc(Cl)ccc1O ZINC000846205535 1131696060 /nfs/dbraw/zinc/69/60/60/1131696060.db2.gz QFGJIBWYSSIKHO-XHDPSFHLSA-N 1 0 297.826 3.901 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]Cc2cc(F)ccc2F)c1O ZINC000846148059 1131696096 /nfs/dbraw/zinc/69/60/96/1131696096.db2.gz WZCIEXHXGPYRGB-JTQLQIEISA-N 1 0 293.313 3.530 20 10 CHCDRO Cc1ccc2c(c1)C[N@@H+](Cc1c(O)cccc1Cl)CC2 ZINC001140337912 1131702201 /nfs/dbraw/zinc/70/22/01/1131702201.db2.gz MIINCOJSLUCRAM-UHFFFAOYSA-N 1 0 287.790 3.912 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CC[C@@H]2CCC[C@H]2C1 ZINC001140339497 1131702639 /nfs/dbraw/zinc/70/26/39/1131702639.db2.gz VNMPEGHADDFPAQ-RYUDHWBXSA-N 1 0 265.784 3.668 20 10 CHCDRO CC(C)O[C@@H]1C[C@H]([NH2+][C@@H]2CCc3cccc(O)c32)C1(C)C ZINC000834766243 1131703175 /nfs/dbraw/zinc/70/31/75/1131703175.db2.gz RLDPWWKMHGJSLX-VNQPRFMTSA-N 1 0 289.419 3.561 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]C[C@H]1CSc3ccccc31)CC2 ZINC000834819100 1131707660 /nfs/dbraw/zinc/70/76/60/1131707660.db2.gz SFDLLRXFJCKYJS-ZFWWWQNUSA-N 1 0 297.423 3.859 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCn2ccnc21)c1ccc2ccccc2c1O ZINC000834832813 1131710449 /nfs/dbraw/zinc/71/04/49/1131710449.db2.gz RNPDTSYTIKDVIZ-MLGOLLRUSA-N 1 0 293.370 3.538 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccnc(C)c1)c1ccc(C)cc1O ZINC000834860424 1131712655 /nfs/dbraw/zinc/71/26/55/1131712655.db2.gz RJZIFDWOKCBYDA-MRXNPFEDSA-N 1 0 270.376 3.645 20 10 CHCDRO CC[C@H](C)[C@@H](C[NH2+][C@@H](C)c1c(C)cc(C)cc1O)OC ZINC000834860609 1131713041 /nfs/dbraw/zinc/71/30/41/1131713041.db2.gz SUTKXOWLBPDRRC-DUVNUKRYSA-N 1 0 279.424 3.721 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H]2CCOC2(C)C)c1O ZINC000834875439 1131716201 /nfs/dbraw/zinc/71/62/01/1131716201.db2.gz OYPVZSMOKNGFGZ-GWCFXTLKSA-N 1 0 283.799 3.572 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCO[C@H](C(C)C)C2)c(O)c1 ZINC000834886218 1131718235 /nfs/dbraw/zinc/71/82/35/1131718235.db2.gz QXKSNJNGMKIPTJ-MPGHIAIKSA-N 1 0 291.435 3.802 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CCc2ncccc2C)cc1 ZINC000834887136 1131719384 /nfs/dbraw/zinc/71/93/84/1131719384.db2.gz YLTTYRHWYMYVRV-INIZCTEOSA-N 1 0 297.446 3.739 20 10 CHCDRO COc1ccc(C)cc1C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000772950383 1131720731 /nfs/dbraw/zinc/72/07/31/1131720731.db2.gz GTLGAAAVXIZYPV-HNNXBMFYSA-N 1 0 298.430 3.920 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1nccn1CC)c1ccc(C)cc1O ZINC000834897180 1131722270 /nfs/dbraw/zinc/72/22/70/1131722270.db2.gz YLMHBZVYPRBFCT-DZGCQCFKSA-N 1 0 287.407 3.719 20 10 CHCDRO C[C@@H]1CCC[C@H](C)[N@H+]1Cc1ccc(Cl)cc1O ZINC001140461952 1131749691 /nfs/dbraw/zinc/74/96/91/1131749691.db2.gz ZWWNRSKJVHYIJW-PHIMTYICSA-N 1 0 253.773 3.809 20 10 CHCDRO Cc1cccc(C[N@@H+](C)C/C=C\c2ccc(N(C)C)cc2)n1 ZINC000835026578 1131759021 /nfs/dbraw/zinc/75/90/21/1131759021.db2.gz VTRQQIRJRWMGJO-VURMDHGXSA-N 1 0 295.430 3.601 20 10 CHCDRO C[C@H](CCc1ccco1)[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC000835033683 1131760591 /nfs/dbraw/zinc/76/05/91/1131760591.db2.gz WRALLKSOLTXLLK-DQOPKJQZSA-N 1 0 298.430 3.970 20 10 CHCDRO CC(C)c1cc(C[NH2+]C/C=C\c2ccc(N(C)C)cc2)on1 ZINC000835040001 1131762430 /nfs/dbraw/zinc/76/24/30/1131762430.db2.gz OKIDSJHKAZWDKD-WAYWQWQTSA-N 1 0 299.418 3.667 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]C23CCC(CC2)C3)cc1 ZINC000835047007 1131763564 /nfs/dbraw/zinc/76/35/64/1131763564.db2.gz BOMWSXSUTOYPCC-ARJAWSKDSA-N 1 0 270.420 3.688 20 10 CHCDRO CSCCCCC[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC000835047312 1131763618 /nfs/dbraw/zinc/76/36/18/1131763618.db2.gz QRJMBWLKGURZFU-BQYQJAHWSA-N 1 0 292.492 3.889 20 10 CHCDRO C[C@@H](CC(F)(F)F)[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC000835046736 1131764272 /nfs/dbraw/zinc/76/42/72/1131764272.db2.gz MLWLYDFLKPNBHR-ITKZLYELSA-N 1 0 286.341 3.696 20 10 CHCDRO C[C@H](CC(F)(F)F)[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC000835046738 1131764363 /nfs/dbraw/zinc/76/43/63/1131764363.db2.gz MLWLYDFLKPNBHR-QMAVJUDZSA-N 1 0 286.341 3.696 20 10 CHCDRO C[C@H]1CCSCC[N@@H+]1C/C=C\c1ccc(N(C)C)cc1 ZINC000835049403 1131764679 /nfs/dbraw/zinc/76/46/79/1131764679.db2.gz RDRBANMEMZXUEO-XVWMLYKFSA-N 1 0 290.476 3.593 20 10 CHCDRO C[C@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)c1cncc(F)c1 ZINC000835048169 1131765610 /nfs/dbraw/zinc/76/56/10/1131765610.db2.gz MNVWYVMCEYJVLH-NNTXTVRGSA-N 1 0 299.393 3.651 20 10 CHCDRO C[C@@H](c1cccnc1)[N@H+](C)C/C=C/c1ccc(N(C)C)cc1 ZINC000835048544 1131765690 /nfs/dbraw/zinc/76/56/90/1131765690.db2.gz UJMVUKKRJVRYRS-MOEXGYKKSA-N 1 0 295.430 3.854 20 10 CHCDRO C[C@H]1CC[N@H+](Cc2c([O-])cc(F)cc2F)CCC1(F)F ZINC001140582900 1131807028 /nfs/dbraw/zinc/80/70/28/1131807028.db2.gz OYLVIYSRRQDYBX-VIFPVBQESA-N 1 0 291.288 3.538 20 10 CHCDRO Cc1c(O)ccc(C[N@@H+]2CC[C@@H](C3CCCCC3)C2)c1O ZINC001140749275 1131906729 /nfs/dbraw/zinc/90/67/29/1131906729.db2.gz UXQDCVVPXFDPSC-OAHLLOKOSA-N 1 0 289.419 3.808 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CC=CCC1)c1ccc(N(C)C)cc1 ZINC000773001095 1131913830 /nfs/dbraw/zinc/91/38/30/1131913830.db2.gz NDOCELIJPDXPPV-NVXWUHKLSA-N 1 0 258.409 3.902 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)CC2CCC2)c(Cl)c1 ZINC001140923559 1131965177 /nfs/dbraw/zinc/96/51/77/1131965177.db2.gz DKDUUUNNQFXRLZ-UHFFFAOYSA-N 1 0 266.816 3.638 20 10 CHCDRO Oc1cc2ccccc2cc1CNc1ccc2c(c1)C[NH2+]C2 ZINC001171404659 1131972293 /nfs/dbraw/zinc/97/22/93/1131972293.db2.gz HJGPSLYYZHRJSO-UHFFFAOYSA-N 1 0 290.366 3.761 20 10 CHCDRO Cc1ccc(C[N@@H+]2CC[C@@H](c3ccc(F)cc3)C2)c(O)c1 ZINC001140951103 1131972298 /nfs/dbraw/zinc/97/22/98/1131972298.db2.gz ZAJLVZKIPJVTBU-OAHLLOKOSA-N 1 0 285.362 3.829 20 10 CHCDRO CC[N@H+](Cc1cccc(OC)c1)Cc1ccc(C)cc1O ZINC001140950856 1131972365 /nfs/dbraw/zinc/97/23/65/1131972365.db2.gz LEOJUFTWTKAKER-UHFFFAOYSA-N 1 0 285.387 3.731 20 10 CHCDRO Cc1ccc(C[NH+]2CCC3(CCC(C)(C)O3)CC2)c(O)c1 ZINC001140958317 1131973353 /nfs/dbraw/zinc/97/33/53/1131973353.db2.gz XQOKENPAJPENLL-UHFFFAOYSA-N 1 0 289.419 3.624 20 10 CHCDRO CC[C@H]([NH2+]CC[C@H]1CCCS1)c1ccccc1O ZINC000715697806 1131990351 /nfs/dbraw/zinc/99/03/51/1131990351.db2.gz QLFKQEPUCUHSHK-OCCSQVGLSA-N 1 0 265.422 3.719 20 10 CHCDRO C[C@H]([NH2+]CCc1ccc(F)cc1)c1ccc(N(C)C)cc1 ZINC000037195969 1132008874 /nfs/dbraw/zinc/00/88/74/1132008874.db2.gz IWJYMXZCKTUDGU-AWEZNQCLSA-N 1 0 286.394 3.785 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)Cc1ccco1)c1ccc(N(C)C)cc1 ZINC000037291937 1132026689 /nfs/dbraw/zinc/02/66/89/1132026689.db2.gz FUNQDJWVAZLHRU-UONOGXRCSA-N 1 0 272.392 3.627 20 10 CHCDRO C[C@@H](c1ccc(Cl)cc1)[N@H+](C)Cc1cc(O)ccc1O ZINC001141160562 1132030981 /nfs/dbraw/zinc/03/09/81/1132030981.db2.gz FAYXFMFLPVVVEV-NSHDSACASA-N 1 0 291.778 3.944 20 10 CHCDRO Oc1ccc(O)c(C[N@@H+]2CCC[C@@H]2C2CCCCC2)c1 ZINC001141160944 1132031281 /nfs/dbraw/zinc/03/12/81/1132031281.db2.gz KIYZGSMCBVSFSZ-MRXNPFEDSA-N 1 0 275.392 3.643 20 10 CHCDRO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1cc(O)ccc1O ZINC001141160574 1132031370 /nfs/dbraw/zinc/03/13/70/1132031370.db2.gz FCOCJPDFCYGOED-QGZVFWFLSA-N 1 0 283.371 3.607 20 10 CHCDRO Cc1cc(O)c(C[NH+]2CCC(C3CC3)CC2)cc1Cl ZINC001206141890 1132062623 /nfs/dbraw/zinc/06/26/23/1132062623.db2.gz IIOOSXYXNPHTDR-UHFFFAOYSA-N 1 0 279.811 3.976 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CCC23CCCC3)cc1 ZINC001171763422 1132091099 /nfs/dbraw/zinc/09/10/99/1132091099.db2.gz BHEPZSBOCDRWSN-UHFFFAOYSA-N 1 0 258.409 3.661 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)[C@@H]1CSc2ccccc2C1 ZINC001172206567 1132141225 /nfs/dbraw/zinc/14/12/25/1132141225.db2.gz ROWSJTXYMFCXCA-INIZCTEOSA-N 1 0 299.439 3.931 20 10 CHCDRO CC[C@H](C)OCC[C@H](C)[NH2+]Cc1ccc(OC)c(C)c1 ZINC001172322196 1132159447 /nfs/dbraw/zinc/15/94/47/1132159447.db2.gz ARYXDEHGUBATRW-GJZGRUSLSA-N 1 0 279.424 3.687 20 10 CHCDRO CC[C@H](C)OCC[C@H](C)[NH2+][C@@H](C)c1ccccc1O ZINC001172328843 1132172689 /nfs/dbraw/zinc/17/26/89/1132172689.db2.gz QFMXGXDHTJRTLG-IHRRRGAJSA-N 1 0 265.397 3.637 20 10 CHCDRO CC[C@H](C)OCC[C@H](C)[NH2+][C@H](C)c1ccccc1O ZINC001172328844 1132172714 /nfs/dbraw/zinc/17/27/14/1132172714.db2.gz QFMXGXDHTJRTLG-MELADBBJSA-N 1 0 265.397 3.637 20 10 CHCDRO CC[C@@H](C)OCC[C@@H](C)[NH2+]Cc1c(C)cc(C)cc1O ZINC001172340107 1132176356 /nfs/dbraw/zinc/17/63/56/1132176356.db2.gz VYJGGJHZJNOKHP-HUUCEWRRSA-N 1 0 279.424 3.692 20 10 CHCDRO Oc1ccc(C[NH2+][C@H]2CC[C@@H](c3ccccc3)C2)cc1O ZINC001172552508 1132265731 /nfs/dbraw/zinc/26/57/31/1132265731.db2.gz FQRKADLZVQMFMS-CVEARBPZSA-N 1 0 283.371 3.524 20 10 CHCDRO CCO[C@H]1C[C@@H]([NH2+][C@@H](CC)c2cc(Cl)ccc2O)C1 ZINC000840764696 1132283886 /nfs/dbraw/zinc/28/38/86/1132283886.db2.gz YBLKXNMEQURLDY-SCRDCRAPSA-N 1 0 283.799 3.654 20 10 CHCDRO CCO[C@H]1C[C@@H]([NH2+][C@@H](C)c2ccc3ccccc3c2O)C1 ZINC000840764737 1132285087 /nfs/dbraw/zinc/28/50/87/1132285087.db2.gz YYHHPDNHMSKDQC-AEGPPILISA-N 1 0 285.387 3.764 20 10 CHCDRO COc1ccc(C[NH2+]C2CC(C)(C)OC(C)(C)C2)cc1C ZINC001172653014 1132289221 /nfs/dbraw/zinc/28/92/21/1132289221.db2.gz XUGZMRULWKRMIF-UHFFFAOYSA-N 1 0 291.435 3.829 20 10 CHCDRO COCC[C@H](C)C[NH2+][C@H](C)c1cc(Cl)cc(C)c1O ZINC000840836235 1132291627 /nfs/dbraw/zinc/29/16/27/1132291627.db2.gz WFBKPPHNFMLGSI-CMPLNLGQSA-N 1 0 285.815 3.677 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)[C@@](C)(OC)C1CC1)c1ccccc1O ZINC000840860508 1132296295 /nfs/dbraw/zinc/29/62/95/1132296295.db2.gz VHOYJMWIYJVNNU-YLQAJVPDSA-N 1 0 277.408 3.637 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CS[C@@H](C)C2)c(O)c1C ZINC000840859760 1132296429 /nfs/dbraw/zinc/29/64/29/1132296429.db2.gz MGJMGOPQGDKAGG-DRZSPHRISA-N 1 0 265.422 3.554 20 10 CHCDRO CC(C)(C)c1ccncc1C[NH2+][C@H]1CCc2cccc(O)c21 ZINC000840857495 1132296511 /nfs/dbraw/zinc/29/65/11/1132296511.db2.gz MLUARALHCUGINL-INIZCTEOSA-N 1 0 296.414 3.862 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CS[C@H](C)C1)c1cc(Cl)ccc1O ZINC000840860939 1132297231 /nfs/dbraw/zinc/29/72/31/1132297231.db2.gz YBWJTPYOXQGFTQ-CDMKHQONSA-N 1 0 285.840 3.980 20 10 CHCDRO COCC1CCC([NH2+][C@@H](C)c2ccc(C)c(C)c2O)CC1 ZINC000840882416 1132301680 /nfs/dbraw/zinc/30/16/80/1132301680.db2.gz VLBREYAHQRFQKH-FHERZECASA-N 1 0 291.435 3.865 20 10 CHCDRO CS[C@H]1CC[C@@H]([NH2+]Cc2c(O)cc(C)cc2Cl)C1 ZINC000840906179 1132307246 /nfs/dbraw/zinc/30/72/46/1132307246.db2.gz VUBZQPUFMKRIKF-MNOVXSKESA-N 1 0 285.840 3.728 20 10 CHCDRO CO[C@]1(C)CCC[N@H+](Cc2c(O)cc(C)cc2Cl)CC1 ZINC000840940860 1132309623 /nfs/dbraw/zinc/30/96/23/1132309623.db2.gz IMWISPMLKBGPHA-MRXNPFEDSA-N 1 0 297.826 3.745 20 10 CHCDRO CCc1cnccc1[C@@H](C)[NH2+]Cc1ccc(N(C)C)cc1C ZINC000840936975 1132309721 /nfs/dbraw/zinc/30/97/21/1132309721.db2.gz PGISUVIEUAPSDI-OAHLLOKOSA-N 1 0 297.446 3.869 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@H]1c1ccncc1 ZINC000840946930 1132312384 /nfs/dbraw/zinc/31/23/84/1132312384.db2.gz XTGAAAHEOGJBAV-IBGZPJMESA-N 1 0 295.430 3.793 20 10 CHCDRO C[C@H]1C[C@H]2C[N@H+](Cc3c(O)ccc4ccccc43)CC[C@H]2O1 ZINC001231587585 1132317387 /nfs/dbraw/zinc/31/73/87/1132317387.db2.gz VTKVUWXAJFZTEK-ZUEVXXBESA-N 1 0 297.398 3.545 20 10 CHCDRO CC[N@H+](Cc1cccnc1)Cc1c(O)ccc2ccccc21 ZINC001231590169 1132317927 /nfs/dbraw/zinc/31/79/27/1132317927.db2.gz OIWJLPCZYOWHBL-UHFFFAOYSA-N 1 0 292.382 3.963 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CCC[C@@H](F)CC1 ZINC001231588818 1132319544 /nfs/dbraw/zinc/31/95/44/1132319544.db2.gz VLEDFCGDWCZFRD-CQSZACIVSA-N 1 0 273.351 3.869 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCSc3ccccc3C2)c1O ZINC001231594818 1132321101 /nfs/dbraw/zinc/32/11/01/1132321101.db2.gz PNKGBFBUUZSKNF-UHFFFAOYSA-N 1 0 285.412 3.809 20 10 CHCDRO C[C@@H]([NH3+])c1ccc(NC/C=C\c2ccc(N(C)C)cc2)cc1 ZINC000841031032 1132321305 /nfs/dbraw/zinc/32/13/05/1132321305.db2.gz OAJDXRJAYUJXLY-FOSCPCJNSA-N 1 0 295.430 3.898 20 10 CHCDRO Cc1cc(O)c(C[NH2+]Cc2ccc3c(c2)CCCN3)cc1C ZINC000841070095 1132325059 /nfs/dbraw/zinc/32/50/59/1132325059.db2.gz KUPXNASIRKAGSL-UHFFFAOYSA-N 1 0 296.414 3.657 20 10 CHCDRO C[NH+]1CCC(c2ccc(Nc3ccc(N)cc3)cc2)CC1 ZINC001212690736 1132348137 /nfs/dbraw/zinc/34/81/37/1132348137.db2.gz USOFARJJACCNNN-UHFFFAOYSA-N 1 0 281.403 3.822 20 10 CHCDRO Cc1cc(C)c(C[NH+]2C[C@@H]3CCCC[C@H]3C2)c(O)c1 ZINC001231842582 1132376442 /nfs/dbraw/zinc/37/64/42/1132376442.db2.gz OTSGATUJFREGPB-GJZGRUSLSA-N 1 0 259.393 3.631 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCCC[C@](C)(F)C2)c(O)c1 ZINC001231842998 1132377331 /nfs/dbraw/zinc/37/73/31/1132377331.db2.gz RQWYCFQWUYAPBQ-INIZCTEOSA-N 1 0 265.372 3.723 20 10 CHCDRO Cc1cc(C)c(C[N@H+](C)Cc2cccs2)c(O)c1 ZINC001231845885 1132378164 /nfs/dbraw/zinc/37/81/64/1132378164.db2.gz SUQDPZNVBXTQIM-UHFFFAOYSA-N 1 0 261.390 3.703 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCC[C@@H]3CCC[C@@H]32)c(O)c1 ZINC001231846963 1132379888 /nfs/dbraw/zinc/37/98/88/1132379888.db2.gz TYPFBKJYSMBKNF-HOCLYGCPSA-N 1 0 259.393 3.774 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CC[C@@H]2c2ccccc2)c(O)c1 ZINC001231845602 1132380128 /nfs/dbraw/zinc/38/01/28/1132380128.db2.gz CFAUHKKSSKHMEV-QGZVFWFLSA-N 1 0 267.372 3.956 20 10 CHCDRO CCN(CC[NH+](CC)CC)Cc1cc(Cl)c(C)cc1O ZINC001231870471 1132385788 /nfs/dbraw/zinc/38/57/88/1132385788.db2.gz DGFKXEJVLASGBO-UHFFFAOYSA-N 1 0 298.858 3.518 20 10 CHCDRO Oc1c(C[N@@H+]2CCC[C@H](F)CC2)ccc2ccccc21 ZINC001231879684 1132389713 /nfs/dbraw/zinc/38/97/13/1132389713.db2.gz NPKLVOYRKCQMCV-HNNXBMFYSA-N 1 0 273.351 3.869 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1ccc(Cl)cc1O)[C@@H]1CCCO1 ZINC000841751114 1132389889 /nfs/dbraw/zinc/38/98/89/1132389889.db2.gz KSSUWMXDEQKTJG-DGFSRKRXSA-N 1 0 283.799 3.654 20 10 CHCDRO C[C@H]1C[C@H]2C[N@H+](Cc3ccc4ccccc4c3O)CC[C@H]2O1 ZINC001231879290 1132389956 /nfs/dbraw/zinc/38/99/56/1132389956.db2.gz YSJHFLRBDPQFBP-QANKJYHBSA-N 1 0 297.398 3.545 20 10 CHCDRO C[C@@H]([NH2+]C[C@H](C)c1nccs1)c1ccc(Cl)cc1O ZINC000841751604 1132390039 /nfs/dbraw/zinc/39/00/39/1132390039.db2.gz IFJHOUFAEYDTQL-VHSXEESVSA-N 1 0 296.823 3.956 20 10 CHCDRO CCOCC1CC[NH+](Cc2ccc3ccccc3c2O)CC1 ZINC001231881596 1132391010 /nfs/dbraw/zinc/39/10/10/1132391010.db2.gz YATXQOSUQJHKHE-UHFFFAOYSA-N 1 0 299.414 3.794 20 10 CHCDRO C[C@@H]([NH2+]C[C@H](O)C1CCCCC1)c1ccc(Cl)cc1O ZINC000841746416 1132390981 /nfs/dbraw/zinc/39/09/81/1132390981.db2.gz GOXLRKGQCAAZNH-BZNIZROVSA-N 1 0 297.826 3.637 20 10 CHCDRO CO[C@](C)(C[NH2+][C@@H](C)c1ccc(Cl)cc1O)C1CC1 ZINC000841758568 1132395248 /nfs/dbraw/zinc/39/52/48/1132395248.db2.gz SVJUWWIZTTWIFG-ZUZCIYMTSA-N 1 0 283.799 3.511 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H](CO)CC2CCCCC2)c(O)c1 ZINC000841760982 1132396190 /nfs/dbraw/zinc/39/61/90/1132396190.db2.gz HLJFXZKJRWYVIW-HOCLYGCPSA-N 1 0 291.435 3.683 20 10 CHCDRO COc1cccc2c(C[N@H+](C)Cc3ccccc3O)c[nH]c21 ZINC001231899876 1132397640 /nfs/dbraw/zinc/39/76/40/1132397640.db2.gz WUGDZIYFJFIIHG-UHFFFAOYSA-N 1 0 296.370 3.514 20 10 CHCDRO CCCOC1CCC([N@H+](CC)Cc2ccccc2O)CC1 ZINC001173100106 1132405000 /nfs/dbraw/zinc/40/50/00/1132405000.db2.gz ARDOQWWZHFFXNJ-UHFFFAOYSA-N 1 0 291.435 3.952 20 10 CHCDRO Oc1cc(O)c(C[N@@H+]2CCC23CCCCC3)cc1Cl ZINC001232261353 1132445013 /nfs/dbraw/zinc/44/50/13/1132445013.db2.gz ZRRRXZHXUWINAT-UHFFFAOYSA-N 1 0 281.783 3.660 20 10 CHCDRO Oc1cc(O)c(C[N@@H+]2CCC[C@@H]3CCC[C@H]32)cc1Cl ZINC001232268500 1132446565 /nfs/dbraw/zinc/44/65/65/1132446565.db2.gz PWNWTMISVAYUKC-GXFFZTMASA-N 1 0 281.783 3.516 20 10 CHCDRO Oc1cc(O)c(C[N@@H+]2CCC[C@@H]3CCC[C@@H]32)cc1Cl ZINC001232268498 1132446784 /nfs/dbraw/zinc/44/67/84/1132446784.db2.gz PWNWTMISVAYUKC-GWCFXTLKSA-N 1 0 281.783 3.516 20 10 CHCDRO COc1cc(O)c(C[N@H+](C)CC2CCCC2)cc1Cl ZINC001232270248 1132447166 /nfs/dbraw/zinc/44/71/66/1132447166.db2.gz ZJFTYNTURQEEGR-UHFFFAOYSA-N 1 0 283.799 3.676 20 10 CHCDRO Oc1ccccc1C[NH2+]C1(c2ccccc2Cl)CC1 ZINC000842724873 1132455059 /nfs/dbraw/zinc/45/50/59/1132455059.db2.gz HKCXYRHHPKATCQ-UHFFFAOYSA-N 1 0 273.763 3.825 20 10 CHCDRO C[C@H](C[NH2+]C/C=C/c1ccc(N(C)C)cc1)CC(F)F ZINC000842730404 1132455135 /nfs/dbraw/zinc/45/51/35/1132455135.db2.gz XWZIHSJOIXXTJZ-IHVVCDCBSA-N 1 0 282.378 3.647 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]C[C@H]1C[C@@H]1c1ccccc1)CC2 ZINC000842903838 1132474825 /nfs/dbraw/zinc/47/48/25/1132474825.db2.gz YUXLIZPAFGFEDC-BRWVUGGUSA-N 1 0 279.383 3.773 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]CC2CCC(F)CC2)c1 ZINC000842926676 1132475738 /nfs/dbraw/zinc/47/57/38/1132475738.db2.gz APGVAUVQQHRARV-PNESKVBLSA-N 1 0 281.371 3.580 20 10 CHCDRO CC(C)(C)c1cccc(C[N@@H+]2CCCC23CC3)c1O ZINC001143104779 1132501373 /nfs/dbraw/zinc/50/13/73/1132501373.db2.gz ZRHUETRXZGLTOX-UHFFFAOYSA-N 1 0 259.393 3.818 20 10 CHCDRO C[C@H]1CCC[N@H+](Cc2cccc(C(C)(C)C)c2O)C1 ZINC001143102145 1132502716 /nfs/dbraw/zinc/50/27/16/1132502716.db2.gz ZTLYRKHCCJBPNB-ZDUSSCGKSA-N 1 0 261.409 3.922 20 10 CHCDRO CC(C)(C)c1cccc(C[N@@H+]2CCc3occc3C2)c1O ZINC001143112836 1132503899 /nfs/dbraw/zinc/50/38/99/1132503899.db2.gz ZHOISFHBBKXPMO-UHFFFAOYSA-N 1 0 285.387 3.841 20 10 CHCDRO CC(C)(C)c1cccc(C[NH+]2CC3CC(C3)C2)c1O ZINC001143112287 1132504645 /nfs/dbraw/zinc/50/46/45/1132504645.db2.gz OLZJKUMCOQAYRM-UHFFFAOYSA-N 1 0 259.393 3.532 20 10 CHCDRO COc1cccc(C[N@@H+]2CCCC[C@H]2C2CCC2)c1O ZINC000843437598 1132534455 /nfs/dbraw/zinc/53/44/55/1132534455.db2.gz OSJBHCAUYGVRQD-HNNXBMFYSA-N 1 0 275.392 3.555 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CCC[C@H]2CCCC[C@H]21 ZINC000236559643 1132545920 /nfs/dbraw/zinc/54/59/20/1132545920.db2.gz AWPDXFIRAFBXBC-IUODEOHRSA-N 1 0 263.356 3.686 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1ccc(C)c(O)c1 ZINC001233235033 1132586958 /nfs/dbraw/zinc/58/69/58/1132586958.db2.gz MMQXFRWRBIOVCI-UHFFFAOYSA-N 1 0 298.430 3.789 20 10 CHCDRO Cc1ccc(Cl)cc1C[N@@H+](C)Cc1ccccc1O ZINC001233250683 1132588119 /nfs/dbraw/zinc/58/81/19/1132588119.db2.gz VDSRDSDIYKXHIH-UHFFFAOYSA-N 1 0 275.779 3.986 20 10 CHCDRO CCCO[C@@H]1CC[N@H+](Cc2cc(C(C)(C)C)ccc2O)C1 ZINC001233286072 1132594874 /nfs/dbraw/zinc/59/48/74/1132594874.db2.gz DJZQVSDYYUXKIO-MRXNPFEDSA-N 1 0 291.435 3.691 20 10 CHCDRO CC(C)O[C@@H]1CC[N@H+](Cc2cc(C(C)(C)C)ccc2O)C1 ZINC001233286825 1132595476 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ZINC001233452466 1132626089 /nfs/dbraw/zinc/62/60/89/1132626089.db2.gz XWJQABOAZKGNHV-BXKDBHETSA-N 1 0 291.288 3.591 20 10 CHCDRO CCN(Cc1ccccc1O)c1[nH+]c(C)cc2[nH]ccc21 ZINC001154888418 1132629258 /nfs/dbraw/zinc/62/92/58/1132629258.db2.gz BXSQQDIYHICAGH-UHFFFAOYSA-N 1 0 281.359 3.603 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]CCCOC(C)C)c1O ZINC000808672398 1132755640 /nfs/dbraw/zinc/75/56/40/1132755640.db2.gz MJNHJMQSDGJGAL-GFCCVEGCSA-N 1 0 285.815 3.820 20 10 CHCDRO C[C@@H]1C[C@@H]([NH3+])C[C@H](c2ccncc2Nc2ccc(N)cc2)C1 ZINC001159383711 1132837335 /nfs/dbraw/zinc/83/73/35/1132837335.db2.gz KOUCOAKKGDTORZ-GZBFAFLISA-N 1 0 296.418 3.638 20 10 CHCDRO Nc1ccc(Nc2ccc(C[C@@H]3CCC[NH2+]C3)cc2)cc1 ZINC001160257347 1132952216 /nfs/dbraw/zinc/95/22/16/1132952216.db2.gz YJUXVUZRJZQASE-HNNXBMFYSA-N 1 0 281.403 3.555 20 10 CHCDRO COc1ccc(C[NH+]2CCC3(CC[C@@H](F)C3)CC2)c(O)c1 ZINC001203629168 1133346073 /nfs/dbraw/zinc/34/60/73/1133346073.db2.gz ROVJGUMLXJRWTM-CQSZACIVSA-N 1 0 293.382 3.505 20 10 CHCDRO COc1ccc(O)c(C[N@H+](C)Cc2ccc(C)c(C)c2)c1 ZINC001203681101 1133353136 /nfs/dbraw/zinc/35/31/36/1133353136.db2.gz PCSZJQOZJGDPPS-UHFFFAOYSA-N 1 0 285.387 3.650 20 10 CHCDRO Cc1ccccc1[C@H]1CCC[N@@H+]1Cc1ccc(O)c(O)c1 ZINC001203878895 1133378403 /nfs/dbraw/zinc/37/84/03/1133378403.db2.gz XZHQVDOBGLFGKR-MRXNPFEDSA-N 1 0 283.371 3.743 20 10 CHCDRO CCCO[C@H]1CC[N@H+](Cc2ccc(N(CC)CC)cc2)C1 ZINC001203939012 1133385739 /nfs/dbraw/zinc/38/57/39/1133385739.db2.gz IRTIUJMRSLYUTP-SFHVURJKSA-N 1 0 290.451 3.534 20 10 CHCDRO C[C@H]1CC[N@H+](Cc2ccc(N(C)C)cc2)CCC1(F)F ZINC001203930326 1133386057 /nfs/dbraw/zinc/38/60/57/1133386057.db2.gz RZPYFDIXSWYJMT-ZDUSSCGKSA-N 1 0 282.378 3.620 20 10 CHCDRO C[C@@H]1c2ccccc2CC[N@H+]1Cc1ccc(N(C)C)cc1 ZINC001203930319 1133386902 /nfs/dbraw/zinc/38/69/02/1133386902.db2.gz RUDYCILAFFBEKS-OAHLLOKOSA-N 1 0 280.415 3.872 20 10 CHCDRO CSCC(C)(C)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC001203953303 1133389565 /nfs/dbraw/zinc/38/95/65/1133389565.db2.gz GTJNXTPWSGVZEB-UHFFFAOYSA-N 1 0 292.492 3.908 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)c2ccccc12)C1CC1 ZINC001204232467 1133422139 /nfs/dbraw/zinc/42/21/39/1133422139.db2.gz FHKLRXUQGWMMBU-UHFFFAOYSA-N 1 0 268.404 3.890 20 10 CHCDRO COC[C@@H]1CCC[N@@H+]1Cc1ccc(N(C)C)c2ccccc12 ZINC001204232865 1133422746 /nfs/dbraw/zinc/42/27/46/1133422746.db2.gz KWLSMQLZFXBYCT-INIZCTEOSA-N 1 0 298.430 3.517 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)C2CCOCC2)c2ccccc21 ZINC001204232621 1133423317 /nfs/dbraw/zinc/42/33/17/1133423317.db2.gz GPULYQAOKYXBOW-UHFFFAOYSA-N 1 0 298.430 3.517 20 10 CHCDRO C[N@H+](CCC1CC1)Cc1ccc(N2CCCC2)cc1 ZINC001204328140 1133437810 /nfs/dbraw/zinc/43/78/10/1133437810.db2.gz CRMXKCPVPRAVFZ-UHFFFAOYSA-N 1 0 258.409 3.519 20 10 CHCDRO CC[C@H](C)C[N@H+](CC)Cc1ccc(Cl)cc1[O-] ZINC001204401658 1133442953 /nfs/dbraw/zinc/44/29/53/1133442953.db2.gz KRUQUKNGYUXCTF-NSHDSACASA-N 1 0 255.789 3.914 20 10 CHCDRO CCC[N@H+](Cc1cc(C)co1)Cc1ccccc1O ZINC001204756824 1133481857 /nfs/dbraw/zinc/48/18/57/1133481857.db2.gz PHAAEPONMIZVMU-UHFFFAOYSA-N 1 0 259.349 3.706 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@H]2CCC[C@@H]21 ZINC001204887939 1133496471 /nfs/dbraw/zinc/49/64/71/1133496471.db2.gz CRDDQXWSOWFBGJ-QAPCUYQASA-N 1 0 272.436 3.826 20 10 CHCDRO COc1cc(C)cc(C[NH2+][C@@H]2CCCC(C)(C)C2)c1O ZINC001205430532 1133576945 /nfs/dbraw/zinc/57/69/45/1133576945.db2.gz AXEUNIMDUBMDMK-CQSZACIVSA-N 1 0 277.408 3.768 20 10 CHCDRO Cc1ccc(Nc2cc(C)[nH+]c3ccccc23)c(O)c1 ZINC001206246718 1133675243 /nfs/dbraw/zinc/67/52/43/1133675243.db2.gz CMBYPUMTKNWVIP-UHFFFAOYSA-N 1 0 264.328 3.723 20 10 CHCDRO Nc1cc(Nc2cccc3c2C(=O)c2ccccc2-3)cc[nH+]1 ZINC001206568520 1133719705 /nfs/dbraw/zinc/71/97/05/1133719705.db2.gz LZCARUAENWATAN-UHFFFAOYSA-N 1 0 287.322 3.619 20 10 CHCDRO Oc1cccc2c1C[N@H+](CCCCc1ccccc1)CC2 ZINC001207616987 1133832146 /nfs/dbraw/zinc/83/21/46/1133832146.db2.gz PBERSIGUVBMUDM-UHFFFAOYSA-N 1 0 281.399 3.773 20 10 CHCDRO CC(C)c1ccc(O)c(C[NH2+][C@@H](CCO)C2CCCC2)c1 ZINC001207675075 1133838043 /nfs/dbraw/zinc/83/80/43/1133838043.db2.gz JPPMMLRGIDPRGT-KRWDZBQOSA-N 1 0 291.435 3.546 20 10 CHCDRO CCc1ccc2c(c1)CC[N@@H+](Cc1cc(OC)ccc1O)C2 ZINC001207845215 1133853195 /nfs/dbraw/zinc/85/31/95/1133853195.db2.gz WOKXGZRPUBCPAL-UHFFFAOYSA-N 1 0 297.398 3.522 20 10 CHCDRO CC/C=C\CCC[N@H+](C)Cc1ccc(N(C)C)cc1 ZINC001208139339 1133884737 /nfs/dbraw/zinc/88/47/37/1133884737.db2.gz XVFRUMWLPZSJBV-SREVYHEPSA-N 1 0 260.425 3.931 20 10 CHCDRO CC1=C[C@H](C)[C@H](C[N@@H+]2CCc3cccc(O)c3C2)CC1 ZINC001208184007 1133900917 /nfs/dbraw/zinc/90/09/17/1133900917.db2.gz ZMQNCEMLDDXNEK-HOCLYGCPSA-N 1 0 271.404 3.743 20 10 CHCDRO CC[N@H+](CCc1ccc(F)c(F)c1)Cc1ccccc1O ZINC001209245558 1133996845 /nfs/dbraw/zinc/99/68/45/1133996845.db2.gz JYCPCFIYCRCUOZ-UHFFFAOYSA-N 1 0 291.341 3.735 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(C[NH+]2CCCC2)cc1 ZINC001209519616 1134034211 /nfs/dbraw/zinc/03/42/11/1134034211.db2.gz YKOVURARPARARR-UHFFFAOYSA-N 1 0 254.377 3.690 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(C[NH+]2CC3(CSC3)C2)cc1 ZINC001209519693 1134034598 /nfs/dbraw/zinc/03/45/98/1134034598.db2.gz FHMPAGJPEPYZLJ-UHFFFAOYSA-N 1 0 298.455 3.643 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(CN(C)Cc2ccon2)cc1 ZINC001209520249 1134035065 /nfs/dbraw/zinc/03/50/65/1134035065.db2.gz SGVBYZJLPCUZEU-UHFFFAOYSA-N 1 0 295.386 3.714 20 10 CHCDRO CC[NH+](CC)Cc1ccc(Nc2ccc(N)cc2)cc1 ZINC001209823570 1134072042 /nfs/dbraw/zinc/07/20/42/1134072042.db2.gz IRILDZCALWFQOE-UHFFFAOYSA-N 1 0 269.392 3.854 20 10 CHCDRO Cn1c[nH+]cc1Nc1ccccc1C(=O)c1ccc(F)cc1 ZINC001211249646 1134399230 /nfs/dbraw/zinc/39/92/30/1134399230.db2.gz XWBSCEGSRPKGLA-UHFFFAOYSA-N 1 0 295.317 3.534 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]C1C[C@H]2CC[C@@H](C1)S2 ZINC000403607144 1134812646 /nfs/dbraw/zinc/81/26/46/1134812646.db2.gz TZDGXSOVBBYKPV-FGWVZKOKSA-N 1 0 283.824 3.562 20 10 CHCDRO O=C1C=CC(=NNc2ccc(O[C@@H]3CCC[NH2+]C3)cc2)C=C1 ZINC001217965449 1135032870 /nfs/dbraw/zinc/03/28/70/1135032870.db2.gz OCJCPMYLGBOKIK-QGZVFWFLSA-N 1 0 297.358 3.938 20 10 CHCDRO C[C@@H](OC1=CC(=O)C=CC1=NNc1ccccc1)C1C[NH2+]C1 ZINC001218198239 1135068159 /nfs/dbraw/zinc/06/81/59/1135068159.db2.gz FJAVEXPMXFPIEY-WMSNYHIESA-N 1 0 297.358 3.794 20 10 CHCDRO O=C1C=CC(=NNc2ccccc2)C(O[C@H]2CCC[NH2+]C2)=C1 ZINC001218283345 1135078938 /nfs/dbraw/zinc/07/89/38/1135078938.db2.gz HIFLUEKSTTWBEI-CVTQAYBASA-N 1 0 297.358 3.938 20 10 CHCDRO CC(C)C[C@@H](Oc1ccc(N2CC[NH2+]CC2)cc1)C(C)C ZINC001218296386 1135081208 /nfs/dbraw/zinc/08/12/08/1135081208.db2.gz KIACSZYESRLRTD-GOSISDBHSA-N 1 0 290.451 3.546 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2ccsc2Cl)c1 ZINC000312765820 1135135729 /nfs/dbraw/zinc/13/57/29/1135135729.db2.gz NDGHVBVEADMGDH-UHFFFAOYSA-N 1 0 267.781 3.705 20 10 CHCDRO CCc1ccccc1C[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000315396818 1135153628 /nfs/dbraw/zinc/15/36/28/1135153628.db2.gz NYXOLXCKEOZEOK-UHFFFAOYSA-N 1 0 294.442 3.921 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCc3ccccc3C2)c1 ZINC000315472611 1135154809 /nfs/dbraw/zinc/15/48/09/1135154809.db2.gz RJVOGXJMEASIHB-XJKSGUPXSA-N 1 0 297.398 3.609 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCN(C)[C@@H](C)C1)c1ccc2ccccc2c1O ZINC000316830242 1135169418 /nfs/dbraw/zinc/16/94/18/1135169418.db2.gz RVFHFZKHYXGQQW-OFQRWUPVSA-N 1 0 298.430 3.679 20 10 CHCDRO CCc1ccc(C[NH2+]Cc2c(C)c3ccccc3n2C)cn1 ZINC000352705119 529653860 /nfs/dbraw/zinc/65/38/60/529653860.db2.gz KDFMDTJMBVRTQB-UHFFFAOYSA-N 1 0 293.414 3.734 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCc2ccccc21)c1ccccc1O ZINC000020129741 171017867 /nfs/dbraw/zinc/01/78/67/171017867.db2.gz JAMZRKGHGBRESE-BLLLJJGKSA-N 1 0 253.345 3.730 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@@H]2CCCc3ccccc32)c1 ZINC000020133808 171022122 /nfs/dbraw/zinc/02/21/22/171022122.db2.gz DNARGYBSJCEBKR-QGZVFWFLSA-N 1 0 283.371 3.568 20 10 CHCDRO C[C@H](CCc1ccccc1)[NH2+]Cc1ccccc1O ZINC000020138336 171026103 /nfs/dbraw/zinc/02/61/03/171026103.db2.gz KKGSJYLIMHXEIT-CQSZACIVSA-N 1 0 255.361 3.503 20 10 CHCDRO COc1cccc(C[NH2+][C@H](C)CCCC(C)C)c1O ZINC000020138723 171026109 /nfs/dbraw/zinc/02/61/09/171026109.db2.gz RSAMJIOZDYZYKN-CYBMUJFWSA-N 1 0 265.397 3.705 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+][C@H]1CCCc2occc21 ZINC000020204570 171069224 /nfs/dbraw/zinc/06/92/24/171069224.db2.gz ATCWGOAHKFPCCA-ZDUSSCGKSA-N 1 0 277.751 3.806 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2CCCc3occc32)c1 ZINC000020204540 171069787 /nfs/dbraw/zinc/06/97/87/171069787.db2.gz IPDRUEJVNGDUIK-NHYWBVRUSA-N 1 0 287.359 3.722 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]CCCc1ccccc1 ZINC000021813416 171330363 /nfs/dbraw/zinc/33/03/63/171330363.db2.gz YZHRZNNWNPWYOD-UHFFFAOYSA-N 1 0 275.779 3.768 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[NH2+]C1CCCCC1 ZINC000035275593 172095634 /nfs/dbraw/zinc/09/56/34/172095634.db2.gz BQZKLQLKPYAUMW-UHFFFAOYSA-N 1 0 258.409 3.709 20 10 CHCDRO CC[C@H]([NH2+]CC1CCC1)c1cc(Br)ccc1O ZINC000037179916 173012842 /nfs/dbraw/zinc/01/28/42/173012842.db2.gz VRMRIYUZXIMTBT-ZDUSSCGKSA-N 1 0 298.224 3.996 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCC[C@H](C)C2)c1 ZINC000037254121 173065552 /nfs/dbraw/zinc/06/55/52/173065552.db2.gz NRIDADHARZCPOW-RWMBFGLXSA-N 1 0 263.381 3.630 20 10 CHCDRO CSC[C@H](C)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000076769194 260166472 /nfs/dbraw/zinc/16/64/72/260166472.db2.gz ZENYBCLENQMAGG-AWEZNQCLSA-N 1 0 278.465 3.518 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCCO1)c1ccc(N2CCCCC2)cc1 ZINC000153136668 261073541 /nfs/dbraw/zinc/07/35/41/261073541.db2.gz QASVERGWUKBZBV-YJBOKZPZSA-N 1 0 288.435 3.507 20 10 CHCDRO CC[C@@H]([NH2+][C@H](COC)c1ccccc1)c1ccccc1O ZINC000156573630 261126443 /nfs/dbraw/zinc/12/64/43/261126443.db2.gz VCSHDHHASOZJRR-IAGOWNOFSA-N 1 0 285.387 3.821 20 10 CHCDRO CCC[N@H+](Cc1ccn(C(C)C)n1)Cc1ccccc1O ZINC000172013384 261490561 /nfs/dbraw/zinc/49/05/61/261490561.db2.gz CWOOJSZSKUIAQH-UHFFFAOYSA-N 1 0 287.407 3.582 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCOc2ccc(F)cc21)c1ccccc1O ZINC000183599244 261981834 /nfs/dbraw/zinc/98/18/34/261981834.db2.gz LBRLDGFOJGJWAR-NHYWBVRUSA-N 1 0 287.334 3.706 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(F)c(C)c2)c(O)c1 ZINC000184911808 262033219 /nfs/dbraw/zinc/03/32/19/262033219.db2.gz OGABXRTVVYOIBT-ZDUSSCGKSA-N 1 0 273.351 3.999 20 10 CHCDRO Cc1cc(C[NH2+][C@H](C)c2cc(F)ccc2O)ccc1F ZINC000184911859 262033453 /nfs/dbraw/zinc/03/34/53/262033453.db2.gz OELIEMKXZJRRAK-LLVKDONJSA-N 1 0 277.314 3.830 20 10 CHCDRO C[C@@H]([NH2+]CCc1cccnc1)c1cc2c(cc1O)CCCC2 ZINC000184980519 262035820 /nfs/dbraw/zinc/03/58/20/262035820.db2.gz VSNJFBDTHULGPD-CQSZACIVSA-N 1 0 296.414 3.559 20 10 CHCDRO CO[C@H](C[NH2+][C@H](C)c1cc(F)ccc1O)c1ccccc1 ZINC000185102214 262040790 /nfs/dbraw/zinc/04/07/90/262040790.db2.gz BBQZMUPZEDMHGQ-SJKOYZFVSA-N 1 0 289.350 3.570 20 10 CHCDRO CO[C@@H](C[NH2+][C@@H](C)c1cc(F)ccc1O)c1ccccc1 ZINC000185102162 262040911 /nfs/dbraw/zinc/04/09/11/262040911.db2.gz BBQZMUPZEDMHGQ-SJCJKPOMSA-N 1 0 289.350 3.570 20 10 CHCDRO CCc1nc([C@@H](C)[NH2+][C@@H](C)c2cc(F)ccc2O)cs1 ZINC000185427134 262054541 /nfs/dbraw/zinc/05/45/41/262054541.db2.gz NRBKNZBDTTVXBA-VHSXEESVSA-N 1 0 294.395 3.962 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H](CCCO)c2ccccc2)c(O)c1 ZINC000185532632 262058807 /nfs/dbraw/zinc/05/88/07/262058807.db2.gz ADPXLEZRADDGSH-CRAIPNDOSA-N 1 0 299.414 3.865 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CC2(CCO)CCCCC2)c1 ZINC000185669222 262065064 /nfs/dbraw/zinc/06/50/64/262065064.db2.gz LDFIHYFNAFRRCP-OAHLLOKOSA-N 1 0 291.435 3.684 20 10 CHCDRO CCc1noc(CC)c1C[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000185678431 262065843 /nfs/dbraw/zinc/06/58/43/262065843.db2.gz KOHZZGWTKHGSSX-LBPRGKRZSA-N 1 0 288.391 3.664 20 10 CHCDRO COC[C@@H]([NH2+][C@H](C)c1cc(F)ccc1O)c1ccccc1 ZINC000186035511 262076257 /nfs/dbraw/zinc/07/62/57/262076257.db2.gz NHEBICJCAPTJRV-MLGOLLRUSA-N 1 0 289.350 3.570 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCOC2(CCCC2)C1)c1cc(F)ccc1O ZINC000186130133 262081092 /nfs/dbraw/zinc/08/10/92/262081092.db2.gz ZGZKOAMUOBOERS-GXTWGEPZSA-N 1 0 293.382 3.674 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2CCC(F)(F)C2)c1 ZINC000280750785 263064135 /nfs/dbraw/zinc/06/41/35/263064135.db2.gz BQCZFLGKRNKCAS-VXGBXAGGSA-N 1 0 269.335 3.787 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC[C@H]2c2ccncc2)cc1F ZINC000289886286 263112872 /nfs/dbraw/zinc/11/28/72/263112872.db2.gz SIVNLRBWLHXLAZ-KRWDZBQOSA-N 1 0 299.393 3.624 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)C[C@H](O)c2ccccc2)c(O)c1 ZINC000185834270 327847253 /nfs/dbraw/zinc/84/72/53/327847253.db2.gz LPTKGYVGNBFFBR-DAYGRLMNSA-N 1 0 299.414 3.863 20 10 CHCDRO COc1cccc(C2([NH2+][C@H](C)c3ccccc3O)CC2)c1 ZINC000272908836 328201285 /nfs/dbraw/zinc/20/12/85/328201285.db2.gz WHMFBXFEGWHGRS-CYBMUJFWSA-N 1 0 283.371 3.741 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H](C)c2nccs2)c(O)c1 ZINC000285128799 328247158 /nfs/dbraw/zinc/24/71/58/328247158.db2.gz LKPJSVROZRMMAZ-OLZOCXBDSA-N 1 0 290.432 3.920 20 10 CHCDRO COc1cccc(C[NH2+]Cc2ccccc2CC(C)C)c1O ZINC000527732499 326853826 /nfs/dbraw/zinc/85/38/26/326853826.db2.gz IOYLIWCFAICMHB-UHFFFAOYSA-N 1 0 299.414 3.889 20 10 CHCDRO CCOc1cccc(C[NH2+]C(CC)(C2CC2)C2CC2)c1O ZINC000527763152 326865631 /nfs/dbraw/zinc/86/56/31/326865631.db2.gz KPNTZTQONDUVKE-UHFFFAOYSA-N 1 0 289.419 3.849 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C[C@H]2CC[C@@H](c3ccccc3)O2)c1 ZINC000377784824 329029337 /nfs/dbraw/zinc/02/93/37/329029337.db2.gz XBIFOOXTUOLQGX-MJGOQNOKSA-N 1 0 297.398 3.711 20 10 CHCDRO Cc1cccc2c1OCC[C@H]2[NH2+][C@H](C)c1ccccc1O ZINC000189374418 329380375 /nfs/dbraw/zinc/38/03/75/329380375.db2.gz NSPDAFIFBCUCKE-CZUORRHYSA-N 1 0 283.371 3.875 20 10 CHCDRO c1ccc([C@H]([NH2+]Cc2ccc3c(c2)CCO3)C2CCC2)nc1 ZINC000527769857 330281838 /nfs/dbraw/zinc/28/18/38/330281838.db2.gz BYKVKYAMSCFWEE-LJQANCHMSA-N 1 0 294.398 3.648 20 10 CHCDRO CC[C@@H]([NH2+]CC[C@H]1CCCOC1)c1cc(Cl)ccc1O ZINC000527923636 330296014 /nfs/dbraw/zinc/29/60/14/330296014.db2.gz DDBFKPMACOTNFV-IUODEOHRSA-N 1 0 297.826 3.903 20 10 CHCDRO CC[C@H]([NH2+]Cc1cccnc1C)c1cc(Cl)ccc1O ZINC000527985697 330298671 /nfs/dbraw/zinc/29/86/71/330298671.db2.gz IESVWMQBVPQCRH-HNNXBMFYSA-N 1 0 290.794 3.990 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]CC[C@H]2CC=CCC2)c1 ZINC000527975902 330301983 /nfs/dbraw/zinc/30/19/83/330301983.db2.gz BKCMGXZARXWJII-KGLIPLIRSA-N 1 0 275.392 3.798 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]CCc1c[nH]c3ccccc13)CC2 ZINC000296113839 334905295 /nfs/dbraw/zinc/90/52/95/334905295.db2.gz UXOVSCUUPDOWIT-QGZVFWFLSA-N 1 0 292.382 3.693 20 10 CHCDRO CC(C)[N@H+](Cc1ccncc1)Cc1ccc(N(C)C)cc1 ZINC000265988456 519662907 /nfs/dbraw/zinc/66/29/07/519662907.db2.gz FBSYJYHBEJSQFG-UHFFFAOYSA-N 1 0 283.419 3.558 20 10 CHCDRO CC(C)[C@@H]([NH2+]Cc1cc2c(cc1O)OCO2)c1ccccc1 ZINC000236746319 519799113 /nfs/dbraw/zinc/79/91/13/519799113.db2.gz VTXCBPHDLUULTE-GOSISDBHSA-N 1 0 299.370 3.608 20 10 CHCDRO CCC[C@@H](CCO)C[NH2+][C@H](CC)c1ccc(C)cc1O ZINC000280224664 520702047 /nfs/dbraw/zinc/70/20/47/520702047.db2.gz UYVYKWDNNNPRMT-GOEBONIOSA-N 1 0 279.424 3.540 20 10 CHCDRO CCOc1cccc(C[NH2+][C@H](C)c2ccc(C)cc2O)c1 ZINC000037679469 521373960 /nfs/dbraw/zinc/37/39/60/521373960.db2.gz CGAVFTBJFUHISM-CQSZACIVSA-N 1 0 285.387 3.950 20 10 CHCDRO CCOCCC1(C[NH2+][C@H](CC)c2ccc(C)cc2O)CC1 ZINC000280128276 521691983 /nfs/dbraw/zinc/69/19/83/521691983.db2.gz OTRWDXABLOZNKY-MRXNPFEDSA-N 1 0 291.435 3.948 20 10 CHCDRO CCc1ccccc1C[NH2+][C@@H](C)c1cc(OC)ccc1O ZINC000084200325 521841686 /nfs/dbraw/zinc/84/16/86/521841686.db2.gz CTZZIGWIJUKESY-ZDUSSCGKSA-N 1 0 285.387 3.814 20 10 CHCDRO CN(C)c1ccc(C[N@H+](CCC(F)(F)F)C2CC2)cc1 ZINC000265877336 522174011 /nfs/dbraw/zinc/17/40/11/522174011.db2.gz BEPIPBWEGQCPFM-UHFFFAOYSA-N 1 0 286.341 3.669 20 10 CHCDRO CC[C@H]([NH2+]CC1([C@@H](C)CCO)CCC1)c1ccccc1O ZINC000274741697 522574211 /nfs/dbraw/zinc/57/42/11/522574211.db2.gz FKWHEGNLOLHTGY-HOCLYGCPSA-N 1 0 291.435 3.622 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCO[C@H](C)C1)c1ccc(C)cc1O ZINC000280299748 522635190 /nfs/dbraw/zinc/63/51/90/522635190.db2.gz ZUVUGYZEDHBEHZ-YCPHGPKFSA-N 1 0 277.408 3.556 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccc1O ZINC000050015505 522657194 /nfs/dbraw/zinc/65/71/94/522657194.db2.gz WTICTORZJVWJBZ-AWEZNQCLSA-N 1 0 286.331 3.541 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)C1CCOCC1)c1ccc(N(C)C)cc1 ZINC000126181682 522730251 /nfs/dbraw/zinc/73/02/51/522730251.db2.gz IPSCVVZBDWTYPB-KDOFPFPSSA-N 1 0 290.451 3.608 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCO[C@@H](C2CC2)C1)c1ccc(C)cc1O ZINC000280269174 522755377 /nfs/dbraw/zinc/75/53/77/522755377.db2.gz XTSJOZODXFZHLC-QILLFSRXSA-N 1 0 289.419 3.699 20 10 CHCDRO CC[C@@H]([NH2+]C1CCSCC1)c1ccc(C)cc1O ZINC000280229200 522811069 /nfs/dbraw/zinc/81/10/69/522811069.db2.gz VFTOFKKOZINJHT-CQSZACIVSA-N 1 0 265.422 3.637 20 10 CHCDRO CC[C@@H]([NH2+]C[C@](C)(OC)C1CC1)c1ccc(C)cc1O ZINC000291301168 522869276 /nfs/dbraw/zinc/86/92/76/522869276.db2.gz SKVIQRLRVNTEOW-WBVHZDCISA-N 1 0 277.408 3.556 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc(C)ccc1O)c1ccc(OC)cc1 ZINC000071407648 522869970 /nfs/dbraw/zinc/86/99/70/522869970.db2.gz PUGVBYTZZLDFPR-QGZVFWFLSA-N 1 0 285.387 3.950 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc(OC)ccc1O)c1ccccc1 ZINC000051626640 522872718 /nfs/dbraw/zinc/87/27/18/522872718.db2.gz CZEFWPDAJMOIJR-MRXNPFEDSA-N 1 0 271.360 3.642 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccccc1O)c1ccc(OC)cc1 ZINC000037062610 522884822 /nfs/dbraw/zinc/88/48/22/522884822.db2.gz PFVBKAFPRKRIRY-MRXNPFEDSA-N 1 0 271.360 3.642 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CCCSC1)c1ccc(C)cc1O ZINC000280009302 522923879 /nfs/dbraw/zinc/92/38/79/522923879.db2.gz GPCHNJCGRROHCP-TZMCWYRMSA-N 1 0 265.422 3.637 20 10 CHCDRO COCCCC[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000118000217 523139521 /nfs/dbraw/zinc/13/95/21/523139521.db2.gz LAWRYRJGVNJMKQ-UHFFFAOYSA-N 1 0 290.451 3.535 20 10 CHCDRO CC[C@@H]1C[N@H+](Cc2c(O)ccc3ccccc32)CCCO1 ZINC000281106057 523449717 /nfs/dbraw/zinc/44/97/17/523449717.db2.gz AVDUXTWIUZEHEU-OAHLLOKOSA-N 1 0 285.387 3.546 20 10 CHCDRO COc1ccc(F)cc1[C@H](C)[NH2+][C@@H](C)c1ccccc1O ZINC000037089973 524332323 /nfs/dbraw/zinc/33/23/23/524332323.db2.gz FGUOKRHABNFKMW-RYUDHWBXSA-N 1 0 289.350 3.952 20 10 CHCDRO COc1ccccc1[C@H](C)[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000094616805 524783030 /nfs/dbraw/zinc/78/30/30/524783030.db2.gz HBECQTMPITVVQH-RYUDHWBXSA-N 1 0 289.350 3.952 20 10 CHCDRO C[C@H]([NH2+]C1CC(F)(F)C1)c1ccc2ccccc2c1O ZINC000277018989 525286995 /nfs/dbraw/zinc/28/69/95/525286995.db2.gz CXWUDLHASLGBOO-JTQLQIEISA-N 1 0 277.314 3.994 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H](c2ccccc2)C2CC2)c1 ZINC000071407673 525355503 /nfs/dbraw/zinc/35/55/03/525355503.db2.gz HMHIGFIZFAUOPZ-GOSISDBHSA-N 1 0 267.372 3.942 20 10 CHCDRO C[C@@H]([NH2+]Cc1cccs1)c1ccc(N(C)C)cc1 ZINC000037231950 525543046 /nfs/dbraw/zinc/54/30/46/525543046.db2.gz ZGIMTIKLMLXULO-GFCCVEGCSA-N 1 0 260.406 3.665 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCc2cccc(O)c21)c1ccc([N+](=O)[O-])cc1 ZINC000297448954 525634389 /nfs/dbraw/zinc/63/43/89/525634389.db2.gz WUVCWJBSGVNPHO-NHYWBVRUSA-N 1 0 298.342 3.639 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(F)c(F)c2)c(O)c1 ZINC000049577365 525733368 /nfs/dbraw/zinc/73/33/68/525733368.db2.gz SXWHPEUAXXTUQG-LLVKDONJSA-N 1 0 277.314 3.830 20 10 CHCDRO COc1cccc(C[N@H+](C)[C@H](C)c2ccccc2F)c1O ZINC000129727302 525918236 /nfs/dbraw/zinc/91/82/36/525918236.db2.gz UKKXBQMQSSRHHI-GFCCVEGCSA-N 1 0 289.350 3.733 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CSCCS2)c(O)c1C ZINC000273617373 525925054 /nfs/dbraw/zinc/92/50/54/525925054.db2.gz XUFRELHLLGIYSI-STQMWFEESA-N 1 0 297.489 3.508 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2cc(C)ccc2O)cc1 ZINC000071408066 525925224 /nfs/dbraw/zinc/92/52/24/525925224.db2.gz OHDCUWRXUGFTHL-AWEZNQCLSA-N 1 0 255.361 3.860 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccccc2C)c(O)c1 ZINC000037718944 525928681 /nfs/dbraw/zinc/92/86/81/525928681.db2.gz BEIWNBGOGDYSRP-AWEZNQCLSA-N 1 0 255.361 3.860 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCCC23CCOCC3)c(O)c1 ZINC000282855481 525936913 /nfs/dbraw/zinc/93/69/13/525936913.db2.gz UJDROZVKIQLNKS-WMLDXEAASA-N 1 0 289.419 3.701 20 10 CHCDRO COc1cccc(C[NH2+][C@@H]2CCCc3ccc(C)cc32)c1O ZINC000291671763 526033710 /nfs/dbraw/zinc/03/37/10/526033710.db2.gz GQPRYEPMEHQAEL-QGZVFWFLSA-N 1 0 297.398 3.876 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@@H+]1CCC[C@@H]1c1ccncc1 ZINC000367721910 526345960 /nfs/dbraw/zinc/34/59/60/526345960.db2.gz ABODDPZPFPCXEE-OAHLLOKOSA-N 1 0 288.778 3.778 20 10 CHCDRO Cc1n[nH]c(C)c1[C@@H]1CCC[N@@H+]1Cc1cc(C)c(C)cc1O ZINC000290343621 526514362 /nfs/dbraw/zinc/51/43/62/526514362.db2.gz FPEAINRNZQGIHU-INIZCTEOSA-N 1 0 299.418 3.686 20 10 CHCDRO C[C@H](CCc1ccccc1)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000013726365 567942234 /nfs/dbraw/zinc/94/22/34/567942234.db2.gz DLUPTZKMVBIHMP-MRXNPFEDSA-N 1 0 282.431 3.864 20 10 CHCDRO C[C@H](c1cccc(F)c1)[N@H+](C)Cc1ccccc1O ZINC000109772072 1125469222 /nfs/dbraw/zinc/46/92/22/1125469222.db2.gz VOUDGHJIVLBXBC-GFCCVEGCSA-N 1 0 259.324 3.724 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC[C@H](c3ccccc3)C2)c1 ZINC000133692080 1125484843 /nfs/dbraw/zinc/48/48/43/1125484843.db2.gz VDACMDCKHBIRGO-INIZCTEOSA-N 1 0 267.372 3.690 20 10 CHCDRO CC[C@@H](CSC)[N@H+](C)Cc1cc(C)cc(C)c1O ZINC000091024533 1120056247 /nfs/dbraw/zinc/05/62/47/1120056247.db2.gz GTEAFTCTSBRZEN-AWEZNQCLSA-N 1 0 267.438 3.582 20 10 CHCDRO CCC(C)(C)[C@H](C)[NH2+][C@@H](C)c1cc(OC)ccc1O ZINC000695107868 1120108009 /nfs/dbraw/zinc/10/80/09/1120108009.db2.gz PHWCAKPHOSFEJM-RYUDHWBXSA-N 1 0 265.397 3.876 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]CC2CCCC2)cc1 ZINC001177240784 1121718911 /nfs/dbraw/zinc/71/89/11/1121718911.db2.gz VJUXBWCDIGFKRZ-YVMONPNESA-N 1 0 258.409 3.546 20 10 CHCDRO CC(C)C[N@H+](Cc1c(O)cccc1Br)C1CC1 ZINC001179985120 1121934947 /nfs/dbraw/zinc/93/49/47/1121934947.db2.gz XNVLDXOKBNUFEN-UHFFFAOYSA-N 1 0 298.224 3.775 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccoc1)c1cc(Cl)ccc1O ZINC000775490235 1122619502 /nfs/dbraw/zinc/61/95/02/1122619502.db2.gz ALVNLJYJRUGJQF-ZDUSSCGKSA-N 1 0 265.740 3.880 20 10 CHCDRO CC[C@H](C)[C@](C)(O)C[NH2+][C@@H](CC)c1cc(Cl)ccc1O ZINC000775503607 1122631524 /nfs/dbraw/zinc/63/15/24/1122631524.db2.gz KSEDVZKPZXCNHT-HZUKXOBISA-N 1 0 299.842 3.883 20 10 CHCDRO CC[C@@H]([NH2+]CC(C)(C)CCCO)c1cc(Cl)ccc1O ZINC000775518680 1122637270 /nfs/dbraw/zinc/63/72/70/1122637270.db2.gz FYBPXSLTEVHDDL-CQSZACIVSA-N 1 0 299.842 3.885 20 10 CHCDRO CSCC1(CC[NH2+][C@H](C)c2ccc(N(C)C)cc2)CC1 ZINC000850506304 1123276056 /nfs/dbraw/zinc/27/60/56/1123276056.db2.gz IIXHTHHEWUNKID-CQSZACIVSA-N 1 0 292.492 3.937 20 10 CHCDRO Cc1ccc(C[NH2+]CC[C@@H]2CCCC2(F)F)c(O)c1 ZINC000895546062 1123491192 /nfs/dbraw/zinc/49/11/92/1123491192.db2.gz YHHPTDHTADMFKF-ZDUSSCGKSA-N 1 0 269.335 3.616 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](OC)C(C)(C)C)c1ccc(C)cc1O ZINC000794802985 1123952930 /nfs/dbraw/zinc/95/29/30/1123952930.db2.gz PBFLCJPGONMPAG-HOCLYGCPSA-N 1 0 279.424 3.802 20 10 CHCDRO Cc1cccc(C[NH2+]CCC[C@H]2CC2(Cl)Cl)c1O ZINC000846111115 1131687241 /nfs/dbraw/zinc/68/72/41/1131687241.db2.gz QOYXATPQTNYKIP-LBPRGKRZSA-N 1 0 288.218 3.764 20 10 CHCDRO CC[C@H]([NH2+]CCOC(C)(C)CC)c1ccc(C)cc1O ZINC000834916394 1131733713 /nfs/dbraw/zinc/73/37/13/1131733713.db2.gz XHWNKRBYUHNRDZ-HNNXBMFYSA-N 1 0 279.424 3.947 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CS[C@H](C)C1)c1ccc(C)cc1O ZINC000840858962 1132296641 /nfs/dbraw/zinc/29/66/41/1132296641.db2.gz FGEKWZMMQRBCCZ-BZPMIXESSA-N 1 0 265.422 3.635 20 10 CHCDRO COC1([C@@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2O)CCC1 ZINC000841755858 1132391939 /nfs/dbraw/zinc/39/19/39/1132391939.db2.gz MXMJHJIXPOTCIG-GHMZBOCLSA-N 1 0 283.799 3.654 20 10 CHCDRO Oc1ccccc1C[NH2+]Cc1nc(-c2ccccc2)cs1 ZINC000134226992 1125543698 /nfs/dbraw/zinc/54/36/98/1125543698.db2.gz CNGBXRINQNYJOU-UHFFFAOYSA-N 1 0 296.395 3.806 20 10 CHCDRO c1cc(N2CCCCC2)ccc1C[NH2+]CCCC1CC1 ZINC000134868234 1125568689 /nfs/dbraw/zinc/56/86/89/1125568689.db2.gz RFSQUEQDSOGEFN-UHFFFAOYSA-N 1 0 272.436 3.957 20 10 CHCDRO CC[C@H](C)[NH2+][C@@H](C)c1cc(Br)ccc1O ZINC000134906457 1125569135 /nfs/dbraw/zinc/56/91/35/1125569135.db2.gz FWDCCVOSVGASAR-IUCAKERBSA-N 1 0 272.186 3.604 20 10 CHCDRO CN(C)c1ccc(C[NH2+]Cc2cccc(Cl)c2F)cc1 ZINC000135236693 1125581455 /nfs/dbraw/zinc/58/14/55/1125581455.db2.gz JISCOXUMNOBMKD-UHFFFAOYSA-N 1 0 292.785 3.835 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)Cc2ccc(F)c(F)c2)cc1 ZINC000215913293 1125581857 /nfs/dbraw/zinc/58/18/57/1125581857.db2.gz VTGYBUOEEOUSJB-UHFFFAOYSA-N 1 0 290.357 3.663 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]C1(c2ccc(F)cc2)CC1 ZINC000729685670 1125588268 /nfs/dbraw/zinc/58/82/68/1125588268.db2.gz JBOMJFQSHLNLIX-UHFFFAOYSA-N 1 0 291.753 3.964 20 10 CHCDRO C[C@H]([NH2+]CCCC[N@H+](C)C1CC1)c1ccc(Cl)cc1[O-] ZINC000841757994 1125597766 /nfs/dbraw/zinc/59/77/66/1125597766.db2.gz QXFGYOUZLWNKKE-LBPRGKRZSA-N 1 0 296.842 3.571 20 10 CHCDRO COc1cccc(C[N@@H+]2CCC[C@H]3CCCC[C@H]32)c1O ZINC000093480704 1125611652 /nfs/dbraw/zinc/61/16/52/1125611652.db2.gz SZMRSYPRGFZBKG-UKRRQHHQSA-N 1 0 275.392 3.555 20 10 CHCDRO C1=CCC(C[NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000717379621 1125654380 /nfs/dbraw/zinc/65/43/80/1125654380.db2.gz YZOHHVAHGLXWHY-UHFFFAOYSA-N 1 0 270.420 3.733 20 10 CHCDRO C[C@@H]([NH2+]C[C@@]1(C)CCOC2(CCC2)C1)c1ccccc1O ZINC000886774537 1125716326 /nfs/dbraw/zinc/71/63/26/1125716326.db2.gz PNYQOIYHCMFKNK-PBHICJAKSA-N 1 0 289.419 3.782 20 10 CHCDRO COC[C@@H]([NH2+][C@H](C)c1ccc(N(C)C)cc1)c1ccccc1 ZINC000089668355 1125737330 /nfs/dbraw/zinc/73/73/30/1125737330.db2.gz WOCXOGIPIUHUPO-DNVCBOLYSA-N 1 0 298.430 3.791 20 10 CHCDRO COc1cccc(C[N@H+]([C@@H](C)c2ccco2)C2CC2)c1O ZINC000092483925 1125758667 /nfs/dbraw/zinc/75/86/67/1125758667.db2.gz PAHAUMCHAQDNEF-LBPRGKRZSA-N 1 0 287.359 3.719 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+](C)[C@@H](C)c2cccc(O)c2)c1 ZINC000093316058 1125766682 /nfs/dbraw/zinc/76/66/82/1125766682.db2.gz PSZHVAVHPPMUKA-ZDUSSCGKSA-N 1 0 271.360 3.599 20 10 CHCDRO CCCO[C@H]1CCC[N@H+](Cc2ccc(N(C)C)cc2)CC1 ZINC000093316595 1125766956 /nfs/dbraw/zinc/76/69/56/1125766956.db2.gz BJUZTCZJXAPXSP-SFHVURJKSA-N 1 0 290.451 3.534 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+](C)[C@H](C)c2cccc(O)c2)c1 ZINC000093316060 1125767343 /nfs/dbraw/zinc/76/73/43/1125767343.db2.gz PSZHVAVHPPMUKA-CYBMUJFWSA-N 1 0 271.360 3.599 20 10 CHCDRO COC(C)(C)C[C@@H](C)[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000121952018 1125781104 /nfs/dbraw/zinc/78/11/04/1125781104.db2.gz XWIXPBJHLMGHSE-ZIAGYGMSSA-N 1 0 278.440 3.607 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+][C@H]2CC[C@H](C)CC2)c1O ZINC000252841654 1129598619 /nfs/dbraw/zinc/59/86/19/1129598619.db2.gz DJQFSZUYDHCEKA-MJHDQNEOSA-N 1 0 283.799 3.723 20 10 CHCDRO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)C[C@@H]1C[C@H]1C ZINC000769487682 1129909632 /nfs/dbraw/zinc/90/96/32/1129909632.db2.gz KVBPPNUHAISCFE-ZBFHGGJFSA-N 1 0 260.425 3.619 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](C)c1nccs1)c1ccccc1O ZINC000158098741 1126745999 /nfs/dbraw/zinc/74/59/99/1126745999.db2.gz XRCIKVZWVASLAY-DGCLKSJQSA-N 1 0 276.405 3.693 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]Cc2cnccc2C)cc1 ZINC000162632561 1126784423 /nfs/dbraw/zinc/78/44/23/1126784423.db2.gz AJRLVQNJAUOXTK-UHFFFAOYSA-N 1 0 283.419 3.526 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCCOC1)c1ccc(N2CCCCC2)cc1 ZINC000177926700 1126807480 /nfs/dbraw/zinc/80/74/80/1126807480.db2.gz VYOJKPXJZGDUNN-NVXWUHKLSA-N 1 0 288.435 3.507 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(Cl)nc1 ZINC000179097072 1126823407 /nfs/dbraw/zinc/82/34/07/1126823407.db2.gz HYFSYWBMTTUKNR-LBPRGKRZSA-N 1 0 289.810 3.652 20 10 CHCDRO Oc1ccccc1C[NH+]1CCC(OCc2ccccc2)CC1 ZINC000179560168 1126829738 /nfs/dbraw/zinc/82/97/38/1126829738.db2.gz SMBRIOVVGQIDNN-UHFFFAOYSA-N 1 0 297.398 3.573 20 10 CHCDRO COc1ccc(O)c(C[N@H+]([C@@H](C)c2ccco2)C2CC2)c1 ZINC000179850012 1126835394 /nfs/dbraw/zinc/83/53/94/1126835394.db2.gz UNKJANJHRRVGHY-LBPRGKRZSA-N 1 0 287.359 3.719 20 10 CHCDRO Cc1cnc([C@@H](C)C[NH2+][C@H](C)c2cc(F)ccc2O)s1 ZINC000183198768 1126883192 /nfs/dbraw/zinc/88/31/92/1126883192.db2.gz TUTJPWQMBPHLHA-GXSJLCMTSA-N 1 0 294.395 3.751 20 10 CHCDRO COc1ccc(CCC[NH2+][C@H](C)c2ccccc2O)cc1 ZINC000183435786 1126886860 /nfs/dbraw/zinc/88/68/60/1126886860.db2.gz LJKLBUAEJIOATI-CQSZACIVSA-N 1 0 285.387 3.684 20 10 CHCDRO CC(C)[C@H](C[NH2+][C@@H](C)c1ccccc1O)c1cccnc1 ZINC000183546851 1126888847 /nfs/dbraw/zinc/88/88/47/1126888847.db2.gz ZUTBNDCSOPEEOV-YOEHRIQHSA-N 1 0 284.403 3.878 20 10 CHCDRO CC(C)[C@@H](C[NH2+][C@H](C)c1ccccc1O)c1cccnc1 ZINC000183546866 1126888851 /nfs/dbraw/zinc/88/88/51/1126888851.db2.gz ZUTBNDCSOPEEOV-RHSMWYFYSA-N 1 0 284.403 3.878 20 10 CHCDRO Cc1ccc(C[NH+](C)C)cc1N[C@@H](C)c1ccccc1O ZINC000183702671 1126890447 /nfs/dbraw/zinc/89/04/47/1126890447.db2.gz MKLYCYGBCXPMLF-AWEZNQCLSA-N 1 0 284.403 3.935 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+](C)[C@@H](C)c2cccnc2)c1O ZINC000183729017 1126891506 /nfs/dbraw/zinc/89/15/06/1126891506.db2.gz PVZPJAIABSPAEI-LBPRGKRZSA-N 1 0 290.794 3.942 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2ccc(C(F)F)cc2)c1 ZINC000185172858 1126899086 /nfs/dbraw/zinc/89/90/86/1126899086.db2.gz ILUJAOWVSLCBFK-UHFFFAOYSA-N 1 0 277.314 3.928 20 10 CHCDRO COCCC1(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)CCC1 ZINC000185752532 1126902317 /nfs/dbraw/zinc/90/23/17/1126902317.db2.gz KNVFKTINORDPBV-LBPRGKRZSA-N 1 0 297.826 3.903 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)C[C@H](O)c2ccccc2)c(O)c1 ZINC000185834314 1126903936 /nfs/dbraw/zinc/90/39/36/1126903936.db2.gz LPTKGYVGNBFFBR-RKVPGOIHSA-N 1 0 299.414 3.863 20 10 CHCDRO COc1ccc(F)cc1C[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000187590584 1126911627 /nfs/dbraw/zinc/91/16/27/1126911627.db2.gz YQHKSUYEDFCSPH-JTQLQIEISA-N 1 0 293.313 3.530 20 10 CHCDRO CSCc1cccc(C[NH2+]Cc2cccc(C)c2O)c1 ZINC000188974973 1126927438 /nfs/dbraw/zinc/92/74/38/1126927438.db2.gz DQZBOZLTRYDNBO-UHFFFAOYSA-N 1 0 287.428 3.853 20 10 CHCDRO CCOC1CC(CC[NH2+][C@H](C)c2ccc(C)cc2O)C1 ZINC000189249564 1126929758 /nfs/dbraw/zinc/92/97/58/1126929758.db2.gz DQSKPQBKULOMFL-WLYUNCDWSA-N 1 0 277.408 3.556 20 10 CHCDRO Cc1cc(C[N@H+](C)Cc2ccsc2)ccc1N(C)C ZINC000815011637 1130949354 /nfs/dbraw/zinc/94/93/54/1130949354.db2.gz UZGQUGZABAULIU-UHFFFAOYSA-N 1 0 274.433 3.755 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(Cl)o2)c(O)c1 ZINC000698074714 1127037829 /nfs/dbraw/zinc/03/78/29/1127037829.db2.gz MMMNAROIGKLFMW-SNVBAGLBSA-N 1 0 265.740 3.798 20 10 CHCDRO Fc1ccc(C[NH2+]Cc2ccc3c(c2)CCO3)c(Cl)c1 ZINC001649009568 1127076537 /nfs/dbraw/zinc/07/65/37/1127076537.db2.gz DLAMESDEUDDUDL-UHFFFAOYSA-N 1 0 291.753 3.704 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@@H+]2CCO[C@@H](c3ccccc3)C2)c1 ZINC000163894918 1127146847 /nfs/dbraw/zinc/14/68/47/1127146847.db2.gz MLXGEWUSNZQLDH-GOSISDBHSA-N 1 0 297.398 3.583 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@@H+]2CCO[C@H](c3ccccc3)C2)c1 ZINC000163894806 1127147481 /nfs/dbraw/zinc/14/74/81/1127147481.db2.gz MLXGEWUSNZQLDH-SFHVURJKSA-N 1 0 297.398 3.583 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+][C@@H](CC)CC(F)(F)F)c1 ZINC000760658501 1127153915 /nfs/dbraw/zinc/15/39/15/1127153915.db2.gz LZTVIMRMLTYYTP-NSHDSACASA-N 1 0 291.313 3.612 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](C)Oc1ccccc1)c1ccccc1O ZINC000156588426 1127160071 /nfs/dbraw/zinc/16/00/71/1127160071.db2.gz RSSOXHWJIAWPHC-RHSMWYFYSA-N 1 0 285.387 3.900 20 10 CHCDRO Cc1sccc1C[N@@H+](C)Cc1ccc(N(C)C)cc1 ZINC000816477593 1131096854 /nfs/dbraw/zinc/09/68/54/1131096854.db2.gz CWRFZDUVATWNJE-UHFFFAOYSA-N 1 0 274.433 3.755 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CCOC2(CCCC2)C1 ZINC000164482455 1127168140 /nfs/dbraw/zinc/16/81/40/1127168140.db2.gz OCJSFJURUCWGJB-UHFFFAOYSA-N 1 0 297.398 3.690 20 10 CHCDRO Cc1cccc(O)c1C[N@H+]1CC[C@@H](C)C(F)(F)CC1 ZINC001237484662 1131104921 /nfs/dbraw/zinc/10/49/21/1131104921.db2.gz GQKDVJUPCOOGHF-GFCCVEGCSA-N 1 0 269.335 3.568 20 10 CHCDRO Oc1ccccc1C[NH2+]C1(Cc2ccccc2)CCC1 ZINC000760719492 1127208446 /nfs/dbraw/zinc/20/84/46/1127208446.db2.gz ZOIPMDDAHIHBJH-UHFFFAOYSA-N 1 0 267.372 3.647 20 10 CHCDRO CC(C)CSCCC[N@H+](C)Cc1ccccc1O ZINC000157252646 1127293498 /nfs/dbraw/zinc/29/34/98/1127293498.db2.gz CSTILPJRASSNRC-UHFFFAOYSA-N 1 0 267.438 3.603 20 10 CHCDRO Cc1cccc([C@H](C)[NH2+]Cc2ccc3c(c2)CCO3)c1 ZINC000157244547 1127293561 /nfs/dbraw/zinc/29/35/61/1127293561.db2.gz ANMKSXMQBVODLX-AWEZNQCLSA-N 1 0 267.372 3.781 20 10 CHCDRO CC[C@@H](CC(F)(F)F)[NH2+][C@H](C)c1cc(F)ccc1O ZINC000760902646 1127324222 /nfs/dbraw/zinc/32/42/22/1127324222.db2.gz HHFAZAHARVFUJG-SCZZXKLOSA-N 1 0 279.277 3.913 20 10 CHCDRO CC[C@H](CC(F)(F)F)[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000760902648 1127324492 /nfs/dbraw/zinc/32/44/92/1127324492.db2.gz HHFAZAHARVFUJG-WCBMZHEXSA-N 1 0 279.277 3.913 20 10 CHCDRO COc1cccc(C[NH2+][C@H]2CCCc3ccc(C)cc32)c1O ZINC000288387668 1127335396 /nfs/dbraw/zinc/33/53/96/1127335396.db2.gz GQPRYEPMEHQAEL-KRWDZBQOSA-N 1 0 297.398 3.876 20 10 CHCDRO C[C@H](CF)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000288391752 1127337021 /nfs/dbraw/zinc/33/70/21/1127337021.db2.gz GZQZOHXCSFMTFE-GFCCVEGCSA-N 1 0 259.324 3.507 20 10 CHCDRO CCCOc1ccc(C[NH2+][C@H]2CS[C@@H](C)C2)cc1C ZINC001308437238 1127384083 /nfs/dbraw/zinc/38/40/83/1127384083.db2.gz NFCPPGVSEOHOAF-DZGCQCFKSA-N 1 0 279.449 3.767 20 10 CHCDRO C[C@@H]([NH2+]Cc1cc(F)ccc1O)c1ccc(F)cc1F ZINC000226583543 1127412574 /nfs/dbraw/zinc/41/25/74/1127412574.db2.gz CWDAPIUPYIJLNO-SECBINFHSA-N 1 0 281.277 3.660 20 10 CHCDRO C[C@@H]1CCCC[N@H+](Cc2cc(F)c(N(C)C)cc2F)C1 ZINC001308694597 1127430676 /nfs/dbraw/zinc/43/06/76/1127430676.db2.gz LNARPPULAITYHB-GFCCVEGCSA-N 1 0 282.378 3.653 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCCC[C@@H]1O)c1ccc2ccccc2c1O ZINC000158227560 1127467519 /nfs/dbraw/zinc/46/75/19/1127467519.db2.gz SOOSBFKSEJGCJB-JOQOYGCGSA-N 1 0 299.414 3.747 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCC(C)(C)C2)c1 ZINC000168861125 1127472677 /nfs/dbraw/zinc/47/26/77/1127472677.db2.gz NZVYJAIOFIVFDC-NWDGAFQWSA-N 1 0 263.381 3.630 20 10 CHCDRO CCOc1cccc(C[NH2+]C[C@H]2CCC[C@@H](C)C2)c1O ZINC000227439782 1127478063 /nfs/dbraw/zinc/47/80/63/1127478063.db2.gz LAXUEEANEQXDLN-KGLIPLIRSA-N 1 0 277.408 3.707 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+][C@@H]2CCC(C)(C)C2)c1O ZINC000169092746 1127481963 /nfs/dbraw/zinc/48/19/63/1127481963.db2.gz HMSNBASJPLRKQW-GFCCVEGCSA-N 1 0 283.799 3.723 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2ccc(C)nc2)c(O)c1 ZINC000293804425 1127522569 /nfs/dbraw/zinc/52/25/69/1127522569.db2.gz RGPZJVBPAWYNGR-AWEZNQCLSA-N 1 0 270.376 3.563 20 10 CHCDRO CC[C@@H]([NH2+]Cc1occc1C)c1ccc(C)cc1O ZINC000293856982 1127526036 /nfs/dbraw/zinc/52/60/36/1127526036.db2.gz XOJKOHLUXDLHMT-CQSZACIVSA-N 1 0 259.349 3.843 20 10 CHCDRO CC[C@H]1CCCC[N@@H+]1Cc1cc(Cl)cc(OC)c1O ZINC000228561083 1127567488 /nfs/dbraw/zinc/56/74/88/1127567488.db2.gz NXINYKQWLNIJMG-ZDUSSCGKSA-N 1 0 283.799 3.819 20 10 CHCDRO COc1cc(Cl)cc(C[N@H+](C)C2CCCCC2)c1O ZINC000228561100 1127567784 /nfs/dbraw/zinc/56/77/84/1127567784.db2.gz RPHXDSSDIQDBED-UHFFFAOYSA-N 1 0 283.799 3.819 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CC[C@H](C(C)C)C2)c1O ZINC000228667814 1127583102 /nfs/dbraw/zinc/58/31/02/1127583102.db2.gz NEYVAVZXSUWMFS-NSHDSACASA-N 1 0 283.799 3.532 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+][C@H]2CCCC[C@H]2C)c1O ZINC000228669756 1127583342 /nfs/dbraw/zinc/58/33/42/1127583342.db2.gz GCLKTHRNRQOHNM-MFKMUULPSA-N 1 0 283.799 3.723 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+][C@@H]2CCOC(C)(C)C2)c(O)c1 ZINC000294856459 1127604455 /nfs/dbraw/zinc/60/44/55/1127604455.db2.gz SSWYYKSCSQFKSJ-ZIAGYGMSSA-N 1 0 277.408 3.617 20 10 CHCDRO Cc1cccc(C[NH2+][C@H](c2ccccc2)[C@@H]2CCOC2)c1O ZINC000362043344 1127607666 /nfs/dbraw/zinc/60/76/66/1127607666.db2.gz WVFCTHQQUHUESH-QZTJIDSGSA-N 1 0 297.398 3.568 20 10 CHCDRO C[C@H]1C[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ccccc1O ZINC000295094369 1127619502 /nfs/dbraw/zinc/61/95/02/1127619502.db2.gz UFQDSKBQSVPTJX-JQWIXIFHSA-N 1 0 273.298 3.555 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]C[C@@H]2CCCCC2(F)F)c1 ZINC000295134115 1127622969 /nfs/dbraw/zinc/62/29/69/1127622969.db2.gz OZGLQWMWJSKRLH-ZDUSSCGKSA-N 1 0 299.361 3.706 20 10 CHCDRO CC(C)(C)[C@@H]1C[C@H]([NH2+][C@@H]2CCc3cccc(O)c32)CCO1 ZINC000296890501 1127684885 /nfs/dbraw/zinc/68/48/85/1127684885.db2.gz ONXJFQXHHGPLMG-FMKPAKJESA-N 1 0 289.419 3.563 20 10 CHCDRO CC(C)(C)[C@@H]1C[C@H]([NH2+][C@H]2CCc3cccc(O)c32)CCO1 ZINC000296890510 1127685281 /nfs/dbraw/zinc/68/52/81/1127685281.db2.gz ONXJFQXHHGPLMG-YCPHGPKFSA-N 1 0 289.419 3.563 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]C[C@@H]1CCOc3ccccc31)CC2 ZINC000297551415 1127699362 /nfs/dbraw/zinc/69/93/62/1127699362.db2.gz FRGQRECSVJITRT-GOEBONIOSA-N 1 0 295.382 3.535 20 10 CHCDRO CC(C)Oc1ccc(C[N@H+](C)Cc2ccccc2O)cc1 ZINC000171937084 1127736198 /nfs/dbraw/zinc/73/61/98/1127736198.db2.gz NDYYNSTUINGIOP-UHFFFAOYSA-N 1 0 285.387 3.811 20 10 CHCDRO C[C@@H]1CCC[C@@H]1C[NH2+]Cc1c(O)cccc1Cl ZINC000230667123 1127771135 /nfs/dbraw/zinc/77/11/35/1127771135.db2.gz NSKAFBHDCSXJPW-GHMZBOCLSA-N 1 0 253.773 3.571 20 10 CHCDRO CC(C)C[C@@H](O)C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000230660052 1127771592 /nfs/dbraw/zinc/77/15/92/1127771592.db2.gz SYCVKNABKBPLRG-UKRRQHHQSA-N 1 0 287.403 3.603 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2OCCc3ccccc32)c(O)c1 ZINC000371869990 1127782776 /nfs/dbraw/zinc/78/27/76/1127782776.db2.gz MCBKKAJLNJRQMK-KUHUBIRLSA-N 1 0 297.398 3.665 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc2c(cc1O)OCO2)c1ccc(C)cc1 ZINC000063255968 1127806314 /nfs/dbraw/zinc/80/63/14/1127806314.db2.gz OXZQWWCKWOAORC-HNNXBMFYSA-N 1 0 299.370 3.670 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCCCC1(F)F)c1ccccc1O ZINC000296443379 1129222960 /nfs/dbraw/zinc/22/29/60/1129222960.db2.gz ZQTLIROAQIFPBA-RYUDHWBXSA-N 1 0 269.335 3.868 20 10 CHCDRO CC[C@@H]([NH2+]CCCC(=O)OC(C)(C)C)c1ccccc1O ZINC000784266113 1127925864 /nfs/dbraw/zinc/92/58/64/1127925864.db2.gz PYECVWYKLVQRRE-CQSZACIVSA-N 1 0 293.407 3.555 20 10 CHCDRO C[C@@H]1CCCCC[C@H]1[NH2+]Cc1ccc(N(C)C)cc1 ZINC000088507844 1127953284 /nfs/dbraw/zinc/95/32/84/1127953284.db2.gz UUNSVBQXCUHFSS-RHSMWYFYSA-N 1 0 260.425 3.811 20 10 CHCDRO CC[N@H+](Cc1cc(Cl)cc(OC)c1O)CC(C)(C)C ZINC000312088198 1127979875 /nfs/dbraw/zinc/97/98/75/1127979875.db2.gz XSYNGXOHNUBYMK-UHFFFAOYSA-N 1 0 285.815 3.922 20 10 CHCDRO CCC[C@H](C)[NH2+][C@@H](C)c1ccc(Br)cc1O ZINC000134898849 1128048987 /nfs/dbraw/zinc/04/89/87/1128048987.db2.gz ZGKCCWIXTGCDAM-UWVGGRQHSA-N 1 0 286.213 3.994 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCO[C@H](c3ccccc3)C2)cc1C ZINC000029891478 1128068494 /nfs/dbraw/zinc/06/84/94/1128068494.db2.gz IXLFSJSPFUSKLC-IBGZPJMESA-N 1 0 297.398 3.583 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCSCC(F)(F)F)c(O)c1 ZINC000698951993 1128069205 /nfs/dbraw/zinc/06/92/05/1128069205.db2.gz FQFNPQGVFAGWHA-JTQLQIEISA-N 1 0 293.354 3.647 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2cc(F)ccc2O)cc1 ZINC000226585357 1128196059 /nfs/dbraw/zinc/19/60/59/1128196059.db2.gz OKCGVGPKLBJTQI-LBPRGKRZSA-N 1 0 259.324 3.691 20 10 CHCDRO C[C@H]([NH2+]C[C@@]1(c2ccccc2)CCCO1)c1ccccc1O ZINC000927114177 1128219375 /nfs/dbraw/zinc/21/93/75/1128219375.db2.gz CSSUIOCKCLRWKO-HNAYVOBHSA-N 1 0 297.398 3.749 20 10 CHCDRO CCc1onc(C)c1C[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000927138605 1128221544 /nfs/dbraw/zinc/22/15/44/1128221544.db2.gz GTBJUWSDBCGRJJ-GFCCVEGCSA-N 1 0 288.391 3.719 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C2([C@H]3CCCCO3)CC2)c(O)c1C ZINC000927164524 1128224016 /nfs/dbraw/zinc/22/40/16/1128224016.db2.gz XKARLNYJRNCRMX-GOEBONIOSA-N 1 0 289.419 3.761 20 10 CHCDRO COc1cc(C)cc(C[N@H+](C)[C@@H]2CCC[C@@H](C)C2)c1O ZINC000754726779 1128299319 /nfs/dbraw/zinc/29/93/19/1128299319.db2.gz UBUFENZRIUMOPA-IUODEOHRSA-N 1 0 277.408 3.720 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@@H](C1CC1)C1CCC1)CC2 ZINC000324631659 1128389386 /nfs/dbraw/zinc/38/93/86/1128389386.db2.gz AOCOURXRMKSWAW-WMLDXEAASA-N 1 0 257.377 3.548 20 10 CHCDRO c1ccc2c(c1)CCC[C@H]2C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000917393711 1128497045 /nfs/dbraw/zinc/49/70/45/1128497045.db2.gz JWAXTGSSJMPCFB-SFHVURJKSA-N 1 0 293.410 3.831 20 10 CHCDRO C[C@H]([NH2+]C[C@@]1(N(C)C)CCC[C@@H](C)C1)c1ccccc1O ZINC000040668279 1128526951 /nfs/dbraw/zinc/52/69/51/1128526951.db2.gz ZTCUJHPARCIRBN-RVKKMQEKSA-N 1 0 290.451 3.553 20 10 CHCDRO CSCC[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000154806419 1128571043 /nfs/dbraw/zinc/57/10/43/1128571043.db2.gz KVZPUAHJBHEBCO-CQSZACIVSA-N 1 0 278.465 3.691 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CCc2ccco2)cc1 ZINC000155943567 1128620173 /nfs/dbraw/zinc/62/01/73/1128620173.db2.gz INMPURBXRXMNNG-AWEZNQCLSA-N 1 0 272.392 3.629 20 10 CHCDRO CC[C@@H]([NH2+][C@H](CCO)C1CCCCC1)c1ccccc1O ZINC000156411162 1128635724 /nfs/dbraw/zinc/63/57/24/1128635724.db2.gz YBIXAVSRZXDXAC-IAGOWNOFSA-N 1 0 291.435 3.764 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)COc2cccc(C)c2)cc1C ZINC000920180105 1128669521 /nfs/dbraw/zinc/66/95/21/1128669521.db2.gz JQDQGSXLZOROND-MRXNPFEDSA-N 1 0 299.414 3.869 20 10 CHCDRO COc1ccc2c(c1)CCC[C@H]2[N@H+](C)Cc1ccccc1O ZINC000778995526 1128674388 /nfs/dbraw/zinc/67/43/88/1128674388.db2.gz BFFAYGZIGUCHMN-GOSISDBHSA-N 1 0 297.398 3.910 20 10 CHCDRO C[C@@H]1[C@H](Cc2ccccc2)CC[N@@H+]1Cc1ccccc1O ZINC000779023639 1128685808 /nfs/dbraw/zinc/68/58/08/1128685808.db2.gz VBNDPCGKZVPGRG-WBVHZDCISA-N 1 0 281.399 3.845 20 10 CHCDRO CC(C)(C)C1=CC[N@H+](Cc2cc(F)ccc2O)CC1 ZINC000779034183 1128696128 /nfs/dbraw/zinc/69/61/28/1128696128.db2.gz PWCHEPOVCMPIHY-UHFFFAOYSA-N 1 0 263.356 3.710 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCCO2)c1ccccc1 ZINC000921477061 1128710085 /nfs/dbraw/zinc/71/00/85/1128710085.db2.gz WNKGWZBFQCWYSD-AWEZNQCLSA-N 1 0 267.372 3.862 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCC(C)(C)O2)c(O)c1C ZINC000779079008 1128720908 /nfs/dbraw/zinc/72/09/08/1128720908.db2.gz JSINORCWXMYQMB-UONOGXRCSA-N 1 0 277.408 3.617 20 10 CHCDRO CSC[C@@H](C)[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000185495048 1117830195 /nfs/dbraw/zinc/83/01/95/1117830195.db2.gz AEYMVKWRHXRZLZ-VXGBXAGGSA-N 1 0 279.449 3.673 20 10 CHCDRO Oc1ccccc1C[NH2+]CC1CCC(C(F)(F)F)CC1 ZINC000072928474 1117846675 /nfs/dbraw/zinc/84/66/75/1117846675.db2.gz RVFCRULYTXWLSD-UHFFFAOYSA-N 1 0 287.325 3.851 20 10 CHCDRO C[N@@H+](Cc1ccccc1O)C[C@H]1CCc2ccccc2C1 ZINC000782047945 1117848275 /nfs/dbraw/zinc/84/82/75/1117848275.db2.gz JOBXQEWDFLMWGI-HNNXBMFYSA-N 1 0 281.399 3.629 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](C)Oc2ccccc2)c(O)c1 ZINC000186041072 1117974793 /nfs/dbraw/zinc/97/47/93/1117974793.db2.gz JJJJHWJPLZTNNC-LSDHHAIUSA-N 1 0 285.387 3.819 20 10 CHCDRO Oc1ccccc1C[N@H+](Cc1ccccc1F)C1CC1 ZINC000179554012 1128748011 /nfs/dbraw/zinc/74/80/11/1128748011.db2.gz YDZWWCLWAUAWGP-UHFFFAOYSA-N 1 0 271.335 3.696 20 10 CHCDRO Cc1nc(C)c([C@@H](C)[N@H+](C)Cc2ccccc2O)s1 ZINC000179572835 1128748373 /nfs/dbraw/zinc/74/83/73/1128748373.db2.gz QMRXSHSSPQDORT-LLVKDONJSA-N 1 0 276.405 3.659 20 10 CHCDRO COc1ccc(O)c(C[N@H+](C)[C@@H](C)c2ccc(F)cc2)c1 ZINC000179630835 1128750628 /nfs/dbraw/zinc/75/06/28/1128750628.db2.gz XPJOLFOGAWLFEE-LBPRGKRZSA-N 1 0 289.350 3.733 20 10 CHCDRO COc1ccc(O)c(C[NH+]2CCC(c3ccccc3)CC2)c1 ZINC000179662911 1128753300 /nfs/dbraw/zinc/75/33/00/1128753300.db2.gz UKXQRMNIPWNION-UHFFFAOYSA-N 1 0 297.398 3.780 20 10 CHCDRO CC(C)C[NH2+][C@H](C)c1ccc(N2CCCCC2)cc1 ZINC000764473661 1118094546 /nfs/dbraw/zinc/09/45/46/1118094546.db2.gz DSQXFIVYVHXUGA-OAHLLOKOSA-N 1 0 260.425 3.984 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCOc2ccccc2)cc1 ZINC000764583229 1118100556 /nfs/dbraw/zinc/10/05/56/1118100556.db2.gz JNQVXXIWOGZDPB-MRXNPFEDSA-N 1 0 298.430 3.872 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)CC=C(C)C)cc1 ZINC000764817076 1118118364 /nfs/dbraw/zinc/11/83/64/1118118364.db2.gz OVHQSCSXFHNBIB-UHFFFAOYSA-N 1 0 260.425 3.931 20 10 CHCDRO Cc1nc(C)c([C@H](C)[N@H+](C)Cc2cc(F)ccc2O)s1 ZINC000180126863 1118142637 /nfs/dbraw/zinc/14/26/37/1118142637.db2.gz ATJZRTMMMWINHD-JTQLQIEISA-N 1 0 294.395 3.798 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H]1CCc2c1cccc2O ZINC000765387877 1118148287 /nfs/dbraw/zinc/14/82/87/1118148287.db2.gz FTWFTBRFTUHUGE-SFHVURJKSA-N 1 0 296.414 3.544 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCOC2CCCC2)cc1 ZINC000765417326 1118149909 /nfs/dbraw/zinc/14/99/09/1118149909.db2.gz QDGGAUCVOFLHAL-OAHLLOKOSA-N 1 0 290.451 3.753 20 10 CHCDRO C[C@H]1CCCC[C@@H]1C[NH2+]Cc1c(O)cccc1Cl ZINC000083552196 1118168236 /nfs/dbraw/zinc/16/82/36/1118168236.db2.gz XDXZQYVVDZSAKX-NWDGAFQWSA-N 1 0 267.800 3.962 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccc2c(c1)COC2 ZINC000765607979 1118182288 /nfs/dbraw/zinc/18/22/88/1118182288.db2.gz GCUHAFMTKLMDKN-ZDUSSCGKSA-N 1 0 295.382 3.503 20 10 CHCDRO CS[C@H](C)C[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000186156955 1118199296 /nfs/dbraw/zinc/19/92/96/1118199296.db2.gz IUHJRRNQKVEAJK-VXGBXAGGSA-N 1 0 279.449 3.673 20 10 CHCDRO COc1ccc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCCO3)cc1 ZINC000921621185 1118226580 /nfs/dbraw/zinc/22/65/80/1118226580.db2.gz LQPJTDLTMJZUBA-CQSZACIVSA-N 1 0 297.398 3.871 20 10 CHCDRO C[C@@H]([NH2+]CCCOCCc1ccccc1)c1ccccc1O ZINC000179878938 1128765090 /nfs/dbraw/zinc/76/50/90/1128765090.db2.gz BTSGJSRAUIEXND-MRXNPFEDSA-N 1 0 299.414 3.692 20 10 CHCDRO COc1cnccc1[C@@H](C)[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000188797757 1128765249 /nfs/dbraw/zinc/76/52/49/1128765249.db2.gz DWIITAXKAZDMQU-QWHCGFSZSA-N 1 0 286.375 3.516 20 10 CHCDRO COc1cnccc1[C@@H](C)[NH2+][C@H](C)c1cc(C)ccc1O ZINC000188782271 1128765542 /nfs/dbraw/zinc/76/55/42/1128765542.db2.gz XYULIXUVXMSLIV-CHWSQXEVSA-N 1 0 286.375 3.516 20 10 CHCDRO c1csc(SCCC[NH2+][C@H]2CCC23CCCC3)n1 ZINC000189128643 1128767786 /nfs/dbraw/zinc/76/77/86/1128767786.db2.gz DTTGXPMMPUWHMO-LBPRGKRZSA-N 1 0 282.478 3.938 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccccc1 ZINC000050285769 1118475153 /nfs/dbraw/zinc/47/51/53/1118475153.db2.gz FYNYRDXQHCGSNZ-OAHLLOKOSA-N 1 0 280.415 3.920 20 10 CHCDRO C[N@H+](Cc1cc(Cl)ccc1O)CC1(O)CCCCCC1 ZINC000779203938 1128786813 /nfs/dbraw/zinc/78/68/13/1128786813.db2.gz LZTYSJVEXHUDMU-UHFFFAOYSA-N 1 0 297.826 3.563 20 10 CHCDRO Cc1noc(C)c1[C@@H](C)[NH2+][C@H](C)c1cc(C)ccc1O ZINC000092326651 1118582983 /nfs/dbraw/zinc/58/29/83/1118582983.db2.gz CRDKNGBUGSOJKP-GHMZBOCLSA-N 1 0 274.364 3.717 20 10 CHCDRO C[C@H]1CCCC[C@@H]1C[NH2+]Cc1ccc2c(c1)CCCN2C ZINC000109935210 1118591014 /nfs/dbraw/zinc/59/10/14/1118591014.db2.gz NTBABMMAXOTFEX-MAUKXSAKSA-N 1 0 286.463 3.985 20 10 CHCDRO CCO[C@@H]1CCC[C@H]1[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000834911266 1118629320 /nfs/dbraw/zinc/62/93/20/1118629320.db2.gz ISRZTMHTHFPHMZ-FVQBIDKESA-N 1 0 277.408 3.617 20 10 CHCDRO COc1cc(C)cc(C[N@@H+]2C[C@H](C)[C@H]3CCCC[C@H]32)c1O ZINC000782275830 1118735709 /nfs/dbraw/zinc/73/57/09/1118735709.db2.gz IUEHUMKOSNNATG-NUEKZKHPSA-N 1 0 289.419 3.720 20 10 CHCDRO COc1cc(C)cc(C[N@@H+]2CCC[C@@H](C(C)C)C2)c1O ZINC000780496920 1118757387 /nfs/dbraw/zinc/75/73/87/1118757387.db2.gz KZSVSJBNMRWKMZ-CQSZACIVSA-N 1 0 277.408 3.577 20 10 CHCDRO COc1cccc(C[N@@H+]2CCC[C@H]2c2ccccc2)c1O ZINC000131587662 1118761230 /nfs/dbraw/zinc/76/12/30/1118761230.db2.gz GRJWIQORBRGMBR-INIZCTEOSA-N 1 0 283.371 3.738 20 10 CHCDRO Cc1cccc(C[NH2+]C2CC(c3ccccc3)C2)c1O ZINC000690726084 1118870837 /nfs/dbraw/zinc/87/08/37/1118870837.db2.gz IKDJOOVBXXOPRE-UHFFFAOYSA-N 1 0 267.372 3.736 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)[C@H](C)Cc1ccsc1 ZINC000190259229 1128807879 /nfs/dbraw/zinc/80/78/79/1128807879.db2.gz PEDAGZGWMPEMFP-CYBMUJFWSA-N 1 0 275.417 3.907 20 10 CHCDRO CCC[N@@H+](Cc1ccccc1O)C[C@H](COC)C(C)C ZINC001167522279 1118987196 /nfs/dbraw/zinc/98/71/96/1118987196.db2.gz XEZFVJMAGHEJDY-MRXNPFEDSA-N 1 0 279.424 3.523 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCc2ccccc2C1)c1ccccc1O ZINC000051630688 1119059429 /nfs/dbraw/zinc/05/94/29/1119059429.db2.gz WSXKUPGFZAHXLX-XJKSGUPXSA-N 1 0 267.372 3.600 20 10 CHCDRO CC[C@@H]1CCCC[C@@H]1[NH2+]Cc1cc(F)ccc1O ZINC000226584014 1119212174 /nfs/dbraw/zinc/21/21/74/1119212174.db2.gz DIAJHERTUMQGHO-RISCZKNCSA-N 1 0 251.345 3.590 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCc2ccc(C)nc2)cc1 ZINC000161557560 1119301489 /nfs/dbraw/zinc/30/14/89/1119301489.db2.gz ORNXSOPBBOYSCW-MRXNPFEDSA-N 1 0 297.446 3.739 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCC2SCCS2)c1 ZINC000693774652 1119332326 /nfs/dbraw/zinc/33/23/26/1119332326.db2.gz BQQJTJYDTISEGP-LLVKDONJSA-N 1 0 283.462 3.547 20 10 CHCDRO CSC1(C[NH2+]Cc2ccc(N3CCCC3)cc2)CCC1 ZINC000227947791 1119368558 /nfs/dbraw/zinc/36/85/58/1119368558.db2.gz XPCDKTWTWUJRNQ-UHFFFAOYSA-N 1 0 290.476 3.662 20 10 CHCDRO C[C@@H]1CCC[C@@H](C)[NH+]1Cc1cc(Cl)ccc1O ZINC000131833737 1119436546 /nfs/dbraw/zinc/43/65/46/1119436546.db2.gz UTSZLSGJXVBMKI-GHMZBOCLSA-N 1 0 253.773 3.809 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]C[C@H]1CCCS1 ZINC000250981120 1119596593 /nfs/dbraw/zinc/59/65/93/1119596593.db2.gz NAJOYBWFMFNFMB-JHJVBQTASA-N 1 0 277.433 3.734 20 10 CHCDRO CC[NH+](CC)CCCSc1ncc(Cl)s1 ZINC000850000390 1119601849 /nfs/dbraw/zinc/60/18/49/1119601849.db2.gz SXFQFGRUYZHFMO-UHFFFAOYSA-N 1 0 264.847 3.621 20 10 CHCDRO Cc1cc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2)cs1 ZINC000294304317 1119633170 /nfs/dbraw/zinc/63/31/70/1119633170.db2.gz VJQIMFYFKDYTBG-CYBMUJFWSA-N 1 0 274.433 3.973 20 10 CHCDRO C[C@@H]1[C@@H](c2ccccc2)CC[N@@H+]1Cc1ccccc1O ZINC000179580517 1119751634 /nfs/dbraw/zinc/75/16/34/1119751634.db2.gz XEHIIQGXXJSQSB-PBHICJAKSA-N 1 0 267.372 3.770 20 10 CHCDRO COc1ccccc1C[N@H+](C)Cc1cc(Cl)ccc1O ZINC000179588932 1119751895 /nfs/dbraw/zinc/75/18/95/1119751895.db2.gz KMHQNKGSVKEXDU-UHFFFAOYSA-N 1 0 291.778 3.686 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCCOc2ccccc2)c(O)c1 ZINC000052092020 1119781338 /nfs/dbraw/zinc/78/13/38/1119781338.db2.gz NZQXZDQWIUIIIV-OAHLLOKOSA-N 1 0 285.387 3.820 20 10 CHCDRO C[C@@H]([NH2+]CCOCC1CCC1)c1cc(Cl)ccc1O ZINC000765811664 1120050080 /nfs/dbraw/zinc/05/00/80/1120050080.db2.gz VELMUHBZHXFBDH-LLVKDONJSA-N 1 0 283.799 3.513 20 10 CHCDRO CC(C)n1cc2c(n1)[C@H]([NH2+][C@@H](C)c1ccccc1O)CCC2 ZINC000765817432 1120063346 /nfs/dbraw/zinc/06/33/46/1120063346.db2.gz LIDYMJYNTBQFKJ-XJKSGUPXSA-N 1 0 299.418 3.898 20 10 CHCDRO CCSCC[C@H](C)[NH2+][C@H](C)c1ccccc1O ZINC000167455602 1120080282 /nfs/dbraw/zinc/08/02/82/1120080282.db2.gz BQLBDTATNNGIHP-NWDGAFQWSA-N 1 0 253.411 3.575 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2CCCC(F)(F)C2)c1 ZINC000695081286 1120100561 /nfs/dbraw/zinc/10/05/61/1120100561.db2.gz FHLBXTJLZRRLDM-QWRGUYRKSA-N 1 0 285.334 3.629 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H](C)C(C)(C)CC)c1O ZINC000695107778 1120107427 /nfs/dbraw/zinc/10/74/27/1120107427.db2.gz OWGDXXHGKSDHNW-LBPRGKRZSA-N 1 0 265.397 3.705 20 10 CHCDRO CO[C@@H](C[NH2+][C@H](C)c1ccccc1O)C1CCCCC1 ZINC000695159887 1120126244 /nfs/dbraw/zinc/12/62/44/1120126244.db2.gz HHEXYGLCFPWORI-DYVFJYSZSA-N 1 0 277.408 3.638 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCCN(C)c2ccccc2)c1 ZINC000314318962 1120184747 /nfs/dbraw/zinc/18/47/47/1120184747.db2.gz YIQGYCPYFPOUGI-INIZCTEOSA-N 1 0 298.430 3.878 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)Cc2ccccc2C)c1 ZINC000314478021 1120218640 /nfs/dbraw/zinc/21/86/40/1120218640.db2.gz OUHRJOACTFEUMT-LSDHHAIUSA-N 1 0 299.414 3.991 20 10 CHCDRO c1cc2c([nH]1)CCC[C@@H]2[NH2+]Cc1ccc2c(c1)CCCO2 ZINC000921815075 1120225056 /nfs/dbraw/zinc/22/50/56/1120225056.db2.gz HOLKZFJOPRWUJY-KRWDZBQOSA-N 1 0 282.387 3.507 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CC(C)(C)OC2(C)C)c1 ZINC000186499676 1120235416 /nfs/dbraw/zinc/23/54/16/1120235416.db2.gz SLPAYZGDKRJZJA-IUODEOHRSA-N 1 0 277.408 3.697 20 10 CHCDRO C[C@H]([NH2+][C@H]1Cc2cccc(Cl)c2C1)c1ccccc1O ZINC001168690240 1120256092 /nfs/dbraw/zinc/25/60/92/1120256092.db2.gz KKIPHXCLSWICIA-AAEUAGOBSA-N 1 0 287.790 3.864 20 10 CHCDRO COc1cccc(C[NH2+][C@H](C)c2cc3ccccc3o2)c1O ZINC000191129784 1128905223 /nfs/dbraw/zinc/90/52/23/1128905223.db2.gz CTLCUPUJVCTGGV-GFCCVEGCSA-N 1 0 297.354 3.998 20 10 CHCDRO C[C@H]1CC[C@@H](C[NH2+]Cc2cccc(Br)c2[O-])C1 ZINC000230410044 1120301412 /nfs/dbraw/zinc/30/14/12/1120301412.db2.gz SFDXONDOMLJIHL-WDEREUQCSA-N 1 0 298.224 3.681 20 10 CHCDRO C[C@H]([NH2+]CC1(c2ccccc2)CC1)c1cc(F)ccc1O ZINC000756396249 1120307147 /nfs/dbraw/zinc/30/71/47/1120307147.db2.gz IVEPRQUSXIGBCB-ZDUSSCGKSA-N 1 0 285.362 3.914 20 10 CHCDRO C[C@H]([NH2+]Cc1ccnn1C1CCC1)c1ccc(N(C)C)cc1 ZINC000922015435 1120336131 /nfs/dbraw/zinc/33/61/31/1120336131.db2.gz PTCNVJFIYVOSMP-AWEZNQCLSA-N 1 0 298.434 3.525 20 10 CHCDRO COC1(C[NH2+][C@H](C)c2ccc(C)cc2O)CCCCC1 ZINC000186505272 1120342006 /nfs/dbraw/zinc/34/20/06/1120342006.db2.gz JYRWFNNWWVWNAZ-CQSZACIVSA-N 1 0 277.408 3.701 20 10 CHCDRO c1cc2cccc(C[NH2+]Cc3ccc4c(c3)CCCO4)c2[nH]1 ZINC000922043330 1120346942 /nfs/dbraw/zinc/34/69/42/1120346942.db2.gz MWELEYBPZLFTQZ-UHFFFAOYSA-N 1 0 292.382 3.783 20 10 CHCDRO Cc1csc([C@@H](C)C[NH2+][C@@H](C)c2cc(F)ccc2O)n1 ZINC000186579471 1120402046 /nfs/dbraw/zinc/40/20/46/1120402046.db2.gz NCKILWYJWLSNHJ-ONGXEEELSA-N 1 0 294.395 3.751 20 10 CHCDRO FC1(F)CC(CC[NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC000922169142 1120442224 /nfs/dbraw/zinc/44/22/24/1120442224.db2.gz JMYOFAZWORIQEB-UHFFFAOYSA-N 1 0 281.346 3.537 20 10 CHCDRO Cc1cccc(C[N@@H+]2CC[C@H](C(F)(F)F)C2(C)C)c1O ZINC000312550717 1120466733 /nfs/dbraw/zinc/46/67/33/1120466733.db2.gz QIDMATFEWFCWNL-LBPRGKRZSA-N 1 0 287.325 3.863 20 10 CHCDRO CC[C@H]([NH2+]CC1(CC)CCOCC1)c1ccccc1O ZINC000312625779 1120495146 /nfs/dbraw/zinc/49/51/46/1120495146.db2.gz BICWCTPYHZKJLD-HNNXBMFYSA-N 1 0 277.408 3.640 20 10 CHCDRO c1cc2c(cccc2C[NH2+]Cc2ccc3c(c2)CCCO3)[nH]1 ZINC000922320367 1120511118 /nfs/dbraw/zinc/51/11/18/1120511118.db2.gz NWLOUWAJPMNHPA-UHFFFAOYSA-N 1 0 292.382 3.783 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CC2C[C@H]3CC[C@@H](C2)S3)cc1C ZINC000922422504 1120537230 /nfs/dbraw/zinc/53/72/30/1120537230.db2.gz LOOFTUUBCTZXPR-VHRNVKJDSA-N 1 0 291.460 3.773 20 10 CHCDRO CC(C)[N@H+](Cc1c(O)ccc2ccccc21)C1CC1 ZINC000078384468 1128924418 /nfs/dbraw/zinc/92/44/18/1128924418.db2.gz XSOMLTOJSKOHTD-UHFFFAOYSA-N 1 0 255.361 3.918 20 10 CHCDRO Cc1cnc(C[NH2+]C/C=C\c2ccc(N(C)C)cc2)c(C)c1 ZINC000922740232 1120589758 /nfs/dbraw/zinc/58/97/58/1120589758.db2.gz DXYQJHIIZZLEAO-WAYWQWQTSA-N 1 0 295.430 3.567 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2ccsc2Cl)c1 ZINC000312763268 1120615641 /nfs/dbraw/zinc/61/56/41/1120615641.db2.gz PBDGDDMOVKVGEX-SECBINFHSA-N 1 0 297.807 3.967 20 10 CHCDRO C[C@H]([NH2+]CC[C@H]1CC1(Cl)Cl)c1cc(F)ccc1O ZINC000857082391 1120628155 /nfs/dbraw/zinc/62/81/55/1120628155.db2.gz NDDGDQQZBHOHFI-IUCAKERBSA-N 1 0 292.181 3.766 20 10 CHCDRO CC[C@H]([NH2+]CCCOCC1CC1)c1ccc(N(C)C)cc1 ZINC000162872855 1120902158 /nfs/dbraw/zinc/90/21/58/1120902158.db2.gz LCBVANQUPGKKLE-SFHVURJKSA-N 1 0 290.451 3.610 20 10 CHCDRO COc1ccccc1C[C@@H](C)[N@H+](C)Cc1cccc(C)c1O ZINC000317254271 1121003986 /nfs/dbraw/zinc/00/39/86/1121003986.db2.gz KXYFYWDJTKZTIS-OAHLLOKOSA-N 1 0 299.414 3.772 20 10 CHCDRO COc1cc(C[NH2+][C@H](C)C2(C)CC2)c(O)c(C(C)(C)C)c1 ZINC001649122967 1121032559 /nfs/dbraw/zinc/03/25/59/1121032559.db2.gz MSOYRJTXQORLQV-GFCCVEGCSA-N 1 0 291.435 3.977 20 10 CHCDRO Cc1cc(Br)cc([C@H](C)[NH2+]CC2CC2)c1O ZINC000186979057 1121042610 /nfs/dbraw/zinc/04/26/10/1121042610.db2.gz SMPGWTGQYZHZDK-VIFPVBQESA-N 1 0 284.197 3.524 20 10 CHCDRO Fc1ccc(C[NH2+]Cc2ccc(N3CCCCC3)cc2)nc1 ZINC000763520857 1128960759 /nfs/dbraw/zinc/96/07/59/1128960759.db2.gz JSLBQODNHGFICC-UHFFFAOYSA-N 1 0 299.393 3.501 20 10 CHCDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]CC1CCSCC1 ZINC000168773913 1121143826 /nfs/dbraw/zinc/14/38/26/1121143826.db2.gz PSXOSJCXGKALKW-JSGCOSHPSA-N 1 0 291.460 3.982 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)C2CCCC2)c1 ZINC000070305440 1128966526 /nfs/dbraw/zinc/96/65/26/1128966526.db2.gz GNVKTZMWQSMXCT-VXGBXAGGSA-N 1 0 263.381 3.630 20 10 CHCDRO CSCC[C@H](C)[NH2+]Cc1cc2ccccc2cc1O ZINC001258207628 1128967573 /nfs/dbraw/zinc/96/75/73/1128967573.db2.gz FODRQVDRCKJEEN-LBPRGKRZSA-N 1 0 275.417 3.777 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCC2(F)CCC2)c(O)c1 ZINC000702433188 1121199553 /nfs/dbraw/zinc/19/95/53/1121199553.db2.gz UNJYZOREHUXEQC-GFCCVEGCSA-N 1 0 251.345 3.634 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H]2C[C@@H](OC(C)C)C2(C)C)cc1C ZINC000766087906 1121206374 /nfs/dbraw/zinc/20/63/74/1121206374.db2.gz HEZVBSYEAIIBFY-DLBZAZTESA-N 1 0 291.435 3.691 20 10 CHCDRO COc1cc(C)cc(C[N@H+](C)Cc2cc(C)cc(C)c2)c1O ZINC000766089049 1121210311 /nfs/dbraw/zinc/21/03/11/1121210311.db2.gz BIYPYNCYIOCFGW-UHFFFAOYSA-N 1 0 299.414 3.958 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc3c(c2)CCC3)c1 ZINC000182448531 1128970242 /nfs/dbraw/zinc/97/02/42/1128970242.db2.gz CAYHOBGGNZBQCF-ZDUSSCGKSA-N 1 0 297.398 3.740 20 10 CHCDRO C[C@H]([NH2+]Cc1ccccc1F)c1cc(F)ccc1O ZINC000094616731 1121216150 /nfs/dbraw/zinc/21/61/50/1121216150.db2.gz QKXIMNQMDQLUBP-JTQLQIEISA-N 1 0 263.287 3.521 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc3c(c2)CCO3)cc1F ZINC000094952895 1121247463 /nfs/dbraw/zinc/24/74/63/1121247463.db2.gz MLKZVUCOUNMNMN-CYBMUJFWSA-N 1 0 285.362 3.920 20 10 CHCDRO Cc1cccc(CCC[NH2+][C@H](C)c2ccccc2O)c1 ZINC001175418681 1121316992 /nfs/dbraw/zinc/31/69/92/1121316992.db2.gz NRWDJFUODQULGR-OAHLLOKOSA-N 1 0 269.388 3.984 20 10 CHCDRO C[C@H]([NH2+]Cc1cccc2ncccc12)c1ccccc1O ZINC001175419105 1121317905 /nfs/dbraw/zinc/31/79/05/1121317905.db2.gz RXQVSNRCFYEFDD-ZDUSSCGKSA-N 1 0 278.355 3.791 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCCC12CCOCC2)c1ccccc1O ZINC001175419493 1121318103 /nfs/dbraw/zinc/31/81/03/1121318103.db2.gz VPDFFYVNPNPVEB-CABCVRRESA-N 1 0 289.419 3.640 20 10 CHCDRO CC[C@@H]([NH2+]CCCCCC[NH3+])c1cccc(Cl)c1[O-] ZINC000843342697 1121323630 /nfs/dbraw/zinc/32/36/30/1121323630.db2.gz SGCOAXMFWIMOKL-CQSZACIVSA-N 1 0 284.831 3.605 20 10 CHCDRO C[C@H]1CCC[C@H](C)[NH+]1Cc1c(O)ccc(F)c1Cl ZINC001237121032 1128980448 /nfs/dbraw/zinc/98/04/48/1128980448.db2.gz JYJNNXKZMPLLAM-UWVGGRQHSA-N 1 0 271.763 3.948 20 10 CHCDRO CCC[C@@H](C[NH2+][C@H](C)c1cc(C)ccc1O)OCC ZINC000705314319 1121395708 /nfs/dbraw/zinc/39/57/08/1121395708.db2.gz HVSKCTGAGPLFQJ-KGLIPLIRSA-N 1 0 265.397 3.556 20 10 CHCDRO COc1cccc(C[NH2+]CC[C@@H]2CCC[C@H](C)C2)c1O ZINC000070546720 1128984961 /nfs/dbraw/zinc/98/49/61/1128984961.db2.gz NPKBEOIUSFMCMZ-KBPBESRZSA-N 1 0 277.408 3.707 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCCSC2)cc1F ZINC000236936604 1121497197 /nfs/dbraw/zinc/49/71/97/1121497197.db2.gz IQRNJIKQKLPXTK-AWEZNQCLSA-N 1 0 296.455 3.657 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)C[C@@H](O)c1ccco1)c1ccccc1O ZINC000248546104 1121573732 /nfs/dbraw/zinc/57/37/32/1121573732.db2.gz FNIPOUOUUCNGSN-IVMMDQJWSA-N 1 0 289.375 3.538 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCCO[C@H]2CC(C)C)c1 ZINC000248583111 1121574567 /nfs/dbraw/zinc/57/45/67/1121574567.db2.gz WNYLAORRVYKIBP-LESCRADOSA-N 1 0 291.435 3.945 20 10 CHCDRO CC[C@@H](C[NH2+]Cc1cc(C)ccc1O)c1ccccc1 ZINC000236985736 1121576561 /nfs/dbraw/zinc/57/65/61/1121576561.db2.gz ZZBJMZJTIVLMHE-HNNXBMFYSA-N 1 0 269.388 3.984 20 10 CHCDRO COc1cc(C)cc(C[NH2+][C@H](C)c2ccccc2)c1O ZINC000894146493 1121666397 /nfs/dbraw/zinc/66/63/97/1121666397.db2.gz SOOXPJOTRPIWPB-CYBMUJFWSA-N 1 0 271.360 3.560 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+][C@@H](C)C2CCCCC2)c1 ZINC000237055502 1121694936 /nfs/dbraw/zinc/69/49/36/1121694936.db2.gz FKWMSFIRZAAAQJ-ZDUSSCGKSA-N 1 0 277.408 3.849 20 10 CHCDRO C[C@@H]1CCC[C@H]([NH2+]Cc2ccc3c(c2)CCCO3)[C@@H]1C ZINC001177092316 1121712446 /nfs/dbraw/zinc/71/24/46/1121712446.db2.gz BWSYJJCIJGCLJY-CPUCHLNUSA-N 1 0 273.420 3.926 20 10 CHCDRO C[C@H]([NH2+]C1CCC(F)(F)CC1)c1cc(F)ccc1O ZINC000688499441 1129004329 /nfs/dbraw/zinc/00/43/29/1129004329.db2.gz BFKBQMVYYUPUME-VIFPVBQESA-N 1 0 273.298 3.760 20 10 CHCDRO CO[C@@H]1CCC[N@H+](Cc2cc(C)cc(C(C)(C)C)c2O)C1 ZINC000728049602 1121760241 /nfs/dbraw/zinc/76/02/41/1121760241.db2.gz HXVWGDUZJRXARF-OAHLLOKOSA-N 1 0 291.435 3.609 20 10 CHCDRO CCN(C)c1ccc(C[N@H+](Cc2ccccn2)C(C)C)cc1 ZINC000773731364 1121773556 /nfs/dbraw/zinc/77/35/56/1121773556.db2.gz TXLXRIDWROIIFS-UHFFFAOYSA-N 1 0 297.446 3.948 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]CC2(C3CC3)CCC2)cc1 ZINC001178272022 1121777195 /nfs/dbraw/zinc/77/71/95/1121777195.db2.gz ACFRAWWAORZLPS-HWKANZROSA-N 1 0 284.447 3.936 20 10 CHCDRO C[N@H+](Cc1ccc(N2CCCC2)cc1)[C@H]1C[C@H]2C[C@H]2C1 ZINC001167941403 1121786618 /nfs/dbraw/zinc/78/66/18/1121786618.db2.gz XPIIXQKIILHNKX-VQFNDLOPSA-N 1 0 270.420 3.517 20 10 CHCDRO CCN(C)c1ccc(C[N@H+](C)C2CCC(OC)CC2)cc1 ZINC000773748866 1121793071 /nfs/dbraw/zinc/79/30/71/1121793071.db2.gz BXXLUSQTWFQSHW-UHFFFAOYSA-N 1 0 290.451 3.532 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+]CCc1cccc(C)n1 ZINC001178628754 1121801939 /nfs/dbraw/zinc/80/19/39/1121801939.db2.gz DEQBGJUJAZYBSG-UHFFFAOYSA-N 1 0 293.414 3.522 20 10 CHCDRO CCC1([NH2+]Cc2ccc(N(C)C)c(F)c2)CCCC1 ZINC001178765966 1121815384 /nfs/dbraw/zinc/81/53/84/1121815384.db2.gz LADBMIRBQHNUBW-UHFFFAOYSA-N 1 0 264.388 3.704 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2ccc(N(C)C)c3ccccc23)CCCO1 ZINC001204232648 1121829749 /nfs/dbraw/zinc/82/97/49/1121829749.db2.gz HKCFTSQUYGPYHZ-OAHLLOKOSA-N 1 0 298.430 3.517 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C[C@@H]2CCC[C@H]2C2CC2)cc1F ZINC001178950016 1121832759 /nfs/dbraw/zinc/83/27/59/1121832759.db2.gz JNMRHIOPTUYFIG-HOTGVXAUSA-N 1 0 290.426 3.808 20 10 CHCDRO COCC1(C[NH2+]Cc2c(O)cc(C)cc2Cl)CCCC1 ZINC001178958245 1121835508 /nfs/dbraw/zinc/83/55/08/1121835508.db2.gz KPTSLVGROVPGOH-UHFFFAOYSA-N 1 0 297.826 3.650 20 10 CHCDRO CCN(C)c1ccc(C[NH2+][C@H](C)c2ccccc2)cc1 ZINC000773813253 1121872734 /nfs/dbraw/zinc/87/27/34/1121872734.db2.gz SSEKFGNAAVUMLP-OAHLLOKOSA-N 1 0 268.404 3.994 20 10 CHCDRO Cc1cc(C)cc(OCC[N@@H+](C)Cc2ccccc2O)c1 ZINC000731843047 1121888305 /nfs/dbraw/zinc/88/83/05/1121888305.db2.gz PJSVMXYSHIUWMC-UHFFFAOYSA-N 1 0 285.387 3.520 20 10 CHCDRO CN(C)c1cc(F)c(C[NH2+][C@@H]2CCCC3(CC3)C2)cc1F ZINC001179670334 1121901638 /nfs/dbraw/zinc/90/16/38/1121901638.db2.gz MHDXAMIMMOIMCB-CYBMUJFWSA-N 1 0 294.389 3.843 20 10 CHCDRO CN(C)c1cc(F)c(C[NH2+][C@H]2CCCC3(CC3)C2)cc1F ZINC001179670335 1121902226 /nfs/dbraw/zinc/90/22/26/1121902226.db2.gz MHDXAMIMMOIMCB-ZDUSSCGKSA-N 1 0 294.389 3.843 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[NH2+][C@@H]1C[C@H]2CCC[C@H]21 ZINC001179767648 1121906008 /nfs/dbraw/zinc/90/60/08/1121906008.db2.gz BXRPPCAVXVFYOG-KBAYOESNSA-N 1 0 270.420 3.565 20 10 CHCDRO COC1(C[NH2+]Cc2c(O)cccc2Cl)CCCCCC1 ZINC001179750475 1121908554 /nfs/dbraw/zinc/90/85/54/1121908554.db2.gz IAPVEOGWIQNESM-UHFFFAOYSA-N 1 0 297.826 3.875 20 10 CHCDRO C[C@]1([NH2+]Cc2ccc3c(c2)CCO3)CCCc2ccccc21 ZINC000732201853 1121911908 /nfs/dbraw/zinc/91/19/08/1121911908.db2.gz PPJOMODIYIAWTF-FQEVSTJZSA-N 1 0 293.410 3.963 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2C[C@@H](C)C[C@@H]2C)c(Cl)c1 ZINC001179898776 1121918795 /nfs/dbraw/zinc/91/87/95/1121918795.db2.gz UIQUZOGPDXCUSL-QWRGUYRKSA-N 1 0 253.773 3.584 20 10 CHCDRO COc1cc(C)cc(C[N@@H+]2CCCC[C@H]2C(C)C)c1O ZINC001179952862 1121930889 /nfs/dbraw/zinc/93/08/89/1121930889.db2.gz SWAZBAAAEAISRI-HNNXBMFYSA-N 1 0 277.408 3.720 20 10 CHCDRO Cc1ccc(C[N@H+]2C[C@H](C)[C@@H]2c2ccccc2)c(O)c1 ZINC001180141991 1121950212 /nfs/dbraw/zinc/95/02/12/1121950212.db2.gz KFTXUQVVSIKOMQ-KBXCAEBGSA-N 1 0 267.372 3.894 20 10 CHCDRO CCN(C)c1ccc(C[NH2+][C@@H]2CC(C)(C)OC2(C)C)cc1 ZINC000773852734 1121979104 /nfs/dbraw/zinc/97/91/04/1121979104.db2.gz CNYYBRRUYHITNQ-MRXNPFEDSA-N 1 0 290.451 3.578 20 10 CHCDRO CCc1cccc(C[NH2+]C2(Cc3ccccc3)CC2)c1O ZINC001180970224 1122026716 /nfs/dbraw/zinc/02/67/16/1122026716.db2.gz PQUOPPMOYFNPGJ-UHFFFAOYSA-N 1 0 281.399 3.820 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CC[C@@H]3CCCC[C@@H]3C2)c(O)c1 ZINC001181196048 1122040769 /nfs/dbraw/zinc/04/07/69/1122040769.db2.gz HOLQTONBTLUGAH-SQWLQELKSA-N 1 0 289.419 3.849 20 10 CHCDRO COc1cc(C)c(C[NH2+]C[C@@H]2CCC[C@H](C)[C@H]2C)c(O)c1 ZINC001181235334 1122043909 /nfs/dbraw/zinc/04/39/09/1122043909.db2.gz UZFPSOQBGXDIKQ-CFVMTHIKSA-N 1 0 291.435 3.871 20 10 CHCDRO COc1ccc(O)c(C[NH2+]C[C@@H]2CCC[C@@H](C)[C@@H]2C)c1 ZINC001181234594 1122044944 /nfs/dbraw/zinc/04/49/44/1122044944.db2.gz MMYUIUUSCMXIHT-RDBSUJKOSA-N 1 0 277.408 3.563 20 10 CHCDRO CCC[C@@H]([NH2+]Cc1cccc(OC)c1O)[C@H]1CC1(C)C ZINC001181487970 1122059131 /nfs/dbraw/zinc/05/91/31/1122059131.db2.gz RFWQXAKBNJBVCW-ZIAGYGMSSA-N 1 0 277.408 3.705 20 10 CHCDRO COc1cc(C)c(C[NH2+]Cc2coc3ccccc23)c(O)c1 ZINC001181959602 1122100396 /nfs/dbraw/zinc/10/03/96/1122100396.db2.gz XPAAHNLOYMPUIK-UHFFFAOYSA-N 1 0 297.354 3.745 20 10 CHCDRO Cc1ccc(O)c(C[N@H+]2CC[C@@H](C)C3(CCC3)C2)c1 ZINC000779604420 1129031904 /nfs/dbraw/zinc/03/19/04/1129031904.db2.gz LCYLURBTQHHFRM-CQSZACIVSA-N 1 0 259.393 3.713 20 10 CHCDRO CC(C)c1ccc(O)c(C[N@@H+]2C[C@H](C)[C@H](C)[C@H]2C)c1 ZINC001182450840 1122160641 /nfs/dbraw/zinc/16/06/41/1122160641.db2.gz AFRZTEZZALITFH-MELADBBJSA-N 1 0 261.409 3.992 20 10 CHCDRO Oc1ccccc1CNc1cc[nH+]c2cc(F)ccc12 ZINC000774523072 1122178525 /nfs/dbraw/zinc/17/85/25/1122178525.db2.gz DRYDLNBKBALPGS-UHFFFAOYSA-N 1 0 268.291 3.692 20 10 CHCDRO COc1ccc(N(C)CC[N@H+](C)CCCCC(C)C)cc1 ZINC001182726448 1122186272 /nfs/dbraw/zinc/18/62/72/1122186272.db2.gz SJROHDXJNUAPJJ-UHFFFAOYSA-N 1 0 292.467 3.890 20 10 CHCDRO CCc1cccc(C[N@@H+]2CCc3cc(OC)ccc3C2)c1O ZINC001182909838 1122195683 /nfs/dbraw/zinc/19/56/83/1122195683.db2.gz KCTOKWGROITNMY-UHFFFAOYSA-N 1 0 297.398 3.522 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C[C@H](C)c2cc(F)cc(F)c2)c1 ZINC001182960249 1122196788 /nfs/dbraw/zinc/19/67/88/1122196788.db2.gz PYUXKPCLLKMADA-LBPRGKRZSA-N 1 0 291.341 3.872 20 10 CHCDRO CCc1cccc(C[N@@H+]2CCC[C@H](C3CCC3)C2)c1O ZINC001182959508 1122197635 /nfs/dbraw/zinc/19/76/35/1122197635.db2.gz JBEVUXDDMPLMHB-INIZCTEOSA-N 1 0 273.420 3.967 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1cccc2cc[nH]c21 ZINC000237126516 1122210024 /nfs/dbraw/zinc/21/00/24/1122210024.db2.gz ZSRZDNRKVPUPMD-UHFFFAOYSA-N 1 0 293.414 3.832 20 10 CHCDRO COCC[C@@H]([NH2+][C@@H](C)c1ccccc1O)c1ccc(C)o1 ZINC000272812061 1122213606 /nfs/dbraw/zinc/21/36/06/1122213606.db2.gz DGYZMDKKFMGFAW-DZGCQCFKSA-N 1 0 289.375 3.722 20 10 CHCDRO C[C@H](C[N@H+](C)Cc1c(O)cccc1Cl)c1nccs1 ZINC000273150055 1122221101 /nfs/dbraw/zinc/22/11/01/1122221101.db2.gz HKVCDFXDLKYUTO-SNVBAGLBSA-N 1 0 296.823 3.738 20 10 CHCDRO CCc1cccc(C[NH2+]C2([C@@H]3CCCCO3)CCC2)c1O ZINC001183482994 1122224394 /nfs/dbraw/zinc/22/43/94/1122224394.db2.gz PSNYLUHVSRIWGH-INIZCTEOSA-N 1 0 289.419 3.536 20 10 CHCDRO CCn1cc(C[NH2+][C@H](C)c2ccc3ccccc3c2O)cn1 ZINC000273446424 1122232959 /nfs/dbraw/zinc/23/29/59/1122232959.db2.gz FBABXOXYRCUYPD-CYBMUJFWSA-N 1 0 295.386 3.613 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCc2ccncc2C)c(O)c1C ZINC000273499782 1122236022 /nfs/dbraw/zinc/23/60/22/1122236022.db2.gz PYPGREVEPIYZJJ-OAHLLOKOSA-N 1 0 284.403 3.606 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)ccc1O)[C@@H]1CCCCO1 ZINC000273505206 1122236879 /nfs/dbraw/zinc/23/68/79/1122236879.db2.gz QXAUBPBFKMCWEL-RWSFTLGLSA-N 1 0 283.799 3.654 20 10 CHCDRO Cc1cnccc1CC[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000273528119 1122237307 /nfs/dbraw/zinc/23/73/07/1122237307.db2.gz VURWIHQLRIVJKW-GFCCVEGCSA-N 1 0 290.794 3.642 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2cccc(N(C)C)c2)c1 ZINC000273565926 1122238840 /nfs/dbraw/zinc/23/88/40/1122238840.db2.gz JLYYQMYWEZPIFH-CQSZACIVSA-N 1 0 284.403 3.617 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](CCO)CC(C)C)c(O)c1C ZINC000273608506 1122240404 /nfs/dbraw/zinc/24/04/04/1122240404.db2.gz UYEMGKAXAOAXBF-HZPDHXFCSA-N 1 0 293.451 3.704 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2cn3cc(C)ccc3n2)c(O)c1 ZINC000273613408 1122241274 /nfs/dbraw/zinc/24/12/74/1122241274.db2.gz WTGQFGYVWKWQEM-AWEZNQCLSA-N 1 0 295.386 3.508 20 10 CHCDRO Cc1nc(C)c(C[NH2+][C@H](C)c2cc(Cl)ccc2O)s1 ZINC000273623110 1122241568 /nfs/dbraw/zinc/24/15/68/1122241568.db2.gz ZRYQWACBPMDAJA-MRVPVSSYSA-N 1 0 296.823 3.970 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]CC[C@@H]1C[C@H]1C1CC1 ZINC001183822038 1122241910 /nfs/dbraw/zinc/24/19/10/1122241910.db2.gz ANWVWALOXFNFOM-QAPCUYQASA-N 1 0 272.436 3.587 20 10 CHCDRO CCc1cccc(C[NH2+]C[C@H]2CCCC3(CCC3)O2)c1O ZINC001184076215 1122252994 /nfs/dbraw/zinc/25/29/94/1122252994.db2.gz FGJURHCYFWBYJB-MRXNPFEDSA-N 1 0 289.419 3.536 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](c1ccccc1)N(C)C)c1ccccc1O ZINC000192907405 1129046608 /nfs/dbraw/zinc/04/66/08/1129046608.db2.gz XQMRTVSJKPDIMO-QZTJIDSGSA-N 1 0 298.430 3.736 20 10 CHCDRO Oc1ccccc1C[NH2+]CCCc1c(F)cccc1Cl ZINC000774988681 1122379382 /nfs/dbraw/zinc/37/93/82/1122379382.db2.gz HEJFGMZKZYUZTC-UHFFFAOYSA-N 1 0 293.769 3.907 20 10 CHCDRO CCCN(C[C@H]1CCO[C@H](CC)C1)c1ccc(C[NH3+])cc1 ZINC000775139648 1122438435 /nfs/dbraw/zinc/43/84/35/1122438435.db2.gz DMOKFXAQQFWHRH-FUHWJXTLSA-N 1 0 290.451 3.567 20 10 CHCDRO CCCN(Cc1cccc(F)c1F)c1ccc(C[NH3+])cc1 ZINC000775139675 1122439234 /nfs/dbraw/zinc/43/92/34/1122439234.db2.gz DTRLDOSHMRACRX-UHFFFAOYSA-N 1 0 290.357 3.840 20 10 CHCDRO CCCN(Cc1ccc(CC)o1)c1ccc(C[NH3+])cc1 ZINC000775141181 1122439972 /nfs/dbraw/zinc/43/99/72/1122439972.db2.gz XVFITIVIXSGLJI-UHFFFAOYSA-N 1 0 272.392 3.717 20 10 CHCDRO CCCN(Cc1c(F)cccc1F)c1ccc(C[NH3+])cc1 ZINC000775141214 1122440563 /nfs/dbraw/zinc/44/05/63/1122440563.db2.gz ZTWULAAJINOJBZ-UHFFFAOYSA-N 1 0 290.357 3.840 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+]1CC[C@@H]1c1ccccc1 ZINC001237487420 1129055760 /nfs/dbraw/zinc/05/57/60/1129055760.db2.gz INNYIYDMGVABFD-MRXNPFEDSA-N 1 0 253.345 3.648 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]CCc2ccc(Cl)cc2)c1 ZINC000071406356 1129060227 /nfs/dbraw/zinc/06/02/27/1129060227.db2.gz MECQHJWZBIPBPE-UHFFFAOYSA-N 1 0 275.779 3.686 20 10 CHCDRO C[C@@H]([NH2+]Cc1cccc(F)c1F)c1ccc(N(C)C)cc1 ZINC000775362537 1122528149 /nfs/dbraw/zinc/52/81/49/1122528149.db2.gz HVZFMUOTYQQERN-GFCCVEGCSA-N 1 0 290.357 3.882 20 10 CHCDRO CC(C)C[C@@H]1OCCC[C@H]1[NH2+]Cc1cc(Cl)ccc1O ZINC000775373665 1122532649 /nfs/dbraw/zinc/53/26/49/1122532649.db2.gz ZLGATGURBMWEGK-ZBFHGGJFSA-N 1 0 297.826 3.729 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCC[C@H]1OC)c1ccc(N(C)C)cc1 ZINC000775417158 1122557434 /nfs/dbraw/zinc/55/74/34/1122557434.db2.gz LTTBKMJKGULNQI-BPQIPLTHSA-N 1 0 290.451 3.608 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)C1CC1)c1cc(Cl)ccc1O ZINC000775485391 1122616341 /nfs/dbraw/zinc/61/63/41/1122616341.db2.gz SPNNFWLIYVTGIG-RNCFNFMXSA-N 1 0 253.773 3.885 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccccn1)c1cc(Cl)ccc1O ZINC000775483466 1122616721 /nfs/dbraw/zinc/61/67/21/1122616721.db2.gz WNXQZECDRKBSGV-HNNXBMFYSA-N 1 0 290.794 3.724 20 10 CHCDRO CC[C@H]([NH2+]CCCOCC1CC1)c1cc(Cl)ccc1O ZINC000775484565 1122616891 /nfs/dbraw/zinc/61/68/91/1122616891.db2.gz DYYOLJVCCDIVDB-HNNXBMFYSA-N 1 0 297.826 3.903 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCCCO1)c1cc(Cl)ccc1O ZINC000775490812 1122619275 /nfs/dbraw/zinc/61/92/75/1122619275.db2.gz XHWIBMKHWXYHGP-OCCSQVGLSA-N 1 0 283.799 3.655 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)CN(CC)CC)c1cc(Cl)ccc1O ZINC000775498055 1122626871 /nfs/dbraw/zinc/62/68/71/1122626871.db2.gz GNGOBCVSVMHQGO-WFASDCNBSA-N 1 0 298.858 3.817 20 10 CHCDRO CC[C@H](COC)[NH2+][C@@H](CC)c1cc(Cl)ccc1O ZINC000775510205 1122631249 /nfs/dbraw/zinc/63/12/49/1122631249.db2.gz WQRWWTBPWKCNHE-YPMHNXCESA-N 1 0 271.788 3.511 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](C)c1ccncc1)c1ccccc1O ZINC000775512920 1122634688 /nfs/dbraw/zinc/63/46/88/1122634688.db2.gz SMQFKGPFSHXQFH-CJNGLKHVSA-N 1 0 270.376 3.632 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ncccc1F)c1cc(Cl)ccc1O ZINC000775523193 1122638381 /nfs/dbraw/zinc/63/83/81/1122638381.db2.gz DWKKSNDFRPOEBA-CYBMUJFWSA-N 1 0 294.757 3.821 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCO[C@@H](C)C1)c1cc(Cl)ccc1O ZINC000775520199 1122638708 /nfs/dbraw/zinc/63/87/08/1122638708.db2.gz QPTMGIICLCGWGA-HUBLWGQQSA-N 1 0 297.826 3.901 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](C)SC)c1cc(Cl)ccc1O ZINC000775524664 1122641788 /nfs/dbraw/zinc/64/17/88/1122641788.db2.gz VRWNVBNHMLDKGY-JOYOIKCWSA-N 1 0 273.829 3.838 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCO[C@@H](C)C1)c1cc(Cl)ccc1O ZINC000775525733 1122645637 /nfs/dbraw/zinc/64/56/37/1122645637.db2.gz MWAFNMBVTKQVQQ-JKOKRWQUSA-N 1 0 283.799 3.654 20 10 CHCDRO CC[C@H]([NH2+]Cc1nn(C)c2ccccc12)c1ccccc1O ZINC000775555050 1122661187 /nfs/dbraw/zinc/66/11/87/1122661187.db2.gz IAHOUMUXEFDBSP-HNNXBMFYSA-N 1 0 295.386 3.520 20 10 CHCDRO CC[C@H]([NH2+]CC[C@H]1CCOC1)c1cc(Cl)ccc1O ZINC000775552475 1122661992 /nfs/dbraw/zinc/66/19/92/1122661992.db2.gz VQSLIALKKNTYBG-FZMZJTMJSA-N 1 0 283.799 3.513 20 10 CHCDRO Cc1cc(Cl)cc(C[NH+]2CCCCCC2)c1O ZINC000775639483 1122848440 /nfs/dbraw/zinc/84/84/40/1122848440.db2.gz WZHCMKVFSJFTSU-UHFFFAOYSA-N 1 0 253.773 3.730 20 10 CHCDRO Cc1cccc(C[N@@H+]2Cc3ccccc3[C@H](C)C2)c1O ZINC000775646124 1122854318 /nfs/dbraw/zinc/85/43/18/1122854318.db2.gz GYCDRXXBNWGSEV-CQSZACIVSA-N 1 0 267.372 3.820 20 10 CHCDRO COc1ccc(O)c(C[N@H+](C)[C@@H]2CCCc3ccccc32)c1 ZINC000775646187 1122854393 /nfs/dbraw/zinc/85/43/93/1122854393.db2.gz HQQBSSFIESPHJW-GOSISDBHSA-N 1 0 297.398 3.910 20 10 CHCDRO CCCSC[C@@H](C)[NH2+][C@H](C)c1cc(OC)ccc1O ZINC000894502280 1122865780 /nfs/dbraw/zinc/86/57/80/1122865780.db2.gz OUFAWNWNRUVGGR-VXGBXAGGSA-N 1 0 283.437 3.583 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+](C)[C@H](C)C(C)C)c1O ZINC000775652511 1122868364 /nfs/dbraw/zinc/86/83/64/1122868364.db2.gz MGSFZNURFKTNIZ-LLVKDONJSA-N 1 0 255.789 3.830 20 10 CHCDRO COc1cc(C)cc(C[NH2+]C2CCC3(CC3)CC2)c1O ZINC000894568985 1122874932 /nfs/dbraw/zinc/87/49/32/1122874932.db2.gz BBFHNBOKKROCMU-UHFFFAOYSA-N 1 0 275.392 3.522 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CC(C)(C)[C@H]2c2ccccc2)c1 ZINC000775662346 1122876143 /nfs/dbraw/zinc/87/61/43/1122876143.db2.gz WJHGZBVENCJASB-GOSISDBHSA-N 1 0 297.398 3.984 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2CCCC2(C)C)c1O ZINC000775669742 1122886571 /nfs/dbraw/zinc/88/65/71/1122886571.db2.gz NAZGDIXNZLBJEL-UHFFFAOYSA-N 1 0 253.773 3.728 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)CCC=C(C)C)c(O)c1OC ZINC000894692578 1122893029 /nfs/dbraw/zinc/89/30/29/1122893029.db2.gz WFXNCDYJMRIPLR-CYBMUJFWSA-N 1 0 293.407 3.634 20 10 CHCDRO Cc1cccc2c1CC[N@@H+](Cc1cc(C)c(C)cc1O)C2 ZINC000729467215 1122894332 /nfs/dbraw/zinc/89/43/32/1122894332.db2.gz SYGACFCVCAQXCB-UHFFFAOYSA-N 1 0 281.399 3.876 20 10 CHCDRO COc1ccc(O)c(C[N@H+](C)C[C@H](C)c2ccccc2)c1 ZINC000775679262 1122900700 /nfs/dbraw/zinc/90/07/00/1122900700.db2.gz SWEPNDKEWFYQNW-AWEZNQCLSA-N 1 0 285.387 3.636 20 10 CHCDRO Cc1cccc(C[N@@H+]2CC[C@@H](c3cccc(F)c3)C2)c1O ZINC000775680826 1122901660 /nfs/dbraw/zinc/90/16/60/1122901660.db2.gz JRYYJTWXHIDZEH-OAHLLOKOSA-N 1 0 285.362 3.829 20 10 CHCDRO CCS[C@H]1CCCC[N@H+](Cc2cccc(C)c2O)C1 ZINC000775698784 1122911741 /nfs/dbraw/zinc/91/17/41/1122911741.db2.gz ZIOKSXZLBDZVOI-HNNXBMFYSA-N 1 0 279.449 3.808 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCCc3sccc3C2)c1O ZINC000775689828 1122911749 /nfs/dbraw/zinc/91/17/49/1122911749.db2.gz MGDZTXTWCRCXJO-UHFFFAOYSA-N 1 0 273.401 3.711 20 10 CHCDRO CC[C@H](Cc1ccccc1)[N@H+](C)Cc1cc(OC)ccc1O ZINC000775719625 1122924376 /nfs/dbraw/zinc/92/43/76/1122924376.db2.gz WJAYLAMPKOGXOK-QGZVFWFLSA-N 1 0 299.414 3.854 20 10 CHCDRO Cc1cccc(C[N@@H+]2CC[C@H]2Cc2ccccc2)c1O ZINC000775726498 1122926231 /nfs/dbraw/zinc/92/62/31/1122926231.db2.gz WDGWALTZPWWVSA-KRWDZBQOSA-N 1 0 267.372 3.518 20 10 CHCDRO CCCOc1ccc(C[NH2+]CCc2ccco2)cc1C ZINC001198942742 1123016437 /nfs/dbraw/zinc/01/64/37/1123016437.db2.gz ASUABZJYVJIOSX-UHFFFAOYSA-N 1 0 273.376 3.709 20 10 CHCDRO C[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc2c(c1)CCCO2 ZINC001198958918 1123016634 /nfs/dbraw/zinc/01/66/34/1123016634.db2.gz FTVHGIAAAKBSDS-CJNGLKHVSA-N 1 0 259.393 3.680 20 10 CHCDRO c1ccc(C2CC([NH2+]Cc3ccc4c(c3)CCO4)C2)cc1 ZINC000105492401 1123053994 /nfs/dbraw/zinc/05/39/94/1123053994.db2.gz OCQGEDBYFKSYGO-UHFFFAOYSA-N 1 0 279.383 3.657 20 10 CHCDRO CCO[C@@H](CC[NH2+]Cc1ccc2c(c1)CCCO2)C(C)C ZINC001200911946 1123063867 /nfs/dbraw/zinc/06/38/67/1123063867.db2.gz WMZSNBPMRIYRJC-KRWDZBQOSA-N 1 0 291.435 3.552 20 10 CHCDRO CCOc1ccc(C[NH2+]Cc2coc3ccccc23)c(O)c1 ZINC000776174827 1123101535 /nfs/dbraw/zinc/10/15/35/1123101535.db2.gz HKNCNRYZBJFFOT-UHFFFAOYSA-N 1 0 297.354 3.827 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C[C@@H](C)c2ccc(F)cc2)c1 ZINC000776173739 1123101647 /nfs/dbraw/zinc/10/16/47/1123101647.db2.gz ILROGCVMFZSSCK-CYBMUJFWSA-N 1 0 273.351 3.733 20 10 CHCDRO CCCCC[N@@H+]1CCc2c(c3cc(OC)ccc3n2C)C1 ZINC001201734849 1123149422 /nfs/dbraw/zinc/14/94/22/1123149422.db2.gz CEGZDZYOPPXQSC-UHFFFAOYSA-N 1 0 286.419 3.735 20 10 CHCDRO CCOc1ccc(C[NH2+][C@@H](C)C2CCCCC2)c(O)c1 ZINC000776213069 1123150321 /nfs/dbraw/zinc/15/03/21/1123150321.db2.gz PNMFDADBQXCBHP-ZDUSSCGKSA-N 1 0 277.408 3.849 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+]C[C@H](C)c2ccncc2)c1O ZINC000776222780 1123156120 /nfs/dbraw/zinc/15/61/20/1123156120.db2.gz VMOUHNWKBQNBQL-LBPRGKRZSA-N 1 0 290.794 3.642 20 10 CHCDRO COc1cc(C[NH2+][C@H](C)C2CCC2)c(O)c(C(C)(C)C)c1 ZINC001201881132 1123156908 /nfs/dbraw/zinc/15/69/08/1123156908.db2.gz IONVGINZIPOWKW-GFCCVEGCSA-N 1 0 291.435 3.977 20 10 CHCDRO COc1cc(C)cc(C[NH2+]C2(c3ccccc3C)CC2)c1O ZINC000895075332 1123159262 /nfs/dbraw/zinc/15/92/62/1123159262.db2.gz CBXPQKIWHGZZSW-UHFFFAOYSA-N 1 0 297.398 3.797 20 10 CHCDRO CCC1([NH2+]Cc2cc(Cl)cc(C)c2O)CCC1 ZINC000776231513 1123172837 /nfs/dbraw/zinc/17/28/37/1123172837.db2.gz IJQUCVIMWRCXDZ-UHFFFAOYSA-N 1 0 253.773 3.776 20 10 CHCDRO Cc1cccc(C[NH2+]C2(Cc3ccccc3)CCC2)c1O ZINC000776240166 1123175685 /nfs/dbraw/zinc/17/56/85/1123175685.db2.gz PVYALTQVWHCPOU-UHFFFAOYSA-N 1 0 281.399 3.956 20 10 CHCDRO COc1cc(C[NH2+]C2(C3CC3)CC2)c(O)c(C(C)(C)C)c1 ZINC000850190886 1123245553 /nfs/dbraw/zinc/24/55/53/1123245553.db2.gz ODAXHXZAKQHUFI-UHFFFAOYSA-N 1 0 289.419 3.731 20 10 CHCDRO COc1cc(C[NH2+]CC[C@@H](C)F)c(O)c(C(C)(C)C)c1 ZINC000850311760 1123253157 /nfs/dbraw/zinc/25/31/57/1123253157.db2.gz WEQOBEQPHJBFGZ-LLVKDONJSA-N 1 0 283.387 3.536 20 10 CHCDRO COc1cccc(CNc2[nH+]ccc(C)c2C2CC2)c1O ZINC000850362891 1123257117 /nfs/dbraw/zinc/25/71/17/1123257117.db2.gz UBMUPGQDJRZNHT-UHFFFAOYSA-N 1 0 284.359 3.594 20 10 CHCDRO CCOCc1cc(C[NH2+]C2(CC(C)C)CC2)ccc1OC ZINC000850404315 1123263550 /nfs/dbraw/zinc/26/35/50/1123263550.db2.gz GORVGBCQIIGLDC-UHFFFAOYSA-N 1 0 291.435 3.900 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]C2CC(C)(C)C2)cc1 ZINC000850416698 1123264116 /nfs/dbraw/zinc/26/41/16/1123264116.db2.gz OLWDNEULQHZEBM-AATRIKPKSA-N 1 0 258.409 3.544 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2[C@H]3Cc4cc(F)ccc4[C@@H]23)cc1C ZINC000850408726 1123264213 /nfs/dbraw/zinc/26/42/13/1123264213.db2.gz DETXCYFHRNAYFS-QXAKKESOSA-N 1 0 297.373 3.571 20 10 CHCDRO COc1cccc(C[NH2+]Cc2cc(Cl)ccc2O)c1C ZINC000850417116 1123264388 /nfs/dbraw/zinc/26/43/88/1123264388.db2.gz WMBUHIPGKUEWOR-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCN1C(C)(C)C)c1ccc(Cl)cc1O ZINC000850481919 1123273402 /nfs/dbraw/zinc/27/34/02/1123273402.db2.gz OQJJSJLLFSBDFI-AAEUAGOBSA-N 1 0 296.842 3.569 20 10 CHCDRO COC1CC(CC[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)C1 ZINC000850483479 1123273995 /nfs/dbraw/zinc/27/39/95/1123273995.db2.gz XXYSFEZUTVESFI-LKSINWNRSA-N 1 0 297.826 3.820 20 10 CHCDRO CC[C@@H](COCC1CC1)[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000850492254 1123274402 /nfs/dbraw/zinc/27/44/02/1123274402.db2.gz CFCMKAQSEYPUDQ-RISCZKNCSA-N 1 0 297.826 3.901 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CCN(C(C)(C)C)C1)c1ccc(C)cc1O ZINC000850492208 1123274415 /nfs/dbraw/zinc/27/44/15/1123274415.db2.gz BQKLXRZMJRZHAS-GOEBONIOSA-N 1 0 290.451 3.614 20 10 CHCDRO CC[C@H](COCC1CC1)[NH2+][C@H](CC)c1ccc(C)cc1O ZINC000850493132 1123274422 /nfs/dbraw/zinc/27/44/22/1123274422.db2.gz HKMUSJDGMZWZOX-NVXWUHKLSA-N 1 0 291.435 3.947 20 10 CHCDRO CC[C@H]([NH2+]CCC1(CSC)CC1)c1ccccc1O ZINC000850506734 1123276714 /nfs/dbraw/zinc/27/67/14/1123276714.db2.gz LAGMUSPUMBJUSF-AWEZNQCLSA-N 1 0 279.449 3.966 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H]2Cc3ccccc3[C@@H]2C)c1 ZINC000850517928 1123279011 /nfs/dbraw/zinc/27/90/11/1123279011.db2.gz IAFXFGZYAKZVAX-VEVIJQCQSA-N 1 0 297.398 3.780 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2COC3(CCC3)C2)c1O ZINC000850523802 1123279767 /nfs/dbraw/zinc/27/97/67/1123279767.db2.gz POSWUSCFRWMVEB-AAEUAGOBSA-N 1 0 295.810 3.716 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1COC2(CCC2)C1)c1cc(Cl)ccc1O ZINC000850523340 1123280268 /nfs/dbraw/zinc/28/02/68/1123280268.db2.gz GRWJSSJMLZZKPN-TZMCWYRMSA-N 1 0 295.810 3.798 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccoc1)c1cc(Cl)ccc1O ZINC000850531582 1123284953 /nfs/dbraw/zinc/28/49/53/1123284953.db2.gz MFKYBCLLLHNJNQ-SNVBAGLBSA-N 1 0 265.740 3.532 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1C[C@H](O)c2ccccc21)c1ccccc1O ZINC000850530242 1123284960 /nfs/dbraw/zinc/28/49/60/1123284960.db2.gz XTTKWQMIMRVCPM-JZXOWHBKSA-N 1 0 283.371 3.611 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccoc1)c1cc(Cl)ccc1O ZINC000850531002 1123285120 /nfs/dbraw/zinc/28/51/20/1123285120.db2.gz GBIBCWHTNKNOAV-AWEZNQCLSA-N 1 0 279.767 3.922 20 10 CHCDRO C[C@H]([NH2+]CCc1cn(C)c2ccccc12)c1ccccc1O ZINC000850533894 1123285771 /nfs/dbraw/zinc/28/57/71/1123285771.db2.gz DDGJADDCQIAHSM-AWEZNQCLSA-N 1 0 294.398 3.777 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCC[C@H](C)O1)c1ccc(C)cc1O ZINC000850535021 1123286427 /nfs/dbraw/zinc/28/64/27/1123286427.db2.gz PQYKJGHNNSGSSF-LZWOXQAQSA-N 1 0 277.408 3.699 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1C(C)(C)C1(F)F)c1ccccc1O ZINC000850553635 1123290210 /nfs/dbraw/zinc/29/02/10/1123290210.db2.gz ZTLVEOLXQCCNEM-WCQYABFASA-N 1 0 269.335 3.724 20 10 CHCDRO CC[C@H]([NH2+]CCC1SCCS1)c1ccc(C)cc1O ZINC000850568842 1123293671 /nfs/dbraw/zinc/29/36/71/1123293671.db2.gz KUAMNEDISQONLS-ZDUSSCGKSA-N 1 0 297.489 3.938 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1CCOC1(C)C)c1ccc(N(C)C)cc1 ZINC000850570326 1123294113 /nfs/dbraw/zinc/29/41/13/1123294113.db2.gz GADXEFLGULFTAY-DOTOQJQBSA-N 1 0 290.451 3.608 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1CCOC1(C)C)c1ccc(C)cc1O ZINC000850570397 1123294116 /nfs/dbraw/zinc/29/41/16/1123294116.db2.gz GWAPYVALFBJQGD-UKRRQHHQSA-N 1 0 277.408 3.556 20 10 CHCDRO C[C@H]1C[C@H]([NH2+]CCCc2ccco2)c2c1c(F)ccc2O ZINC000850570552 1123294121 /nfs/dbraw/zinc/29/41/21/1123294121.db2.gz WDXUNHXUMDJPEC-FZMZJTMJSA-N 1 0 289.350 3.895 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H](O)[C@H](C)c2ccccc2)c1 ZINC000850572768 1123295546 /nfs/dbraw/zinc/29/55/46/1123295546.db2.gz GEIZFIHDVANASM-VCBZYWHSSA-N 1 0 299.414 3.516 20 10 CHCDRO COc1cccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)c1C ZINC000850579105 1123296501 /nfs/dbraw/zinc/29/65/01/1123296501.db2.gz RVLAQTAZWKEJJV-HNNXBMFYSA-N 1 0 298.430 3.920 20 10 CHCDRO CC(C)(C)[C@H]1C[C@@H]([NH2+]Cc2cc(Cl)ccc2O)CCO1 ZINC000721827846 1123303399 /nfs/dbraw/zinc/30/33/99/1123303399.db2.gz PXHJBEQYHHKHRU-DZGCQCFKSA-N 1 0 297.826 3.729 20 10 CHCDRO CC(C)(C)[C@@H]1C[C@@H]([NH2+]Cc2cc(Cl)ccc2O)CCO1 ZINC000721827853 1123304644 /nfs/dbraw/zinc/30/46/44/1123304644.db2.gz PXHJBEQYHHKHRU-ZFWWWQNUSA-N 1 0 297.826 3.729 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]C1CCC(F)(F)CC1)CC2 ZINC000688491832 1123357499 /nfs/dbraw/zinc/35/74/99/1123357499.db2.gz VWXBCGNAESOBTN-LBPRGKRZSA-N 1 0 267.319 3.547 20 10 CHCDRO C[N@@H+](Cc1c(O)ccc2ccccc21)C[C@H]1CCCCO1 ZINC000108643341 1123364557 /nfs/dbraw/zinc/36/45/57/1123364557.db2.gz DBIJLVDJCJJHEE-OAHLLOKOSA-N 1 0 285.387 3.546 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H]2CCc3c2cccc3F)cc1 ZINC000110058848 1123369031 /nfs/dbraw/zinc/36/90/31/1123369031.db2.gz UKRGETBBQJKFBH-SFHVURJKSA-N 1 0 284.378 3.669 20 10 CHCDRO CC(C)n1cc([C@H](C)[NH2+][C@@H](C)c2ccccc2O)cn1 ZINC000783511469 1123407545 /nfs/dbraw/zinc/40/75/45/1123407545.db2.gz ZPCQXKSGOXYMSD-STQMWFEESA-N 1 0 273.380 3.581 20 10 CHCDRO CC(C)(C[NH2+][C@H]1CCc2cccc(O)c21)CC(F)(F)F ZINC000853240140 1123428770 /nfs/dbraw/zinc/42/87/70/1123428770.db2.gz GRFCJIQNXLSOAH-NSHDSACASA-N 1 0 287.325 3.948 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CC2(O)CCC(C)CC2)c(O)c1 ZINC000853237612 1123429413 /nfs/dbraw/zinc/42/94/13/1123429413.db2.gz NLSXZBALVVURBU-HBSPSFQMSA-N 1 0 291.435 3.601 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCO[C@H](C)C1)c1ccc2ccccc2c1O ZINC000273534640 1129126735 /nfs/dbraw/zinc/12/67/35/1129126735.db2.gz XECQLVUGNYPRIW-NFAWXSAZSA-N 1 0 285.387 3.764 20 10 CHCDRO Cc1nc(C)c(C[NH2+][C@@H](C)c2ccc(C)cc2O)s1 ZINC000273597430 1129126820 /nfs/dbraw/zinc/12/68/20/1129126820.db2.gz RABXNUKNRAJAIG-JTQLQIEISA-N 1 0 276.405 3.625 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc(Cl)c(C)cc1O)[C@@H]1CCCOC1 ZINC000895664131 1123502995 /nfs/dbraw/zinc/50/29/95/1123502995.db2.gz PWMSNOHNLNHQNW-IUODEOHRSA-N 1 0 297.826 3.649 20 10 CHCDRO Oc1ccccc1C[N@H+](C[C@H]1CCC=CO1)C1CCCC1 ZINC000193932682 1129125921 /nfs/dbraw/zinc/12/59/21/1129125921.db2.gz RQNXEOKCOAAUGX-QGZVFWFLSA-N 1 0 287.403 3.830 20 10 CHCDRO CCC[N@@H+](Cc1ccccc1O)C[C@H]1CCO[C@H](CC)C1 ZINC000780758815 1123543818 /nfs/dbraw/zinc/54/38/18/1123543818.db2.gz WTEZANFHGIOTLU-DOTOQJQBSA-N 1 0 291.435 3.809 20 10 CHCDRO CC(C)(C[NH2+]Cc1cc(Cl)ccc1O)CC(F)F ZINC000883251746 1123544619 /nfs/dbraw/zinc/54/46/19/1123544619.db2.gz AYLRDEXEJLGSMN-UHFFFAOYSA-N 1 0 277.742 3.817 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2C[C@@H]3CC[C@@H](C3)C2)cc1F ZINC001648965834 1123550259 /nfs/dbraw/zinc/55/02/59/1123550259.db2.gz VFDOJOYZPZRIBV-AGGWBTHJSA-N 1 0 276.399 3.560 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CCCC(F)(F)F)cc1 ZINC000097988837 1123577116 /nfs/dbraw/zinc/57/71/16/1123577116.db2.gz NUUBMWVFMCVXMY-UHFFFAOYSA-N 1 0 288.357 3.965 20 10 CHCDRO C[C@@H]1C[C@@H]([NH2+]CC[C@@H]2CC2(F)F)c2c1c(F)ccc2O ZINC000857082193 1123585756 /nfs/dbraw/zinc/58/57/56/1123585756.db2.gz UQVBZMUNPQCGOE-FXPVBKGRSA-N 1 0 285.309 3.715 20 10 CHCDRO COc1ccc(F)c(C[NH2+][C@@H](C)c2ccc(C)cc2O)c1 ZINC000857082001 1123586126 /nfs/dbraw/zinc/58/61/26/1123586126.db2.gz SGKYCUQNROMBRB-LBPRGKRZSA-N 1 0 289.350 3.699 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]C(C)(C)/C=C\Cl)c1O ZINC000896747418 1123618731 /nfs/dbraw/zinc/61/87/31/1123618731.db2.gz LNOQQPJCBJISOK-PLNGDYQASA-N 1 0 290.190 3.675 20 10 CHCDRO CCOc1ccccc1C[NH2+]Cc1ccc(N(C)C)cc1C ZINC000115629160 1123620308 /nfs/dbraw/zinc/62/03/08/1123620308.db2.gz WGFDNLNZBYBHAQ-UHFFFAOYSA-N 1 0 298.430 3.750 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2cc(F)c(N(C)C)cc2F)cc1 ZINC000858087354 1123629986 /nfs/dbraw/zinc/62/99/86/1123629986.db2.gz NAIRXIMDRFAJLM-UHFFFAOYSA-N 1 0 290.357 3.629 20 10 CHCDRO CCC[C@H](C[NH2+][C@H](C)c1c(C)cc(C)cc1O)OCC ZINC000858450480 1123655294 /nfs/dbraw/zinc/65/52/94/1123655294.db2.gz DONXQFQLHMZNGL-HUUCEWRRSA-N 1 0 279.424 3.865 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H]2CO[C@@H](C3CC3)C2)c1O ZINC000858548247 1123661598 /nfs/dbraw/zinc/66/15/98/1123661598.db2.gz RPODEDAHAXRXIK-VZJVUDMVSA-N 1 0 295.810 3.572 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccns2)c(O)c1C ZINC000858575589 1123664103 /nfs/dbraw/zinc/66/41/03/1123664103.db2.gz BLRDDKNFWXWEAS-RYUDHWBXSA-N 1 0 276.405 3.877 20 10 CHCDRO Cc1cc(C[N@@H+]2CC[C@H]3CC[C@@H](C2)S3)ccc1N(C)C ZINC000859545778 1123700923 /nfs/dbraw/zinc/70/09/23/1123700923.db2.gz XQPLKORZTDGVQV-CVEARBPZSA-N 1 0 290.476 3.531 20 10 CHCDRO C[C@@H]1C[C@@H]([NH2+]Cc2ccc3ccccc3c2O)CCS1 ZINC000896951647 1123792388 /nfs/dbraw/zinc/79/23/88/1123792388.db2.gz LGPSGVHUXDWRCM-DOMZBBRYSA-N 1 0 287.428 3.919 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCC(F)(F)C1)c1ccc(N(C)C)cc1 ZINC000777243731 1123797174 /nfs/dbraw/zinc/79/71/74/1123797174.db2.gz XWXUVJQSIKJDKK-HIFRSBDPSA-N 1 0 282.378 3.981 20 10 CHCDRO CCN(CC)c1ccc(Cn2cnc3c2CCCC3)cc1 ZINC000862431739 1123808896 /nfs/dbraw/zinc/80/88/96/1123808896.db2.gz SOJQOVALQMBWQO-UHFFFAOYSA-N 1 0 283.419 3.656 20 10 CHCDRO COC1CCC([NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)CC1 ZINC000840793402 1123811201 /nfs/dbraw/zinc/81/12/01/1123811201.db2.gz ZOOQBBCIBGBOCJ-MLCFOIATSA-N 1 0 293.382 3.627 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)c1ccccc1O)c1ccc2c(c1)OCCO2 ZINC000192785065 1123816725 /nfs/dbraw/zinc/81/67/25/1123816725.db2.gz FXYLHWFVTGJULA-STQMWFEESA-N 1 0 299.370 3.575 20 10 CHCDRO Cc1cc(F)c(C[NH2+]Cc2cccc(C)c2O)c(F)c1 ZINC000897213666 1123846915 /nfs/dbraw/zinc/84/69/15/1123846915.db2.gz GHKZFOJDBPISIS-UHFFFAOYSA-N 1 0 277.314 3.577 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)[C@@](C)(OC)C1CC1)c1ccccc1O ZINC000840860500 1123860326 /nfs/dbraw/zinc/86/03/26/1123860326.db2.gz VHOYJMWIYJVNNU-ISTRZQFTSA-N 1 0 277.408 3.637 20 10 CHCDRO CO[C@@](C)([C@H](C)[NH2+][C@@H](C)c1cc(C)ccc1O)C1CC1 ZINC000840859982 1123862271 /nfs/dbraw/zinc/86/22/71/1123862271.db2.gz RAKRLUGBLSIOSL-DCGLDWPTSA-N 1 0 277.408 3.555 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](CC(C)C)N(C)C)c1ccc(C)cc1O ZINC000794798555 1123949906 /nfs/dbraw/zinc/94/99/06/1123949906.db2.gz WFRPMZBNQDXAGW-DOTOQJQBSA-N 1 0 292.467 3.718 20 10 CHCDRO CC[C@@H]([NH2+]CCN(C(C)C)C(C)C)c1ccc(C)cc1O ZINC000794792920 1123950569 /nfs/dbraw/zinc/95/05/69/1123950569.db2.gz HXZRNTSRHSVECN-QGZVFWFLSA-N 1 0 292.467 3.860 20 10 CHCDRO CC[C@H]([NH2+]CCOCc1ccccc1)c1ccc(C)cc1O ZINC000794799867 1123950760 /nfs/dbraw/zinc/95/07/60/1123950760.db2.gz AAJYIWILJWIKRS-SFHVURJKSA-N 1 0 299.414 3.958 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccoc1C)c1ccc(C)cc1O ZINC000794805731 1123955271 /nfs/dbraw/zinc/95/52/71/1123955271.db2.gz QLUASZODFUZSEB-HNNXBMFYSA-N 1 0 259.349 3.843 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1C[C@@H](C)O[C@@H](C)C1)c1ccc(C)cc1O ZINC000794814330 1123957134 /nfs/dbraw/zinc/95/71/34/1123957134.db2.gz CYMNHXYNXDRQSJ-FQLMCAECSA-N 1 0 277.408 3.697 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCC[C@H]1OC)c1ccc(C)cc1O ZINC000794815180 1123957857 /nfs/dbraw/zinc/95/78/57/1123957857.db2.gz HYFDIRIPYBHGFN-UKPHBRMFSA-N 1 0 277.408 3.556 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1ccc[nH]1)c1ccc(C)cc1O ZINC000794814692 1123958301 /nfs/dbraw/zinc/95/83/01/1123958301.db2.gz HYCCHVUKPLDRPD-TZMCWYRMSA-N 1 0 258.365 3.831 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1ccc[nH]1)c1ccc(C)cc1O ZINC000794814687 1123958314 /nfs/dbraw/zinc/95/83/14/1123958314.db2.gz HYCCHVUKPLDRPD-JSGCOSHPSA-N 1 0 258.365 3.831 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)[C@H]1CCCOC1)c1ccc(C)cc1O ZINC000794818131 1123960550 /nfs/dbraw/zinc/96/05/50/1123960550.db2.gz QIKPQIFIZLRKFO-YCPHGPKFSA-N 1 0 277.408 3.556 20 10 CHCDRO COc1ccc(C[N@@H+]2CCc3ccccc3[C@@H]2C)c(O)c1 ZINC000093149713 1123961651 /nfs/dbraw/zinc/96/16/51/1123961651.db2.gz VLJHOOUUJVUHIJ-ZDUSSCGKSA-N 1 0 283.371 3.520 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)Cc2ccsc2)cc1F ZINC000120464319 1123965840 /nfs/dbraw/zinc/96/58/40/1123965840.db2.gz VLVQTXXOMJIAAB-UHFFFAOYSA-N 1 0 278.396 3.585 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CC)c1ccc(N(C)C)cc1)[C@H](O)C(C)C ZINC000840884157 1123996024 /nfs/dbraw/zinc/99/60/24/1123996024.db2.gz ZUCHOABMWLUFTE-RCCFBDPRSA-N 1 0 292.467 3.589 20 10 CHCDRO CCOCc1cc(C[NH2+][C@@H]2CCCC23CC3)ccc1OC ZINC000865657257 1124003361 /nfs/dbraw/zinc/00/33/61/1124003361.db2.gz YXQCGYTWBHYJGP-QGZVFWFLSA-N 1 0 289.419 3.654 20 10 CHCDRO Cc1cc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2)oc1C ZINC000282005956 1124008290 /nfs/dbraw/zinc/00/82/90/1124008290.db2.gz DGEFPBHDAQJRTA-CYBMUJFWSA-N 1 0 272.392 3.813 20 10 CHCDRO COCC[NH2+]Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O ZINC000205780780 1124026273 /nfs/dbraw/zinc/02/62/73/1124026273.db2.gz DEXMYGCYBPVNPV-UHFFFAOYSA-N 1 0 293.451 3.723 20 10 CHCDRO CC1=C(C)C[N@H+](Cc2cc(C(C)(C)C)cc(O)c2O)CC1 ZINC000794880384 1124026301 /nfs/dbraw/zinc/02/63/01/1124026301.db2.gz LCCNZWTZSNGOLP-UHFFFAOYSA-N 1 0 289.419 3.937 20 10 CHCDRO CC[C@@H]([NH2+]CC[C@H]1CCSC1)c1ccc(C)cc1O ZINC000866401593 1124062987 /nfs/dbraw/zinc/06/29/87/1124062987.db2.gz BEDWOIYKYSKALX-DZGCQCFKSA-N 1 0 279.449 3.885 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H](C)c2cnc(C)s2)c1O ZINC000866454399 1124067743 /nfs/dbraw/zinc/06/77/43/1124067743.db2.gz BEOMUSVQTAOHMH-UWVGGRQHSA-N 1 0 292.404 3.578 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(C)o1)c1ccc(C)cc1O ZINC000866479206 1124071207 /nfs/dbraw/zinc/07/12/07/1124071207.db2.gz RPYUAYPJCVLDII-OAHLLOKOSA-N 1 0 259.349 3.843 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@@H](CF)c1ccc(F)cc1)CC2 ZINC000866597083 1124086152 /nfs/dbraw/zinc/08/61/52/1124086152.db2.gz MRNZWNMWJSSEBG-GJZGRUSLSA-N 1 0 289.325 3.819 20 10 CHCDRO C[C@@H]([NH2+][C@H](CF)c1ccc(F)cc1)c1ccccc1O ZINC000866597211 1124086339 /nfs/dbraw/zinc/08/63/39/1124086339.db2.gz ZDVBBEOXCJWVFN-IAQYHMDHSA-N 1 0 277.314 3.893 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccc2ccccc2c1O)c1ccnn1C ZINC000866615001 1124089767 /nfs/dbraw/zinc/08/97/67/1124089767.db2.gz RYWUIUFYHIWDFW-QWHCGFSZSA-N 1 0 295.386 3.691 20 10 CHCDRO CC[C@H](C[C@H](C)O)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000866635050 1124093064 /nfs/dbraw/zinc/09/30/64/1124093064.db2.gz MHYZCLYWMPPIED-KCQAQPDRSA-N 1 0 287.403 3.746 20 10 CHCDRO COC(C)(C)C[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000122173192 1124471668 /nfs/dbraw/zinc/47/16/68/1124471668.db2.gz RFAUWDITRMGUKB-HNNXBMFYSA-N 1 0 290.451 3.753 20 10 CHCDRO COc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2C)cc1 ZINC000122783765 1124534431 /nfs/dbraw/zinc/53/44/31/1124534431.db2.gz WNGUGLMYIDQMGR-HNNXBMFYSA-N 1 0 298.430 3.920 20 10 CHCDRO CSCC(C)(C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001119963435 1131268784 /nfs/dbraw/zinc/26/87/84/1131268784.db2.gz IQPYZCITSMNNRB-UHFFFAOYSA-N 1 0 278.465 3.518 20 10 CHCDRO CC[C@H](CCc1ccccc1)[NH2+]Cc1cccc(OC)c1O ZINC000527760702 1124584626 /nfs/dbraw/zinc/58/46/26/1124584626.db2.gz HTTKUHAUIDJFMM-QGZVFWFLSA-N 1 0 299.414 3.902 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1C[C@@H]2CCC[C@@H]2O1)c1cc(Cl)ccc1O ZINC000872110040 1124685832 /nfs/dbraw/zinc/68/58/32/1124685832.db2.gz VJWXYKSLFAAPAA-GPMKHBRKSA-N 1 0 295.810 3.654 20 10 CHCDRO Cc1nccnc1[C@H](C)[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000872129721 1124690692 /nfs/dbraw/zinc/69/06/92/1124690692.db2.gz ATZPFKDZPBOQQJ-ONGXEEELSA-N 1 0 291.782 3.556 20 10 CHCDRO Cc1nccnc1[C@H](C)[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000872132358 1124691424 /nfs/dbraw/zinc/69/14/24/1124691424.db2.gz FFJWYZHNCOFLNA-KOLCDFICSA-N 1 0 291.782 3.556 20 10 CHCDRO CCCOc1ccc(C[NH2+][C@H](C)c2nccnc2C)cc1C ZINC000873186112 1124748120 /nfs/dbraw/zinc/74/81/20/1124748120.db2.gz FGYCENCQIRSFLO-OAHLLOKOSA-N 1 0 299.418 3.733 20 10 CHCDRO CCOCc1cc(C[NH2+]C2(C)CC(F)(F)C2)ccc1OC ZINC000873197915 1124750911 /nfs/dbraw/zinc/75/09/11/1124750911.db2.gz IPKAGVBSCFUKJK-UHFFFAOYSA-N 1 0 299.361 3.509 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC[C@H]2CNc3ccccc32)c(O)c1 ZINC000873236408 1124752629 /nfs/dbraw/zinc/75/26/29/1124752629.db2.gz HBSKRNXTQWRKNL-CABCVRRESA-N 1 0 296.414 3.951 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccc(OC)cc1)c1ccccc1O ZINC000019907444 1124768511 /nfs/dbraw/zinc/76/85/11/1124768511.db2.gz FRCYWHJEUBNXJY-QGZVFWFLSA-N 1 0 285.387 3.684 20 10 CHCDRO CCN(C)c1ccccc1C[NH2+][C@H](C)c1ccccc1O ZINC000783508133 1131284912 /nfs/dbraw/zinc/28/49/12/1131284912.db2.gz GNKDHEPCZCDQCT-CQSZACIVSA-N 1 0 284.403 3.699 20 10 CHCDRO COc1ccccc1[C@@H](C)[NH2+]Cc1cc(Cl)ccc1O ZINC000020096889 1124805542 /nfs/dbraw/zinc/80/55/42/1124805542.db2.gz BDWGMOLXWUOAMF-LLVKDONJSA-N 1 0 291.778 3.905 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)CCc2ccco2)c(O)c1 ZINC000020145208 1124809243 /nfs/dbraw/zinc/80/92/43/1124809243.db2.gz FKCDXODLXFUTFN-ZIAGYGMSSA-N 1 0 273.376 3.966 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+](CCc1nccs1)C(C)C ZINC000876776256 1124977115 /nfs/dbraw/zinc/97/71/15/1124977115.db2.gz AUBUBVFQFLCGBC-UHFFFAOYSA-N 1 0 290.432 3.610 20 10 CHCDRO Cc1cccc(O)c1C[N@H+](CCC(F)(F)F)CC1CC1 ZINC000876806574 1124980192 /nfs/dbraw/zinc/98/01/92/1124980192.db2.gz QSOOYYPBUMUVGT-UHFFFAOYSA-N 1 0 287.325 3.865 20 10 CHCDRO COc1ccccc1C(C)(C)[NH2+]Cc1ccc(C)cc1O ZINC000877007272 1124996683 /nfs/dbraw/zinc/99/66/83/1124996683.db2.gz JXFXSCIJSXZMMN-UHFFFAOYSA-N 1 0 285.387 3.734 20 10 CHCDRO Cc1ccc(C[NH2+]C(C)(C)c2cccc(F)c2)c(O)c1 ZINC000877043535 1125001611 /nfs/dbraw/zinc/00/16/11/1125001611.db2.gz LUJJVRDQCKDYDY-UHFFFAOYSA-N 1 0 273.351 3.865 20 10 CHCDRO Cc1ccc(C[NH2+][C@H]2CSc3ccccc32)c(O)c1 ZINC000877047793 1125003186 /nfs/dbraw/zinc/00/31/86/1125003186.db2.gz DJDREGNHVHXHAZ-AWEZNQCLSA-N 1 0 271.385 3.637 20 10 CHCDRO COc1ccc(C[NH2+]Cc2ccc(C)cc2O)cc1Cl ZINC000877109329 1125010894 /nfs/dbraw/zinc/01/08/94/1125010894.db2.gz GMMXLFMXUCIBII-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO C[C@H]([NH2+]Cc1cc(Cl)ccc1O)C1CC(F)(F)C1 ZINC000529619401 1125020614 /nfs/dbraw/zinc/02/06/14/1125020614.db2.gz XHFXRULPWHDAKZ-QMMMGPOBSA-N 1 0 275.726 3.569 20 10 CHCDRO Cc1ccc(C[N@@H+]2C[C@@H](C)C[C@@H]2c2cccnc2)c(O)c1 ZINC000877343211 1125023901 /nfs/dbraw/zinc/02/39/01/1125023901.db2.gz VXDAANLUIBIBSB-WMLDXEAASA-N 1 0 282.387 3.679 20 10 CHCDRO Cc1cccc(O)c1C[NH2+][C@@H]1CCCc2cn(C(C)C)nc21 ZINC000877376441 1125024173 /nfs/dbraw/zinc/02/41/73/1125024173.db2.gz SMFBNEUSTHUTRD-MRXNPFEDSA-N 1 0 299.418 3.645 20 10 CHCDRO Cc1cc(Cl)cc(C[NH+]2CC(Cc3ccco3)C2)c1O ZINC000529648399 1125029840 /nfs/dbraw/zinc/02/98/40/1125029840.db2.gz BKXPWTPHBVMAKG-UHFFFAOYSA-N 1 0 291.778 3.622 20 10 CHCDRO Cc1cccc(O)c1C[NH+]1CCC(CC(F)(F)F)CC1 ZINC000877508054 1125036945 /nfs/dbraw/zinc/03/69/45/1125036945.db2.gz QXTQCKZISZZCRP-UHFFFAOYSA-N 1 0 287.325 3.865 20 10 CHCDRO COc1cccc(C[NH2+][C@H](C)[C@@H]2C[C@H]2c2ccccc2)c1O ZINC000877525981 1125037741 /nfs/dbraw/zinc/03/77/41/1125037741.db2.gz NNTBXQATAYOMPV-COXVUDFISA-N 1 0 297.398 3.683 20 10 CHCDRO CCC[N@H+](CCc1ccccn1)Cc1ccc(C)cc1O ZINC000877521936 1125038194 /nfs/dbraw/zinc/03/81/94/1125038194.db2.gz GMQSCCGSWQBKSS-UHFFFAOYSA-N 1 0 284.403 3.550 20 10 CHCDRO Cc1ccc(C[NH2+]C[C@H]2CCCCC2(F)F)c(O)c1 ZINC000877555966 1125044370 /nfs/dbraw/zinc/04/43/70/1125044370.db2.gz HZUOVXWNPWMJCG-CYBMUJFWSA-N 1 0 269.335 3.616 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+]1CCSC2(CCC2)CC1 ZINC000877588381 1125049503 /nfs/dbraw/zinc/04/95/03/1125049503.db2.gz ZNAXEPWJEIYEPC-UHFFFAOYSA-N 1 0 277.433 3.562 20 10 CHCDRO Oc1c(C[NH2+]CC[C@H]2CCSC2)ccc2ccccc21 ZINC000877662187 1125058895 /nfs/dbraw/zinc/05/88/95/1125058895.db2.gz NERKUKCQCPPMNW-ZDUSSCGKSA-N 1 0 287.428 3.778 20 10 CHCDRO C[C@@H]([NH2+]Cc1csc(C(C)(C)C)n1)c1ccccc1O ZINC000877756296 1125071939 /nfs/dbraw/zinc/07/19/39/1125071939.db2.gz FSSMOYLYFZBEFO-LLVKDONJSA-N 1 0 290.432 3.997 20 10 CHCDRO C[C@H]([NH2+]Cc1ncc(C(C)(C)C)s1)c1ccccc1O ZINC000877758025 1125074482 /nfs/dbraw/zinc/07/44/82/1125074482.db2.gz DNBPNQWNKTWJRR-NSHDSACASA-N 1 0 290.432 3.997 20 10 CHCDRO C[C@H]([NH2+]CC[C@H]1CCCC1(F)F)c1ccccc1O ZINC000878354160 1125143092 /nfs/dbraw/zinc/14/30/92/1125143092.db2.gz DAGZETWPKPKODT-NWDGAFQWSA-N 1 0 269.335 3.868 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)c1 ZINC000127330486 1125178223 /nfs/dbraw/zinc/17/82/23/1125178223.db2.gz XPRABYWNKBOFEB-NVXWUHKLSA-N 1 0 297.398 3.827 20 10 CHCDRO C[C@H]([NH2+]CCCc1ccsc1)c1ccccc1O ZINC000879650688 1125224504 /nfs/dbraw/zinc/22/45/04/1125224504.db2.gz NNYHSMIWRMPGJC-LBPRGKRZSA-N 1 0 261.390 3.737 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CCCCC[C@@H]2C)c1O ZINC000228666467 1125251233 /nfs/dbraw/zinc/25/12/33/1125251233.db2.gz ILXDMJHDZSHKHQ-NSHDSACASA-N 1 0 283.799 3.819 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]CCCCC(F)(F)F)c1 ZINC000130498853 1125362703 /nfs/dbraw/zinc/36/27/03/1125362703.db2.gz LPCPSJGWWGMASY-SNVBAGLBSA-N 1 0 291.313 3.784 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]CC2(C)CC(F)(F)C2)cc1 ZINC000883250848 1125384907 /nfs/dbraw/zinc/38/49/07/1125384907.db2.gz QQLDUOAJUZOZHY-SNAWJCMRSA-N 1 0 294.389 3.791 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1C[C@H](OC)C1)c1cc(Cl)ccc1O ZINC000883272205 1125389985 /nfs/dbraw/zinc/38/99/85/1125389985.db2.gz GUADRYDTXROLDW-JKOKRWQUSA-N 1 0 283.799 3.511 20 10 CHCDRO CO[C@H](C[NH2+][C@H](C)c1ccc(N(C)C)cc1)c1ccccc1 ZINC000131429080 1125391448 /nfs/dbraw/zinc/39/14/48/1125391448.db2.gz MJCZRAPEGVJQPD-DNVCBOLYSA-N 1 0 298.430 3.791 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)c2cc(F)ccc2O)c(Cl)n1 ZINC000883301521 1125392263 /nfs/dbraw/zinc/39/22/63/1125392263.db2.gz BLSLURNWRBLOPV-SNVBAGLBSA-N 1 0 294.757 3.739 20 10 CHCDRO COC[C@H]1C[C@@H]([NH2+][C@@H](C)c2ccc3ccccc3c2O)C1 ZINC000883319710 1125395657 /nfs/dbraw/zinc/39/56/57/1125395657.db2.gz MRDHPZFWTODTMF-KCQAQPDRSA-N 1 0 285.387 3.621 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C2CCC3(COC3)CC2)c(O)c1 ZINC000883382015 1125406735 /nfs/dbraw/zinc/40/67/35/1125406735.db2.gz YEWHKDJBEOCZSO-AWEZNQCLSA-N 1 0 289.419 3.619 20 10 CHCDRO Cc1ccc(O)c(C[N@H+]2C[C@@H](c3ccccc3)OC[C@H]2C)c1 ZINC000245700138 1129218526 /nfs/dbraw/zinc/21/85/26/1129218526.db2.gz CZCYRQQWZGTWTL-BEFAXECRSA-N 1 0 297.398 3.663 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@H]1CCCc3occc31)CC2 ZINC000295901234 1129219381 /nfs/dbraw/zinc/21/93/81/1129219381.db2.gz IRFGTYZUKNYTPM-KBPBESRZSA-N 1 0 269.344 3.640 20 10 CHCDRO C[C@@H](CCc1ccco1)[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000295989594 1129220936 /nfs/dbraw/zinc/22/09/36/1129220936.db2.gz NRRIJSUUFWAVEG-SWLSCSKDSA-N 1 0 271.360 3.583 20 10 CHCDRO COc1ccc([C@@H](C)[NH2+][C@H]2CCc3cccc(O)c32)cc1 ZINC000296237682 1129221135 /nfs/dbraw/zinc/22/11/35/1129221135.db2.gz APXKFXPAMUNGCB-WBMJQRKESA-N 1 0 283.371 3.739 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCS[C@H]3CCCC[C@H]32)c1 ZINC000245755536 1129222848 /nfs/dbraw/zinc/22/28/48/1129222848.db2.gz ONDZUCMEOFNYOJ-ZBFHGGJFSA-N 1 0 277.433 3.561 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC(C)(C)N2CCCCC2)c(O)c1 ZINC000184847719 1129256396 /nfs/dbraw/zinc/25/63/96/1129256396.db2.gz GMNLIXWSFBXWLO-HNNXBMFYSA-N 1 0 290.451 3.616 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(C)c(F)c2)c1 ZINC000184910032 1129261642 /nfs/dbraw/zinc/26/16/42/1129261642.db2.gz ZVQPXWXXWLGFPU-ZDUSSCGKSA-N 1 0 273.351 3.999 20 10 CHCDRO COc1ccc(C[NH2+]CCSc2ccccc2)cc1C ZINC000037855681 1129276960 /nfs/dbraw/zinc/27/69/60/1129276960.db2.gz FAXXGWKZJJZNLM-UHFFFAOYSA-N 1 0 287.428 3.886 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1ccc(N(C)CC)cc1)[C@@H]1CCCO1 ZINC000246496643 1129287754 /nfs/dbraw/zinc/28/77/54/1129287754.db2.gz SGXMGMSAAIOPLD-JLSDUUJJSA-N 1 0 290.451 3.751 20 10 CHCDRO CN(C)c1ccc(C[NH2+]CC(C)(C)Oc2ccccc2)cc1 ZINC000734161222 1129298295 /nfs/dbraw/zinc/29/82/95/1129298295.db2.gz NTILYSZXBYGVTL-UHFFFAOYSA-N 1 0 298.430 3.700 20 10 CHCDRO CCOc1ccc(C[NH2+]C2(C)CCC(C)CC2)c(O)c1 ZINC000734844864 1129324480 /nfs/dbraw/zinc/32/44/80/1129324480.db2.gz ZKLOPDGPTQOMBT-UHFFFAOYSA-N 1 0 277.408 3.849 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C(C)(C)c2cccs2)c1 ZINC000735087042 1129330866 /nfs/dbraw/zinc/33/08/66/1129330866.db2.gz VBBSYKKYOMKXJZ-UHFFFAOYSA-N 1 0 261.390 3.787 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C[C@H]2CCc3ccccc3C2)cc1 ZINC000735324642 1129339220 /nfs/dbraw/zinc/33/92/20/1129339220.db2.gz XWBKBKVNZMAVCO-KRWDZBQOSA-N 1 0 294.442 3.647 20 10 CHCDRO CC[C@H](C)[C@H]1CCCC[N@@H+]1Cc1cc2c(cc1O)OCO2 ZINC000738056766 1129389884 /nfs/dbraw/zinc/38/98/84/1129389884.db2.gz QCDCZOYKQCPWRK-GXTWGEPZSA-N 1 0 291.391 3.522 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@H](C)CSC)cc1 ZINC000248147640 1129406847 /nfs/dbraw/zinc/40/68/47/1129406847.db2.gz QIVSUSRABDSWPB-CHWSQXEVSA-N 1 0 266.454 3.545 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C[C@H](C)C2CC2)cc1F ZINC000740004252 1129408970 /nfs/dbraw/zinc/40/89/70/1129408970.db2.gz LXIDLQKKEWOJNK-ZDUSSCGKSA-N 1 0 278.415 3.808 20 10 CHCDRO C[C@H](CN(C)Cc1ccccc1)[NH2+][C@H](C)c1ccccc1O ZINC000248394046 1129416530 /nfs/dbraw/zinc/41/65/30/1129416530.db2.gz XSSFRKFGOUIHHY-HZPDHXFCSA-N 1 0 298.430 3.563 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCO[C@H]2c2ccccc2)c1 ZINC000248518544 1129420295 /nfs/dbraw/zinc/42/02/95/1129420295.db2.gz PXAJOCXLTFXDOA-YJLNNSPDSA-N 1 0 297.398 3.881 20 10 CHCDRO CC(C)C[C@@H]1OCCC[C@@H]1[NH2+][C@H](C)c1ccccc1O ZINC000248546881 1129420964 /nfs/dbraw/zinc/42/09/64/1129420964.db2.gz FWPZYJXBHUORFR-KMFMINBZSA-N 1 0 277.408 3.637 20 10 CHCDRO Cc1cc(C)cc(CC[NH2+]Cc2c(O)cccc2Cl)c1 ZINC000740900822 1129423658 /nfs/dbraw/zinc/42/36/58/1129423658.db2.gz ZINUIFURWQAFFD-UHFFFAOYSA-N 1 0 289.806 3.995 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCc2ccccc2C)c(O)c1 ZINC000094182846 1129441735 /nfs/dbraw/zinc/44/17/35/1129441735.db2.gz ZOILZAWCGDDQGZ-HNNXBMFYSA-N 1 0 269.388 3.902 20 10 CHCDRO c1cncc([C@@H]([NH2+]Cc2ccc3c(c2)CCO3)C2CCC2)c1 ZINC000795788407 1129447619 /nfs/dbraw/zinc/44/76/19/1129447619.db2.gz LDCXXGNXXIQJCG-IBGZPJMESA-N 1 0 294.398 3.648 20 10 CHCDRO c1cncc([C@H]([NH2+]Cc2ccc3c(c2)CCO3)C2CCC2)c1 ZINC000795788408 1129447688 /nfs/dbraw/zinc/44/76/88/1129447688.db2.gz LDCXXGNXXIQJCG-LJQANCHMSA-N 1 0 294.398 3.648 20 10 CHCDRO C[C@H]1Cc2ccccc2C[N@@H+]1Cc1cc2c(cc1O)CCC2 ZINC000742159866 1129468340 /nfs/dbraw/zinc/46/83/40/1129468340.db2.gz TYUQQUQCXMJCJH-AWEZNQCLSA-N 1 0 293.410 3.828 20 10 CHCDRO CC[C@H](O)CCC[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000742374115 1129475449 /nfs/dbraw/zinc/47/54/49/1129475449.db2.gz YUWWCSIRKSLWJV-SFHVURJKSA-N 1 0 299.414 3.700 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CC[C@@H](C)C[C@H]2C)cc1C ZINC000250869878 1129501069 /nfs/dbraw/zinc/50/10/69/1129501069.db2.gz ATWBKMRBXNDJMR-XJKCOSOUSA-N 1 0 261.409 3.918 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCOC[C@@H]2c2ccccc2)cc1C ZINC000743407381 1129522745 /nfs/dbraw/zinc/52/27/45/1129522745.db2.gz WWCASOZYBRCWQM-GOSISDBHSA-N 1 0 297.398 3.583 20 10 CHCDRO CCC[N@H+](Cc1cccc(OC)c1)Cc1ccccc1O ZINC000743870598 1129542320 /nfs/dbraw/zinc/54/23/20/1129542320.db2.gz YQTZYTSWPDLHCJ-UHFFFAOYSA-N 1 0 285.387 3.813 20 10 CHCDRO C[C@@H]([NH2+]CC1=CCCOC1)c1ccc2ccccc2c1O ZINC000379735739 1129652909 /nfs/dbraw/zinc/65/29/09/1129652909.db2.gz JQVWPVXUBRGGER-CYBMUJFWSA-N 1 0 283.371 3.543 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H](OC)C(C)(C)C)cc1 ZINC000766368498 1129660543 /nfs/dbraw/zinc/66/05/43/1129660543.db2.gz IESXBZPHIHGKRD-WMLDXEAASA-N 1 0 292.467 3.854 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](OC)C(C)(C)C)c1ccc(N(C)C)cc1 ZINC000766370794 1129660912 /nfs/dbraw/zinc/66/09/12/1129660912.db2.gz VQEWMIFPYGCSJL-IAGOWNOFSA-N 1 0 292.467 3.854 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1c(C)noc1C ZINC000121337330 1129714420 /nfs/dbraw/zinc/71/44/20/1129714420.db2.gz MXOYYTVCZKHKTH-INIZCTEOSA-N 1 0 287.407 3.598 20 10 CHCDRO C[C@@H]1CSC[C@@H]1[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000796481217 1129741955 /nfs/dbraw/zinc/74/19/55/1129741955.db2.gz CPDZBNWHUZWOHS-DYVFJYSZSA-N 1 0 299.439 3.900 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)C1CCCCC1 ZINC000742373175 1129816628 /nfs/dbraw/zinc/81/66/28/1129816628.db2.gz GXFGYVSEZKALNM-CYBMUJFWSA-N 1 0 278.415 3.950 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H]2CCCC(F)(F)C2)cc1C ZINC000767927818 1129822491 /nfs/dbraw/zinc/82/24/91/1129822491.db2.gz DGIRFUFJUWVFQM-CYBMUJFWSA-N 1 0 269.335 3.677 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)C[C@@H]2CC=CCC2)cc1 ZINC000768129997 1129834898 /nfs/dbraw/zinc/83/48/98/1129834898.db2.gz MEIUWCMWCHJPSO-OAHLLOKOSA-N 1 0 258.409 3.541 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)C(C)C)cc1F ZINC000768141043 1129835916 /nfs/dbraw/zinc/83/59/16/1129835916.db2.gz MVZDLQLSQQMENB-UHFFFAOYSA-N 1 0 252.377 3.512 20 10 CHCDRO CCOc1cccc(C[N@H+](C)Cc2ccc(CC)cc2)c1O ZINC000768162753 1129837864 /nfs/dbraw/zinc/83/78/64/1129837864.db2.gz HPLDJFYAJRPALL-UHFFFAOYSA-N 1 0 299.414 3.985 20 10 CHCDRO COc1cccc(C[N@H+]2Cc3ccccc3[C@H](C)C2)c1O ZINC000768196643 1129841944 /nfs/dbraw/zinc/84/19/44/1129841944.db2.gz SYVVCJYNWFVBRG-CYBMUJFWSA-N 1 0 283.371 3.520 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](C)Cc2cccc(C)c2)c1 ZINC000768261547 1129849090 /nfs/dbraw/zinc/84/90/90/1129849090.db2.gz DRLWYKWBMRXSJJ-UHFFFAOYSA-N 1 0 285.387 3.731 20 10 CHCDRO CCCC[N@H+](Cc1cccc(OCC)c1O)C1CC1 ZINC000768291961 1129849606 /nfs/dbraw/zinc/84/96/06/1129849606.db2.gz SLTKGYWGMNKCSL-UHFFFAOYSA-N 1 0 263.381 3.555 20 10 CHCDRO Oc1cc2c(cc1C[N@@H+]1CCC[C@H]1C1CC1)CCCC2 ZINC000768452046 1129858141 /nfs/dbraw/zinc/85/81/41/1129858141.db2.gz NQKLCDMWALPOJR-KRWDZBQOSA-N 1 0 271.404 3.645 20 10 CHCDRO C[C@H]1C[N@H+](Cc2cc(-c3ccccc3)ccc2O)[C@@H](C)CO1 ZINC000768536268 1129861779 /nfs/dbraw/zinc/86/17/79/1129861779.db2.gz GXYXNOKJJIAITC-GJZGRUSLSA-N 1 0 297.398 3.668 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](C)[C@H](C)C(C)(C)C)c1 ZINC000768544020 1129863739 /nfs/dbraw/zinc/86/37/39/1129863739.db2.gz MJVYXTZXBWTPMO-GFCCVEGCSA-N 1 0 265.397 3.657 20 10 CHCDRO C[C@H]1CC[N@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000769103996 1129890525 /nfs/dbraw/zinc/89/05/25/1129890525.db2.gz VIOIBAGCBHSSOV-AWEZNQCLSA-N 1 0 267.372 3.901 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@H]3CCC[C@@H]32)cc1C ZINC000769101749 1129890653 /nfs/dbraw/zinc/89/06/53/1129890653.db2.gz GCCQFHJCYLNDME-HOCLYGCPSA-N 1 0 259.393 3.774 20 10 CHCDRO COc1cccc(O)c1C[N@@H+]1CC[C@@H](c2ccccc2C)C1 ZINC000769234908 1129897480 /nfs/dbraw/zinc/89/74/80/1129897480.db2.gz YSBXMZNBCFHIEU-OAHLLOKOSA-N 1 0 297.398 3.699 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CC[C@H]1C1CCC1 ZINC000800970749 1129900821 /nfs/dbraw/zinc/90/08/21/1129900821.db2.gz DSJLAYOFPHHRPV-ZWKOTPCHSA-N 1 0 272.436 3.729 20 10 CHCDRO CCOc1ccc(C[N@H+](C)Cc2ccc(C)s2)c(O)c1 ZINC000769315368 1129901871 /nfs/dbraw/zinc/90/18/71/1129901871.db2.gz ACFTUOSLQNOUJC-UHFFFAOYSA-N 1 0 291.416 3.793 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCc3ccccc3OC2)c1 ZINC000800986514 1129902841 /nfs/dbraw/zinc/90/28/41/1129902841.db2.gz GWQIFFSBVTVFBJ-GOEBONIOSA-N 1 0 297.398 3.745 20 10 CHCDRO CCOc1ccc(C[N@@H+]2[C@H](C)C[C@@H]3CCCC[C@@H]32)c(O)c1 ZINC000769403309 1129906684 /nfs/dbraw/zinc/90/66/84/1129906684.db2.gz BUHGTQJVKLJULG-KEYYUXOJSA-N 1 0 289.419 3.944 20 10 CHCDRO CC[C@@H]1c2ccccc2CC[N@H+]1Cc1c(O)cccc1OC ZINC000769428370 1129908180 /nfs/dbraw/zinc/90/81/80/1129908180.db2.gz QSAGFZQVFCETSV-QGZVFWFLSA-N 1 0 297.398 3.910 20 10 CHCDRO C[C@H]1COCCC[N@@H+]1Cc1cc(-c2ccccc2)ccc1O ZINC000769458410 1129911876 /nfs/dbraw/zinc/91/18/76/1129911876.db2.gz TZTWSWGXCKPUQV-HNNXBMFYSA-N 1 0 297.398 3.670 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCS[C@H]3CCCC[C@@H]32)cc1 ZINC000769497902 1129914354 /nfs/dbraw/zinc/91/43/54/1129914354.db2.gz HKFRSBXKSDUNBY-IRXDYDNUSA-N 1 0 290.476 3.613 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC[C@H]2c2cccc(F)c2)c1 ZINC000769507728 1129914565 /nfs/dbraw/zinc/91/45/65/1129914565.db2.gz NVSJRCYORKDNTK-INIZCTEOSA-N 1 0 271.335 3.787 20 10 CHCDRO CCS[C@@H]1CC[C@H]([N@H+](C)Cc2c(O)cccc2OC)C1 ZINC000769549026 1129917182 /nfs/dbraw/zinc/91/71/82/1129917182.db2.gz JUWGXIWUTIPHAI-QWHCGFSZSA-N 1 0 295.448 3.507 20 10 CHCDRO CC[C@H]1CCC[C@@H]1C[NH2+]Cc1ccc(OC)c(C)c1 ZINC001461514449 1129934403 /nfs/dbraw/zinc/93/44/03/1129934403.db2.gz JQWSWDVWWBKLSJ-JKSUJKDBSA-N 1 0 261.409 3.920 20 10 CHCDRO CS[C@H]1CCCC[N@H+](Cc2c(O)cccc2Cl)C1 ZINC000770352668 1129945768 /nfs/dbraw/zinc/94/57/68/1129945768.db2.gz YHVQFGSBHWVAIP-NSHDSACASA-N 1 0 285.840 3.763 20 10 CHCDRO Cc1ccccc1[C@@H]1CC[N@H+](Cc2ccccc2O)C1 ZINC000770511072 1129948765 /nfs/dbraw/zinc/94/87/65/1129948765.db2.gz YNEAYWPJKHTKAJ-OAHLLOKOSA-N 1 0 267.372 3.690 20 10 CHCDRO Cc1ccc(C[C@H](C)[N@H+](C)Cc2ccccc2O)cc1 ZINC000770511069 1129948863 /nfs/dbraw/zinc/94/88/63/1129948863.db2.gz YMPADPNIKMPOTQ-HNNXBMFYSA-N 1 0 269.388 3.764 20 10 CHCDRO COc1cc(C[N@@H+]2CC[C@@H](C)C3(CCC3)C2)c(O)cc1C ZINC000770671700 1129955043 /nfs/dbraw/zinc/95/50/43/1129955043.db2.gz UNUALMIXFUJHSF-CQSZACIVSA-N 1 0 289.419 3.721 20 10 CHCDRO Oc1ccccc1C[NH2+]CC1(Cc2ccc(F)cc2)CC1 ZINC000770742183 1129958429 /nfs/dbraw/zinc/95/84/29/1129958429.db2.gz RRHZMFLPGBVBOJ-UHFFFAOYSA-N 1 0 285.362 3.644 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccc(F)cn1 ZINC000771383027 1129977165 /nfs/dbraw/zinc/97/71/65/1129977165.db2.gz JOOACICLNLPFAU-CQSZACIVSA-N 1 0 299.393 3.672 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2)c(C)n1 ZINC000771370722 1129978056 /nfs/dbraw/zinc/97/80/56/1129978056.db2.gz NXRZPXCANDSNOH-AWEZNQCLSA-N 1 0 283.419 3.615 20 10 CHCDRO CCOCC[N@H+](C)Cc1cc2oc3ccccc3c2cc1O ZINC000771640676 1129987195 /nfs/dbraw/zinc/98/71/95/1129987195.db2.gz DHGWEAZTDKNVDI-UHFFFAOYSA-N 1 0 299.370 3.760 20 10 CHCDRO Cc1ccncc1[C@H](C)[NH2+]CCCSc1nccs1 ZINC000772454870 1130022086 /nfs/dbraw/zinc/02/20/86/1130022086.db2.gz VAJKHDOBWXTFJL-LBPRGKRZSA-N 1 0 293.461 3.680 20 10 CHCDRO COc1ccc(O)c(C[N@H+](C)[C@H](C)C2CCCCC2)c1 ZINC000802659215 1130028205 /nfs/dbraw/zinc/02/82/05/1130028205.db2.gz PAJQLIVIGBYPIZ-CYBMUJFWSA-N 1 0 277.408 3.801 20 10 CHCDRO CC[C@]1(C)C[N@H+](Cc2cc(C(C)C)c(C)cc2O)CCO1 ZINC000785512781 1130037870 /nfs/dbraw/zinc/03/78/70/1130037870.db2.gz UKTJXCXAJATXFN-GOSISDBHSA-N 1 0 291.435 3.825 20 10 CHCDRO Oc1ccccc1C[N@H+](C[C@H]1CCSC1)C1CCCC1 ZINC000787164769 1130135270 /nfs/dbraw/zinc/13/52/70/1130135270.db2.gz ODEIZMHEJIONNY-CQSZACIVSA-N 1 0 291.460 3.890 20 10 CHCDRO COC(C)(C)CC[N@H+](Cc1ccc(N(C)C)cc1)C(C)C ZINC000787184221 1130138272 /nfs/dbraw/zinc/13/82/72/1130138272.db2.gz ONFXRTDPFMDANM-UHFFFAOYSA-N 1 0 292.467 3.778 20 10 CHCDRO CC1(C)C[C@H]([NH2+][C@@H]2CCc3cccc(O)c32)CCS1 ZINC000903281819 1130145341 /nfs/dbraw/zinc/14/53/41/1130145341.db2.gz INEIOACEPDDKKQ-CHWSQXEVSA-N 1 0 277.433 3.643 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)c1cncs1 ZINC000903312137 1130152055 /nfs/dbraw/zinc/15/20/55/1130152055.db2.gz SORDFAGHZXGCKT-IUCAKERBSA-N 1 0 282.796 3.914 20 10 CHCDRO C[C@@H]([NH2+]C1CC2(C1)COC(C)(C)C2)c1cc(F)ccc1O ZINC000903323841 1130154463 /nfs/dbraw/zinc/15/44/63/1130154463.db2.gz LREIHRFQYRPVEN-FFLHNBHYSA-N 1 0 293.382 3.530 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)C(C)(C)OC)c1ccc(C)cc1O ZINC000903331434 1130158035 /nfs/dbraw/zinc/15/80/35/1130158035.db2.gz NKVFDZSRPHRVEP-OCCSQVGLSA-N 1 0 265.397 3.555 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@H](c2ccccn2)C2CC2)c1O ZINC000903335281 1130160795 /nfs/dbraw/zinc/16/07/95/1130160795.db2.gz NJLGPUAOJORIRM-PXAZEXFGSA-N 1 0 298.386 3.598 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)c1ccccc1O)c1cnn(CC2CCC2)c1 ZINC000903403631 1130171617 /nfs/dbraw/zinc/17/16/17/1130171617.db2.gz DJDDPKZESQFBKW-ZIAGYGMSSA-N 1 0 299.418 3.801 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H](c2ccncc2)C2CC2)c(O)c1 ZINC000903430342 1130176746 /nfs/dbraw/zinc/17/67/46/1130176746.db2.gz YVRZPRCEBZMVLC-UGSOOPFHSA-N 1 0 282.387 3.898 20 10 CHCDRO CCC(O)(CC)CC[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000788264500 1130180543 /nfs/dbraw/zinc/18/05/43/1130180543.db2.gz XYVMVAGNGABYNH-AAEUAGOBSA-N 1 0 295.398 3.610 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@H+]1CC[C@@H](C)C(C)(C)C1 ZINC001462062653 1130184560 /nfs/dbraw/zinc/18/45/60/1130184560.db2.gz SAMYSIVIBNDZPR-OAHLLOKOSA-N 1 0 274.452 3.929 20 10 CHCDRO C[C@@H]1C[C@@H]1C[N@H+](Cc1ccco1)Cc1ccccc1O ZINC000788444036 1130186915 /nfs/dbraw/zinc/18/69/15/1130186915.db2.gz WOYVJIFKGLJCDY-UKRRQHHQSA-N 1 0 271.360 3.643 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CCN(C)c2ccccc2)c(O)c1 ZINC000788507880 1130192142 /nfs/dbraw/zinc/19/21/42/1130192142.db2.gz SOIRVUIULLFCJQ-INIZCTEOSA-N 1 0 298.430 3.796 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@@](C)(O)CCC(C)C)c(O)c1 ZINC000788600880 1130197186 /nfs/dbraw/zinc/19/71/86/1130197186.db2.gz DVIRXJJRAITCPU-QAPCUYQASA-N 1 0 293.451 3.847 20 10 CHCDRO CSC1(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)CCC1 ZINC000788604471 1130197408 /nfs/dbraw/zinc/19/74/08/1130197408.db2.gz AUQDBBVFBAGDDV-JQWIXIFHSA-N 1 0 295.423 3.955 20 10 CHCDRO CCC(CC)[C@@H](CC[NH2+]Cc1ccc2c(c1)CCO2)OC ZINC000746761521 1130206642 /nfs/dbraw/zinc/20/66/42/1130206642.db2.gz PLDQORKDBRMFHH-QGZVFWFLSA-N 1 0 291.435 3.552 20 10 CHCDRO CCOC[C@@H]([NH2+][C@H](C)c1ccc(C)c(C)c1O)C(C)C ZINC000788983673 1130222578 /nfs/dbraw/zinc/22/25/78/1130222578.db2.gz FIRFOXABCMIHIH-GDBMZVCRSA-N 1 0 279.424 3.721 20 10 CHCDRO COc1c2ccccc2oc1C[NH2+][C@@H](C)c1ccccc1O ZINC000788982684 1130225005 /nfs/dbraw/zinc/22/50/05/1130225005.db2.gz YICGGDUODDXKDP-LBPRGKRZSA-N 1 0 297.354 3.998 20 10 CHCDRO CC(C)C[C@H]1CCC[N@@H+]1Cc1cc2c(cc1O)CCC2 ZINC000748790691 1130246651 /nfs/dbraw/zinc/24/66/51/1130246651.db2.gz CMNIICFSXFMFCH-QGZVFWFLSA-N 1 0 273.420 3.891 20 10 CHCDRO Cc1cc[nH+]c(NCc2cc(F)ccc2O)c1C1CC1 ZINC000827010960 1130338179 /nfs/dbraw/zinc/33/81/79/1130338179.db2.gz CQDIQVVCCLUCRM-UHFFFAOYSA-N 1 0 272.323 3.724 20 10 CHCDRO CS[C@H]1CC[C@@H]([NH2+]Cc2c([O-])ccc(Cl)c2F)C1 ZINC000790974222 1130343824 /nfs/dbraw/zinc/34/38/24/1130343824.db2.gz QHRCXLFTWJUUEE-BDAKNGLRSA-N 1 0 289.803 3.558 20 10 CHCDRO Cn1ccc2ccc(-c3cnccc3/C=C/[NH+](C)C)cc21 ZINC001240577648 1130370395 /nfs/dbraw/zinc/37/03/95/1130370395.db2.gz ZNMMCIVEZRTUOG-JXMROGBWSA-N 1 0 277.371 3.773 20 10 CHCDRO [O-]c1ccc(Cl)c(F)c1C[N@@H+]1CC[C@H](c2ccco2)C1 ZINC000792167570 1130434472 /nfs/dbraw/zinc/43/44/72/1130434472.db2.gz KQVLKWKWUMPJQZ-JTQLQIEISA-N 1 0 295.741 3.767 20 10 CHCDRO COC1(C[N@H+](C)Cc2ccc(N(C)C)cc2)CCCCC1 ZINC000792161772 1130434751 /nfs/dbraw/zinc/43/47/51/1130434751.db2.gz JFQOUPOBTHIIIG-UHFFFAOYSA-N 1 0 290.451 3.534 20 10 CHCDRO Oc1ccccc1C[N@H+](CC1(F)CC1)C1CCCC1 ZINC000792821013 1130501208 /nfs/dbraw/zinc/50/12/08/1130501208.db2.gz RVTUNVVIYPAPBR-UHFFFAOYSA-N 1 0 263.356 3.639 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C2CC=CC2)c(C(F)(F)F)c1 ZINC000793010488 1130512853 /nfs/dbraw/zinc/51/28/53/1130512853.db2.gz BTUAXTKRZPSURW-UHFFFAOYSA-N 1 0 284.325 3.580 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C2(C)CCC2)c(C(F)(F)F)c1 ZINC000793056848 1130517233 /nfs/dbraw/zinc/51/72/33/1130517233.db2.gz BECVPONVJUZOFD-UHFFFAOYSA-N 1 0 286.341 3.804 20 10 CHCDRO CCCN(CCCc1ccc(C)nc1)c1ccc(C[NH3+])cc1 ZINC000793190780 1130529515 /nfs/dbraw/zinc/52/95/15/1130529515.db2.gz HNRRNMJEYURPNU-UHFFFAOYSA-N 1 0 297.446 3.698 20 10 CHCDRO C[C@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1cc(Cl)ccc1O ZINC000793230930 1130533286 /nfs/dbraw/zinc/53/32/86/1130533286.db2.gz IVFFFVKFNKBJFA-KWQFWETISA-N 1 0 293.716 3.818 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]Cc1ccc2ncccc2c1 ZINC000793263958 1130535748 /nfs/dbraw/zinc/53/57/48/1130535748.db2.gz MZMXFPWOCGTHMP-UHFFFAOYSA-N 1 0 298.773 3.884 20 10 CHCDRO CCC[C@H]([NH2+]Cc1cc(C)ccc1O)[C@H](O)c1ccccc1 ZINC000793245520 1130536871 /nfs/dbraw/zinc/53/68/71/1130536871.db2.gz YBZPLFWXNFNTPD-PKOBYXMFSA-N 1 0 299.414 3.693 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]CCCc1ccccc1F ZINC000793346850 1130542526 /nfs/dbraw/zinc/54/25/26/1130542526.db2.gz LSIDFYJHULGFNW-UHFFFAOYSA-N 1 0 293.769 3.907 20 10 CHCDRO C[N@H+](Cc1cc(F)ccc1O)[C@H]1CCC(C)(C)C1 ZINC000793353340 1130543254 /nfs/dbraw/zinc/54/32/54/1130543254.db2.gz SAAIMCSGRBKDPU-ZDUSSCGKSA-N 1 0 251.345 3.542 20 10 CHCDRO CCOc1ccc(C[N@H+](CC2CC2)CC2CCC2)c(O)c1 ZINC000793391386 1130552096 /nfs/dbraw/zinc/55/20/96/1130552096.db2.gz XEHNDBVJHOZOEE-UHFFFAOYSA-N 1 0 289.419 3.803 20 10 CHCDRO COc1ccc(C[NH2+]C/C(C)=C\c2ccccc2)c(O)c1 ZINC000793387332 1130552288 /nfs/dbraw/zinc/55/22/88/1130552288.db2.gz DFOLRMXQKNJGMK-UVTDQMKNSA-N 1 0 283.371 3.594 20 10 CHCDRO COC(C)(C)C[N@H+](C)Cc1cc(C)cc(C(C)(C)C)c1O ZINC000758404489 1130610362 /nfs/dbraw/zinc/61/03/62/1130610362.db2.gz HEESZNRZDROTGY-UHFFFAOYSA-N 1 0 293.451 3.855 20 10 CHCDRO COc1ccc(C[NH2+]C2CCC3(CCCC3)CC2)c(O)c1 ZINC000811499158 1130612694 /nfs/dbraw/zinc/61/26/94/1130612694.db2.gz JXHMNYQKZVQVQC-UHFFFAOYSA-N 1 0 289.419 3.993 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H](c2cccnc2)C2CC2)cc1F ZINC000758633863 1130619922 /nfs/dbraw/zinc/61/99/22/1130619922.db2.gz ZBOASKCKNKILOJ-GOSISDBHSA-N 1 0 299.393 3.528 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CC(C)(C)[C@H]2C2CC2)cc1C ZINC000811513972 1130620461 /nfs/dbraw/zinc/62/04/61/1130620461.db2.gz YDDPJEMOKDHKLJ-MRXNPFEDSA-N 1 0 259.393 3.629 20 10 CHCDRO COc1ccc2ccc(O)c(C[N@@H+]3C[C@H](C)CC34CC4)c2c1 ZINC001234569095 1130657166 /nfs/dbraw/zinc/65/71/66/1130657166.db2.gz JKSDPEJJTFIHHF-CYBMUJFWSA-N 1 0 297.398 3.928 20 10 CHCDRO COc1ccc2ccc(O)c(C[N@@H+]3CCC[C@H]4C[C@H]43)c2c1 ZINC001234569103 1130657382 /nfs/dbraw/zinc/65/73/82/1130657382.db2.gz 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CC(C)N(CC[NH3+])Cc1cc(Cl)c(C(C)(C)C)cc1O ZINC001235947139 1130811963 /nfs/dbraw/zinc/81/19/63/1130811963.db2.gz IKCOSXSSSMSJEH-UHFFFAOYSA-N 1 0 298.858 3.512 20 10 CHCDRO Nc1ccc(C[N@@H+]2CC[C@H](c3ccc(Cl)cc3)C2)cc1 ZINC001235948947 1130815249 /nfs/dbraw/zinc/81/52/49/1130815249.db2.gz XWRLXDGPLBQLNZ-HNNXBMFYSA-N 1 0 286.806 3.912 20 10 CHCDRO Nc1ccc(C[N@@H+]2CC[C@@H](c3cccc(Cl)c3)C2)cc1 ZINC001235949830 1130815374 /nfs/dbraw/zinc/81/53/74/1130815374.db2.gz JAUROBKJHYTTPD-OAHLLOKOSA-N 1 0 286.806 3.912 20 10 CHCDRO Cc1cccc(OC2CC[NH+](Cc3ccc(N)cc3)CC2)c1 ZINC001235959922 1130817352 /nfs/dbraw/zinc/81/73/52/1130817352.db2.gz NOZXKDXCMGFSFE-UHFFFAOYSA-N 1 0 296.414 3.621 20 10 CHCDRO Nc1ccc(C[N@H+]2CC=C(c3ccccc3)CC2)cc1 ZINC001235962723 1130819316 /nfs/dbraw/zinc/81/93/16/1130819316.db2.gz OOIPGQSMJBGEJY-UHFFFAOYSA-N 1 0 264.372 3.558 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CC3(CCC3)[C@H]2C(C)C)c1 ZINC000814171445 1130832852 /nfs/dbraw/zinc/83/28/52/1130832852.db2.gz PAIQRFPIVPMFJK-QGZVFWFLSA-N 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Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H](C)N2CCCCC2)c(O)c1 ZINC000815562407 1130999211 /nfs/dbraw/zinc/99/92/11/1130999211.db2.gz DUILUTAKPBJWPD-HZPDHXFCSA-N 1 0 290.451 3.534 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H]2Cc3ccccc3O2)c(O)c1 ZINC000815556047 1130999381 /nfs/dbraw/zinc/99/93/81/1130999381.db2.gz NBAAKHPOEFICDT-ZBFHGGJFSA-N 1 0 297.398 3.663 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CCN2CCCC[C@@H]2C)c(O)c1 ZINC000815559870 1130999543 /nfs/dbraw/zinc/99/95/43/1130999543.db2.gz RTKZCJLSRDRGJJ-JKSUJKDBSA-N 1 0 290.451 3.534 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@]2(C)CCCC[C@@H]2O)c(O)c1 ZINC000815585902 1131003539 /nfs/dbraw/zinc/00/35/39/1131003539.db2.gz VEWCKJQDXQSDRF-QILLFSRXSA-N 1 0 291.435 3.601 20 10 CHCDRO CCc1ccc(C[N@@H+]2CCc3ccccc3C2)c(O)c1 ZINC001236783981 1131006980 /nfs/dbraw/zinc/00/69/80/1131006980.db2.gz QPLPLPIBKZXZMC-UHFFFAOYSA-N 1 0 267.372 3.513 20 10 CHCDRO C[C@@H]1CC[N@@H+]1Cc1cc(OCc2ccccc2)ccc1O ZINC001236779096 1131007027 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c1ccc([C@H]2C[C@H]([NH2+]Cc3ccc4c(c3)CCO4)C2)cc1 ZINC000797876669 1131011204 /nfs/dbraw/zinc/01/12/04/1131011204.db2.gz OCQGEDBYFKSYGO-IYARVYRRSA-N 1 0 279.383 3.657 20 10 CHCDRO COc1cc(C)c(C[N@H+](C)Cc2ccccc2C)c(O)c1 ZINC001236812424 1131011370 /nfs/dbraw/zinc/01/13/70/1131011370.db2.gz FFMAMDSWQJPIQE-UHFFFAOYSA-N 1 0 285.387 3.650 20 10 CHCDRO COc1cc(O)c(C[NH+]2C3CCCC2CCC3)c(Cl)c1 ZINC001236807548 1131012978 /nfs/dbraw/zinc/01/29/78/1131012978.db2.gz HPRITKFIVPLTMK-UHFFFAOYSA-N 1 0 295.810 3.961 20 10 CHCDRO COC1(CC[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)CCC1 ZINC000815642154 1131013850 /nfs/dbraw/zinc/01/38/50/1131013850.db2.gz UBIDJBWPIZTOGE-DGCLKSJQSA-N 1 0 293.382 3.628 20 10 CHCDRO CC[C@H]([NH2+]CCC1(OC)CCC1)c1ccc(N(C)C)cc1 ZINC000815641919 1131015504 /nfs/dbraw/zinc/01/55/04/1131015504.db2.gz LVEIEXQWXKOUFL-KRWDZBQOSA-N 1 0 290.451 3.753 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1cc[nH]c(=O)c1)c1ccc(N(C)C)cc1 ZINC000815642650 1131015782 /nfs/dbraw/zinc/01/57/82/1131015782.db2.gz IRCAFAWERXVAEY-GUYCJALGSA-N 1 0 299.418 3.655 20 10 CHCDRO C[C@@H]([NH2+]Cc1c(F)cc(F)cc1F)c1ccccc1O ZINC000815649933 1131016217 /nfs/dbraw/zinc/01/62/17/1131016217.db2.gz CNXAPEKKSHKTBU-SECBINFHSA-N 1 0 281.277 3.660 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](CO)C1CCCCC1)c1ccccc1O ZINC000815648120 1131016395 /nfs/dbraw/zinc/01/63/95/1131016395.db2.gz FDCQXESLDYQXHA-WBVHZDCISA-N 1 0 291.435 3.622 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@H](CO)C2CCCCC2)c1 ZINC000815648452 1131016710 /nfs/dbraw/zinc/01/67/10/1131016710.db2.gz MZUAOOPZEREYML-GDBMZVCRSA-N 1 0 291.435 3.540 20 10 CHCDRO CC(C)O[C@H]1CC[N@H+](Cc2cc3ccccc3cc2O)C1 ZINC001236835280 1131018977 /nfs/dbraw/zinc/01/89/77/1131018977.db2.gz GGHOKLJCPCIQFR-KRWDZBQOSA-N 1 0 285.387 3.545 20 10 CHCDRO CO[C@@H]1CCC[N@H+](Cc2cc3ccccc3cc2O)CC1 ZINC001236833064 1131019177 /nfs/dbraw/zinc/01/91/77/1131019177.db2.gz NRJBQADUZGNBJF-QGZVFWFLSA-N 1 0 285.387 3.546 20 10 CHCDRO C[N@H+](Cc1cc2ccccc2cc1O)C1CCCC1 ZINC001236842521 1131020656 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Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CC=C(C)CC1 ZINC000816549083 1131106909 /nfs/dbraw/zinc/10/69/09/1131106909.db2.gz CNQBMDMEGOYHJI-MRXNPFEDSA-N 1 0 258.409 3.649 20 10 CHCDRO Oc1c(C[NH2+]C[C@H]2CC=CCC2)ccc2ccccc21 ZINC000816544005 1131107044 /nfs/dbraw/zinc/10/70/44/1131107044.db2.gz VJZLXCHROAGPLO-AWEZNQCLSA-N 1 0 267.372 3.991 20 10 CHCDRO Oc1c(C[NH2+]Cc2ccccc2)ccc2ccccc21 ZINC000816529358 1131108275 /nfs/dbraw/zinc/10/82/75/1131108275.db2.gz QAPVQBOBVCMLKH-UHFFFAOYSA-N 1 0 263.340 3.835 20 10 CHCDRO Oc1c(C[NH2+][C@H]2CC=CCC2)ccc2ccccc21 ZINC000816552645 1131109384 /nfs/dbraw/zinc/10/93/84/1131109384.db2.gz RVKXUNLNSAPZQM-HNNXBMFYSA-N 1 0 253.345 3.744 20 10 CHCDRO C[C@H](C[NH2+]Cc1ccc2ccccc2c1O)c1ccncc1 ZINC000816554591 1131109553 /nfs/dbraw/zinc/10/95/53/1131109553.db2.gz CPRPQIFDTBTQTP-CQSZACIVSA-N 1 0 292.382 3.834 20 10 CHCDRO C[C@]1(C[NH2+]Cc2ccc3ccccc3c2O)CCCS1 ZINC000816556494 1131109910 /nfs/dbraw/zinc/10/99/10/1131109910.db2.gz KUZHNQSBYIPBOH-QGZVFWFLSA-N 1 0 287.428 3.921 20 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20 10 CHCDRO Cc1cc(Cl)cc(C[NH+]2CC(c3ccccc3)C2)c1O ZINC001237687141 1131126572 /nfs/dbraw/zinc/12/65/72/1131126572.db2.gz RHMMNSIFSIHFOX-UHFFFAOYSA-N 1 0 287.790 3.953 20 10 CHCDRO Cc1cc(Cl)cc(C[NH+]2CCC(C)(C)CC2)c1O ZINC001237686177 1131126614 /nfs/dbraw/zinc/12/66/14/1131126614.db2.gz FYSBMNLKUXSXCJ-UHFFFAOYSA-N 1 0 267.800 3.976 20 10 CHCDRO CCCC[N@H+](C)Cc1cc(Br)c(C)cc1O ZINC001237676531 1131126637 /nfs/dbraw/zinc/12/66/37/1131126637.db2.gz KIUWUXWSCOIOFX-UHFFFAOYSA-N 1 0 286.213 3.695 20 10 CHCDRO CCC(CC)[N@H+](C)Cc1cc(Cl)cc(C)c1O ZINC001237687151 1131127155 /nfs/dbraw/zinc/12/71/55/1131127155.db2.gz ROBBQMCJNMEBCN-UHFFFAOYSA-N 1 0 255.789 3.974 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+]2CCC[C@H](C)[C@H]2C)c1O ZINC001237687800 1131127933 /nfs/dbraw/zinc/12/79/33/1131127933.db2.gz VHTMLUWJEUIEBP-CMPLNLGQSA-N 1 0 267.800 3.974 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+](C(C)C)C2CCOCC2)c1O ZINC001237691155 1131128084 /nfs/dbraw/zinc/12/80/84/1131128084.db2.gz YCKZMYRYLSDHNY-UHFFFAOYSA-N 1 0 297.826 3.743 20 10 CHCDRO C[C@]1(F)CCC[N@H+](Cc2cc(F)cc(Cl)c2[O-])CC1 ZINC001237808618 1131143251 /nfs/dbraw/zinc/14/32/51/1131143251.db2.gz UYYMUMJHUCTDDX-AWEZNQCLSA-N 1 0 289.753 3.899 20 10 CHCDRO Cc1cc(F)cc(C[N@@H+]2CCCc3ccccc3C2)c1O ZINC001238063351 1131166274 /nfs/dbraw/zinc/16/62/74/1131166274.db2.gz VXZLHMKWPGCEFE-UHFFFAOYSA-N 1 0 285.362 3.788 20 10 CHCDRO CCC[C@H]1CCCC[N@@H+]1Cc1cc(F)cc(C)c1O ZINC001238063548 1131166391 /nfs/dbraw/zinc/16/63/91/1131166391.db2.gz YKZYKOUJZOEFAS-HNNXBMFYSA-N 1 0 265.372 3.994 20 10 CHCDRO Cc1cc(F)cc(C[N@@H+]2CC[C@H](Cc3ccccc3)C2)c1O ZINC001238061878 1131166769 /nfs/dbraw/zinc/16/67/69/1131166769.db2.gz KSDAKFHEIALTAQ-MRXNPFEDSA-N 1 0 299.389 3.904 20 10 CHCDRO Cc1cc(F)cc(C[N@@H+]2CCCC3(CCCC3)C2)c1O ZINC001238063955 1131167012 /nfs/dbraw/zinc/16/70/12/1131167012.db2.gz NCIKCJQIXMKUDU-UHFFFAOYSA-N 1 0 277.383 3.996 20 10 CHCDRO Cc1cc(F)cc(C[NH+]2CCC3(CC[C@H](F)C3)CC2)c1O ZINC001238069693 1131168754 /nfs/dbraw/zinc/16/87/54/1131168754.db2.gz KAXIYYNWXGOALC-AWEZNQCLSA-N 1 0 295.373 3.944 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccc(N)cc1)c1cc(F)ccc1F ZINC000817955746 1131190348 /nfs/dbraw/zinc/19/03/48/1131190348.db2.gz GUQYOSLVJSXFCS-KRWDZBQOSA-N 1 0 290.357 3.830 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccc(N)cc1)c1ccc(F)c(Cl)c1 ZINC000817955893 1131190521 /nfs/dbraw/zinc/19/05/21/1131190521.db2.gz KIHIUDDIEPUVSU-LLVKDONJSA-N 1 0 292.785 3.955 20 10 CHCDRO C[C@@H]1C[C@@H]([NH2+]CCc2ccc(N)cc2)c2ccccc21 ZINC000817956700 1131190577 /nfs/dbraw/zinc/19/05/77/1131190577.db2.gz AVNKKXTUIYOJDG-FZKQIMNGSA-N 1 0 266.388 3.649 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccc(N)cc1)[C@@H]1C[C@H]1c1ccccc1 ZINC000817958192 1131191037 /nfs/dbraw/zinc/19/10/37/1131191037.db2.gz SWGXRLVLQABUSL-CCKFTAQKSA-N 1 0 280.415 3.593 20 10 CHCDRO Nc1ccc(CC[NH2+][C@H]2CCCc3sccc32)cc1 ZINC000817956318 1131191174 /nfs/dbraw/zinc/19/11/74/1131191174.db2.gz WIUNFXGBKVMECU-HNNXBMFYSA-N 1 0 272.417 3.540 20 10 CHCDRO C[C@H]([NH2+]CCc1ccc(N)cc1)C1CCCCCC1 ZINC000817958860 1131191300 /nfs/dbraw/zinc/19/13/00/1131191300.db2.gz ZYYSRWQUKPUAAD-AWEZNQCLSA-N 1 0 260.425 3.760 20 10 CHCDRO CC[C@@H]([NH2+]CC([NH3+])(CC)CC)c1cccc(Cl)c1[O-] ZINC000817959695 1131191580 /nfs/dbraw/zinc/19/15/80/1131191580.db2.gz GRTYGHPMEMJUPL-CYBMUJFWSA-N 1 0 284.831 3.604 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+]C/C=C/C2CC2)c1O ZINC001117712580 1131193595 /nfs/dbraw/zinc/19/35/95/1131193595.db2.gz IONZZEULGNRRNF-UFFNRZRYSA-N 1 0 265.784 3.971 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+]C/C=C\C2CC2)c1O ZINC001117712576 1131193796 /nfs/dbraw/zinc/19/37/96/1131193796.db2.gz IONZZEULGNRRNF-BYCRGOAPSA-N 1 0 265.784 3.971 20 10 CHCDRO Nc1ccc2c(c1)CCC[C@H]2[NH2+][C@H]1CCc2cccc(O)c21 ZINC000817967378 1131193931 /nfs/dbraw/zinc/19/39/31/1131193931.db2.gz GVHNMQCJERUMPH-SJORKVTESA-N 1 0 294.398 3.629 20 10 CHCDRO CC[C@H]([NH2+]CCC[C@@H]1CCC[NH2+]1)c1cccc(Cl)c1[O-] ZINC000817979773 1131195007 /nfs/dbraw/zinc/19/50/07/1131195007.db2.gz FCBOZYKVWGTIJU-WFASDCNBSA-N 1 0 296.842 3.619 20 10 CHCDRO CC[C@H]([NH2+]CCC[C@H]1CCC[NH2+]1)c1cccc(Cl)c1[O-] ZINC000817979769 1131195492 /nfs/dbraw/zinc/19/54/92/1131195492.db2.gz FCBOZYKVWGTIJU-DOMZBBRYSA-N 1 0 296.842 3.619 20 10 CHCDRO COc1ccc(N2CC[C@@H](C[NH2+][C@@H](C)C(C)(C)C)C2)cc1 ZINC000818341812 1131209380 /nfs/dbraw/zinc/20/93/80/1131209380.db2.gz GZIXXRLLLRFLQM-GJZGRUSLSA-N 1 0 290.451 3.546 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1C[C@H]2C[C@H]2C1)c1ccc(Br)cc1O ZINC000818361271 1131211196 /nfs/dbraw/zinc/21/11/96/1131211196.db2.gz VZHGZSRIPCLMGA-MWGHHZFTSA-N 1 0 296.208 3.604 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CC12CC2)c1ccc(N2CCCCC2)cc1 ZINC000818356692 1131211448 /nfs/dbraw/zinc/21/14/48/1131211448.db2.gz PWVPCOZRZYZBRK-PBHICJAKSA-N 1 0 270.420 3.880 20 10 CHCDRO COCC1(CC[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3C)CC1 ZINC001118238511 1131216201 /nfs/dbraw/zinc/21/62/01/1131216201.db2.gz JPSQWNMPYJOZLL-KBPBESRZSA-N 1 0 289.419 3.655 20 10 CHCDRO COC[C@@H]1CCC[N@@H+]1Cc1cc(C)n(-c2ccccc2)c1C ZINC001137853920 1131424333 /nfs/dbraw/zinc/42/43/33/1131424333.db2.gz ATOYNIPEQCDEFI-IBGZPJMESA-N 1 0 298.430 3.705 20 10 CHCDRO Cc1cc(C[NH+]2CCSCC2)c(C)n1-c1ccccc1 ZINC001137856118 1131424448 /nfs/dbraw/zinc/42/44/48/1131424448.db2.gz QXDDONOEJJETFB-UHFFFAOYSA-N 1 0 286.444 3.643 20 10 CHCDRO Cc1cc(C[N@@H+]2C[C@H]3[C@H](CF)[C@H]3C2)c(C)n1-c1ccccc1 ZINC001137858950 1131424797 /nfs/dbraw/zinc/42/47/97/1131424797.db2.gz BJRYJMLAIPNYIG-LDLYASANSA-N 1 0 298.405 3.741 20 10 CHCDRO CC[C@H]([NH2+]CCCSc1nccs1)C1CCC1 ZINC000823937836 1131448917 /nfs/dbraw/zinc/44/89/17/1131448917.db2.gz LBDNAZMFVYGKKC-LBPRGKRZSA-N 1 0 270.467 3.794 20 10 CHCDRO Oc1c(C[NH2+]CCCC2CCOCC2)ccc2ccccc21 ZINC000824477148 1131470385 /nfs/dbraw/zinc/47/03/85/1131470385.db2.gz GTZVNOKCJCUMNG-UHFFFAOYSA-N 1 0 299.414 3.842 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+][C@H]1CCCc2c(F)cccc21 ZINC000824469042 1131471404 /nfs/dbraw/zinc/47/14/04/1131471404.db2.gz VMFAOOFAEBMFKQ-INIZCTEOSA-N 1 0 289.325 3.838 20 10 CHCDRO Cc1cc([C@@H](C)[NH2+]Cc2ccccc2O)ccc1F ZINC000824548153 1131476431 /nfs/dbraw/zinc/47/64/31/1131476431.db2.gz AQMRJZFXWCKNTB-GFCCVEGCSA-N 1 0 259.324 3.691 20 10 CHCDRO C[C@]1(CF)CC[N@H+](Cc2ccc(N3CCCCC3)cc2)C1 ZINC001138215579 1131477911 /nfs/dbraw/zinc/47/79/11/1131477911.db2.gz JZQDGRPCLFYFPU-GOSISDBHSA-N 1 0 290.426 3.858 20 10 CHCDRO C[C@H](CCCCO)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000824653454 1131478469 /nfs/dbraw/zinc/47/84/69/1131478469.db2.gz BJEIBVGHLWKWET-OAHLLOKOSA-N 1 0 299.414 3.700 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(OCc2ccccc2)cc1O)C1CC1 ZINC000824683446 1131480206 /nfs/dbraw/zinc/48/02/06/1131480206.db2.gz JUORPTDCPKGAMQ-CQSZACIVSA-N 1 0 297.398 3.859 20 10 CHCDRO CCCCC[N@H+](C)Cc1ccc2c(c1)CCCN2C ZINC001138354370 1131493706 /nfs/dbraw/zinc/49/37/06/1131493706.db2.gz HFGKTMMBDHXASK-UHFFFAOYSA-N 1 0 260.425 3.691 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H](C)c2cccnc2)cc1Cl ZINC000825072318 1131497962 /nfs/dbraw/zinc/49/79/62/1131497962.db2.gz YNVIQUJRXRQJEC-LLVKDONJSA-N 1 0 276.767 3.600 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CCC[C@@]2(CCSC2)C1 ZINC000825215278 1131502318 /nfs/dbraw/zinc/50/23/18/1131502318.db2.gz KSPJWEKQMVIGLW-OAHLLOKOSA-N 1 0 297.851 3.765 20 10 CHCDRO Cc1csc([C@H](C)[NH2+]Cc2cc(Cl)c(C)cc2O)n1 ZINC000825197325 1131503334 /nfs/dbraw/zinc/50/33/34/1131503334.db2.gz KNCADRUDBYQMKI-JTQLQIEISA-N 1 0 296.823 3.970 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cc(Cl)c(C)cc1O)C1CCOCC1 ZINC000825332067 1131507149 /nfs/dbraw/zinc/50/71/49/1131507149.db2.gz VZLZFIXJKIKNJZ-OAHLLOKOSA-N 1 0 297.826 3.649 20 10 CHCDRO Cc1cnc([C@H](C)[NH2+]Cc2cc(Cl)c(C)cc2O)s1 ZINC000825330859 1131507581 /nfs/dbraw/zinc/50/75/81/1131507581.db2.gz FGIVQEMESPLKNY-JTQLQIEISA-N 1 0 296.823 3.970 20 10 CHCDRO C[C@H]1CCCC[C@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000035275589 1131559308 /nfs/dbraw/zinc/55/93/08/1131559308.db2.gz AYDXSPPKCJYZIC-MAUKXSAKSA-N 1 0 272.436 3.955 20 10 CHCDRO CC[N@H+](Cc1ccc2cccnc2c1)Cc1ccccc1O ZINC001139171271 1131591465 /nfs/dbraw/zinc/59/14/65/1131591465.db2.gz PVTINBRXUBREKU-UHFFFAOYSA-N 1 0 292.382 3.963 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@@H+]2CCC[C@]3(CC3(F)F)C2)c1 ZINC000844747667 1131595869 /nfs/dbraw/zinc/59/58/69/1131595869.db2.gz XPMKQXHPUVVEEK-HNNXBMFYSA-N 1 0 281.346 3.630 20 10 CHCDRO C[N@H+](Cc1ccc2cc(O)ccc2c1)Cc1ccccc1O ZINC001139342793 1131603123 /nfs/dbraw/zinc/60/31/23/1131603123.db2.gz UPVSLFPMMUIXHY-UHFFFAOYSA-N 1 0 293.366 3.883 20 10 CHCDRO C[C@H]([NH2+]CC[C@@H]1CCc2ccccc2N1)c1ccccc1O ZINC000844924560 1131608195 /nfs/dbraw/zinc/60/81/95/1131608195.db2.gz LXAIIQXBMWQGMY-HOCLYGCPSA-N 1 0 296.414 3.860 20 10 CHCDRO CCc1cccc(C[N@@H+](CC)Cc2ccccc2O)c1 ZINC001144326880 1131619619 /nfs/dbraw/zinc/61/96/19/1131619619.db2.gz YKQMYLRLZGLOAS-UHFFFAOYSA-N 1 0 269.388 3.977 20 10 CHCDRO CC[C@H]1CCCC[N@@H+]1Cc1ccc(N(C)C)c(C)c1 ZINC001139673581 1131627907 /nfs/dbraw/zinc/62/79/07/1131627907.db2.gz UPIIIKYJPNJYIP-INIZCTEOSA-N 1 0 260.425 3.826 20 10 CHCDRO Cc1cc(C[N@H+](Cc2ccco2)C2CC2)ccc1N(C)C ZINC001139674137 1131627980 /nfs/dbraw/zinc/62/79/80/1131627980.db2.gz QJQUZPDBOHHKOM-UHFFFAOYSA-N 1 0 284.403 3.819 20 10 CHCDRO C[N@H+](Cc1cc2ccccc2cn1)Cc1ccccc1O ZINC001140000408 1131655780 /nfs/dbraw/zinc/65/57/80/1131655780.db2.gz GGNRXJAPYWZCBE-UHFFFAOYSA-N 1 0 278.355 3.572 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CC[C@H](c3ccccc3)C2)c1O ZINC001140178540 1131673262 /nfs/dbraw/zinc/67/32/62/1131673262.db2.gz NVGQWAILFHXNHQ-KRWDZBQOSA-N 1 0 281.399 3.999 20 10 CHCDRO Cc1ccc(C)c(C[N@H+](C)Cc2ccccc2F)c1O ZINC001140179747 1131673297 /nfs/dbraw/zinc/67/32/97/1131673297.db2.gz OCQYBUKRTMJQIV-UHFFFAOYSA-N 1 0 273.351 3.780 20 10 CHCDRO COc1cccc(C[NH2+]Cc2ccc(C)cc2Cl)c1O ZINC000845969495 1131673386 /nfs/dbraw/zinc/67/33/86/1131673386.db2.gz FFWVEHHSRFVPAW-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO Cc1cccc(C[N@@H+](C)Cc2c(C)ccc(C)c2O)c1 ZINC001140178600 1131673416 /nfs/dbraw/zinc/67/34/16/1131673416.db2.gz QGOOGRVWTTWBQP-UHFFFAOYSA-N 1 0 269.388 3.949 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCC23CCCCC3)c1O ZINC001140178539 1131673459 /nfs/dbraw/zinc/67/34/59/1131673459.db2.gz NTIFXQCNZFBPEQ-UHFFFAOYSA-N 1 0 259.393 3.918 20 10 CHCDRO Cc1ccc(C)c(C[N@H+]2Cc3ccccc3C[C@H]2C)c1O ZINC001140184389 1131674522 /nfs/dbraw/zinc/67/45/22/1131674522.db2.gz RMPWJPBKXKFKDI-OAHLLOKOSA-N 1 0 281.399 3.956 20 10 CHCDRO CCCN(Cc1cc2cnccc2o1)c1ccc(C[NH3+])cc1 ZINC000845964991 1131677185 /nfs/dbraw/zinc/67/71/85/1131677185.db2.gz OSMFDNQANIIGTF-UHFFFAOYSA-N 1 0 295.386 3.703 20 10 CHCDRO C[C@H](Cc1ccccc1F)[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000834526338 1131682047 /nfs/dbraw/zinc/68/20/47/1131682047.db2.gz GYKOGXZEJWQVAM-MLGOLLRUSA-N 1 0 285.362 3.739 20 10 CHCDRO CCN(C)c1ccccc1C[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000834575507 1131684103 /nfs/dbraw/zinc/68/41/03/1131684103.db2.gz LUITYOSYFLKXBE-MRXNPFEDSA-N 1 0 296.414 3.625 20 10 CHCDRO CC(C)n1cc([C@@H](C)[NH2+][C@@H]2CCc3cccc(O)c32)cn1 ZINC000834581914 1131684821 /nfs/dbraw/zinc/68/48/21/1131684821.db2.gz QYKSPHGAFFMKNU-IUODEOHRSA-N 1 0 285.391 3.508 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)cc1C)c1ccncc1 ZINC000834590141 1131685666 /nfs/dbraw/zinc/68/56/66/1131685666.db2.gz RGVHMJGRGQCWBU-SFHVURJKSA-N 1 0 283.419 3.697 20 10 CHCDRO Cc1ccc(CC[C@@H](C)[NH2+][C@H]2CCc3cccc(O)c32)o1 ZINC000834602547 1131686581 /nfs/dbraw/zinc/68/65/81/1131686581.db2.gz RYACVLIHSJGXFS-WBMJQRKESA-N 1 0 285.387 3.892 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@@H]1CSc3ccccc31)CC2 ZINC000834594653 1131686698 /nfs/dbraw/zinc/68/66/98/1131686698.db2.gz SACNCIQUGBFEEP-UONOGXRCSA-N 1 0 283.396 3.816 20 10 CHCDRO Cc1ccc(CC[C@H](C)[NH2+][C@H]2CCc3cccc(O)c32)o1 ZINC000834602544 1131686814 /nfs/dbraw/zinc/68/68/14/1131686814.db2.gz RYACVLIHSJGXFS-LRDDRELGSA-N 1 0 285.387 3.892 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CCCSCC(C)C)c1O ZINC000846157936 1131692135 /nfs/dbraw/zinc/69/21/35/1131692135.db2.gz PNKUAMQFGRGZMC-ZDUSSCGKSA-N 1 0 297.464 3.831 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CCCSCC(C)C)c1O ZINC000846157934 1131692326 /nfs/dbraw/zinc/69/23/26/1131692326.db2.gz PNKUAMQFGRGZMC-CYBMUJFWSA-N 1 0 297.464 3.831 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@@H]2CCC(C)(C)C2)c1O ZINC000846157245 1131692370 /nfs/dbraw/zinc/69/23/70/1131692370.db2.gz BSJKAMPNRQKWCM-VXGBXAGGSA-N 1 0 263.381 3.630 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@H]1C[C@@H]1Cc1ccccc1)CC2 ZINC000834668719 1131692547 /nfs/dbraw/zinc/69/25/47/1131692547.db2.gz NPXIEZDEVQWONS-BBWFWOEESA-N 1 0 279.383 3.600 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CCC(C)(C)C2CC2)c1O ZINC000846168913 1131692831 /nfs/dbraw/zinc/69/28/31/1131692831.db2.gz DIDNJJXJLCDIIQ-GFCCVEGCSA-N 1 0 277.408 3.878 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@H](C)CCC2CC2)c1O ZINC000846163856 1131692978 /nfs/dbraw/zinc/69/29/78/1131692978.db2.gz MEJGNSURTLSMJA-VXGBXAGGSA-N 1 0 263.381 3.630 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H](C)CC(C)(C)C)c1O ZINC000846167804 1131693049 /nfs/dbraw/zinc/69/30/49/1131693049.db2.gz DWUCVZMSVUTYCT-RYUDHWBXSA-N 1 0 265.397 3.876 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]C2CCC3(CC3)CC2)c1O ZINC000846167094 1131693128 /nfs/dbraw/zinc/69/31/28/1131693128.db2.gz SWPWUPAELUJDNZ-LBPRGKRZSA-N 1 0 275.392 3.774 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]Cc2cc(C)cs2)c1O ZINC000846170359 1131693633 /nfs/dbraw/zinc/69/36/33/1131693633.db2.gz XOUXPEJBPAMNFF-NSHDSACASA-N 1 0 277.389 3.622 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]C[C@H](C)CC(F)(F)F)c1O ZINC000846172341 1131693680 /nfs/dbraw/zinc/69/36/80/1131693680.db2.gz LGFNNNKDFPIJRO-ZJUUUORDSA-N 1 0 291.313 3.640 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CC2CCCCC2)c1O ZINC000846136241 1131693698 /nfs/dbraw/zinc/69/36/98/1131693698.db2.gz HSGSWDUPVWNTLP-LBPRGKRZSA-N 1 0 263.381 3.632 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]Cc2ccccc2Cl)c1O ZINC000846136704 1131694054 /nfs/dbraw/zinc/69/40/54/1131694054.db2.gz JOYAILSYOZLGPL-LLVKDONJSA-N 1 0 291.778 3.905 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]Cc2ccc(C)c(F)c2)c1O ZINC000846136188 1131694060 /nfs/dbraw/zinc/69/40/60/1131694060.db2.gz JIQQXLJSQCXAQW-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H](C)Cc2cccs2)c1O ZINC000846139061 1131694139 /nfs/dbraw/zinc/69/41/39/1131694139.db2.gz PGPLIZCSAODSGW-RYUDHWBXSA-N 1 0 291.416 3.744 20 10 CHCDRO CC(C)CSCCC[NH2+][C@H]1CCc2cccc(O)c21 ZINC000834692940 1131694228 /nfs/dbraw/zinc/69/42/28/1131694228.db2.gz JMEFQVDNGZHOOX-AWEZNQCLSA-N 1 0 279.449 3.748 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCc2cccc(O)c21)c1c(C)noc1C ZINC000834692676 1131694442 /nfs/dbraw/zinc/69/44/42/1131694442.db2.gz GWZIKLGAGXMQLJ-UONOGXRCSA-N 1 0 286.375 3.725 20 10 CHCDRO COCC(C)(C)CCC[NH2+][C@@H](C)c1cccc(OC)c1O ZINC000846174537 1131694806 /nfs/dbraw/zinc/69/48/06/1131694806.db2.gz XQVLEVVACGUGMR-ZDUSSCGKSA-N 1 0 295.423 3.504 20 10 CHCDRO CCc1cccc(C[NH2+][C@@H](C)c2cc(F)ccc2O)c1 ZINC000846208725 1131695986 /nfs/dbraw/zinc/69/59/86/1131695986.db2.gz KASQHXDDMVQOCM-LBPRGKRZSA-N 1 0 273.351 3.945 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCCC[C@H]1OC)c1ccc(C)cc1O ZINC000846201038 1131700000 /nfs/dbraw/zinc/70/00/00/1131700000.db2.gz INVNABVUUOAAHR-ZMSDIMECSA-N 1 0 277.408 3.699 20 10 CHCDRO C[N@H+](CCc1ccc(F)cc1)Cc1c(O)cccc1Cl ZINC001140341393 1131703766 /nfs/dbraw/zinc/70/37/66/1131703766.db2.gz LVVOHDKAKBNAAM-UHFFFAOYSA-N 1 0 293.769 3.859 20 10 CHCDRO COC1(C[NH2+][C@H]2C[C@H](C)c3c2c(O)ccc3F)CCCC1 ZINC000834814517 1131707923 /nfs/dbraw/zinc/70/79/23/1131707923.db2.gz LIJDXVRGCWGNBQ-AAEUAGOBSA-N 1 0 293.382 3.628 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]C[C@@H]1CSc3ccccc31)CC2 ZINC000834819095 1131707930 /nfs/dbraw/zinc/70/79/30/1131707930.db2.gz SFDLLRXFJCKYJS-HIFRSBDPSA-N 1 0 297.423 3.859 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]C[C@H]1CSc3ccccc31)CC2 ZINC000834819094 1131707940 /nfs/dbraw/zinc/70/79/40/1131707940.db2.gz SFDLLRXFJCKYJS-DZGCQCFKSA-N 1 0 297.423 3.859 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)CC(C)(C)O)c1cc(Cl)ccc1O ZINC000834876784 1131716166 /nfs/dbraw/zinc/71/61/66/1131716166.db2.gz OTPWQXBOEGBKEL-MFKMUULPSA-N 1 0 285.815 3.636 20 10 CHCDRO CC[C@](C)(C[NH2+][C@H](C)c1cc(Cl)cc(C)c1O)OC ZINC000834882549 1131717035 /nfs/dbraw/zinc/71/70/35/1131717035.db2.gz ROUOEGHWQHFCSU-IAQYHMDHSA-N 1 0 285.815 3.820 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCOC2(CCC2)C1)c1cc(F)ccc1O ZINC000834881802 1131717199 /nfs/dbraw/zinc/71/71/99/1131717199.db2.gz BHIHEXYMKJSEEJ-STQMWFEESA-N 1 0 293.382 3.531 20 10 CHCDRO CO[C@](C)(C[NH2+][C@H](C)c1ccc(C)cc1O)c1ccccc1 ZINC000834885014 1131718329 /nfs/dbraw/zinc/71/83/29/1131718329.db2.gz RTOFEVAQZBBSCR-DNVCBOLYSA-N 1 0 299.414 3.913 20 10 CHCDRO Cc1ccc(F)c(CC[NH2+][C@@H](C)c2ccccc2O)c1 ZINC000834892402 1131719341 /nfs/dbraw/zinc/71/93/41/1131719341.db2.gz MHWWUVPDPHNJRE-ZDUSSCGKSA-N 1 0 273.351 3.733 20 10 CHCDRO CC[C@@H]([NH2+]CC1(CC)COC1)c1cc(Cl)ccc1O ZINC000834898463 1131721567 /nfs/dbraw/zinc/72/15/67/1131721567.db2.gz DKSLDMJLUYGHQY-CYBMUJFWSA-N 1 0 283.799 3.513 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1nccn1CC)c1ccc(C)cc1O ZINC000834897183 1131721920 /nfs/dbraw/zinc/72/19/20/1131721920.db2.gz YLMHBZVYPRBFCT-ZFWWWQNUSA-N 1 0 287.407 3.719 20 10 CHCDRO CCc1nc(C[NH2+][C@H](C)c2ccc3ccccc3c2O)co1 ZINC000834896971 1131722468 /nfs/dbraw/zinc/72/24/68/1131722468.db2.gz DSODDPWPUWTCNJ-GFCCVEGCSA-N 1 0 296.370 3.947 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C2CCC(OC(F)F)CC2)c1 ZINC000834903465 1131726580 /nfs/dbraw/zinc/72/65/80/1131726580.db2.gz KLOQLGFSTWBFRZ-PNESKVBLSA-N 1 0 299.361 3.902 20 10 CHCDRO CC[C@@H]([NH2+]CCC[C@H]1CCOC1)c1ccc(N(C)C)cc1 ZINC000834903542 1131726695 /nfs/dbraw/zinc/72/66/95/1131726695.db2.gz KTMIYWIWBGPGJY-MAUKXSAKSA-N 1 0 290.451 3.610 20 10 CHCDRO Cc1cc(C)c(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)cn1 ZINC000834902024 1131727114 /nfs/dbraw/zinc/72/71/14/1131727114.db2.gz CVASSCQIKLXYEU-LBPRGKRZSA-N 1 0 290.794 3.908 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCC[C@@H]2CCOC2)cc1 ZINC000834905967 1131728715 /nfs/dbraw/zinc/72/87/15/1131728715.db2.gz VOYNKDFUYZWDFV-HZPDHXFCSA-N 1 0 290.451 3.610 20 10 CHCDRO CC[C@@H]([NH2+]CCC[C@H]1CCOC1)c1ccc(C)cc1O ZINC000834906433 1131729349 /nfs/dbraw/zinc/72/93/49/1131729349.db2.gz WTLASZNENKMOIV-GOEBONIOSA-N 1 0 277.408 3.558 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1CCOC(C)(C)C1)c1ccc(C)cc1O ZINC000834909126 1131729833 /nfs/dbraw/zinc/72/98/33/1131729833.db2.gz JHSCJEXSVLFWJI-GDBMZVCRSA-N 1 0 291.435 3.947 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+]C[C@@H]2CC[C@@H](C)O2)c1O ZINC000834913938 1131732647 /nfs/dbraw/zinc/73/26/47/1131732647.db2.gz JNIAMEKCYDCKGT-MDZLAQPJSA-N 1 0 283.799 3.572 20 10 CHCDRO CC1(C)CC[NH+](Cc2ccc(Cl)cc2O)CC1 ZINC001140466437 1131752748 /nfs/dbraw/zinc/75/27/48/1131752748.db2.gz FSQQMJGXWDLWMQ-UHFFFAOYSA-N 1 0 253.773 3.668 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]Cc2cccs2)cc1 ZINC000835033147 1131760418 /nfs/dbraw/zinc/76/04/18/1131760418.db2.gz OXKDOQLOOWGCNJ-HYXAFXHYSA-N 1 0 272.417 3.617 20 10 CHCDRO C[C@@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)c1ccccn1 ZINC000835033105 1131761231 /nfs/dbraw/zinc/76/12/31/1131761231.db2.gz CKCMZHQIOZXXDL-LQYUOIDQSA-N 1 0 281.403 3.512 20 10 CHCDRO C[C@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)c1ccccn1 ZINC000835033107 1131761535 /nfs/dbraw/zinc/76/15/35/1131761535.db2.gz CKCMZHQIOZXXDL-XHPSBEMXSA-N 1 0 281.403 3.512 20 10 CHCDRO CC[C@@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)c1ccncc1 ZINC000835039073 1131762830 /nfs/dbraw/zinc/76/28/30/1131762830.db2.gz ASPSFSAUWPNOJJ-SFFCAUCYSA-N 1 0 295.430 3.902 20 10 CHCDRO C[C@@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)C1CCC1 ZINC000835042168 1131762971 /nfs/dbraw/zinc/76/29/71/1131762971.db2.gz RVSOKHDGFWDUST-GEXIGZQTSA-N 1 0 258.409 3.544 20 10 CHCDRO Cc1cc(C)c(C[NH2+]C/C=C\c2ccc(N(C)C)cc2)cn1 ZINC000835055122 1131766112 /nfs/dbraw/zinc/76/61/12/1131766112.db2.gz RLEMAJWYLHNQDE-WAYWQWQTSA-N 1 0 295.430 3.567 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+][C@H]2CCC2(C)C)cc1 ZINC000835052591 1131766231 /nfs/dbraw/zinc/76/62/31/1131766231.db2.gz GXOGBVHYDZSGBI-KJPDOMRESA-N 1 0 258.409 3.544 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(OC)c(C)c1)[C@H]1CC1(C)C ZINC001171285459 1131798975 /nfs/dbraw/zinc/79/89/75/1131798975.db2.gz AHICEYKJNGFTLC-HUUCEWRRSA-N 1 0 261.409 3.918 20 10 CHCDRO Cc1ccc(O)c(C[N@H+](C)C/C=C/c2ccccc2)c1 ZINC001140622979 1131830628 /nfs/dbraw/zinc/83/06/28/1131830628.db2.gz JUFOFNGOFIDXFV-RMKNXTFCSA-N 1 0 267.372 3.846 20 10 CHCDRO C[C@@H]([NH2+]C[C@H](C)Oc1ccccc1)c1ccc(N(C)C)cc1 ZINC000772985527 1131836380 /nfs/dbraw/zinc/83/63/80/1131836380.db2.gz RZQIAHNQLFKERJ-JKSUJKDBSA-N 1 0 298.430 3.871 20 10 CHCDRO C[C@H](C[NH2+][C@H](C)c1ccc(N(C)C)cc1)Oc1ccccc1 ZINC000772985525 1131836467 /nfs/dbraw/zinc/83/64/67/1131836467.db2.gz RZQIAHNQLFKERJ-HZPDHXFCSA-N 1 0 298.430 3.871 20 10 CHCDRO COc1ccc(C[N@H+](C)Cc2ccc(N(C)C)cc2)c(C)c1 ZINC001140677401 1131858073 /nfs/dbraw/zinc/85/80/73/1131858073.db2.gz MEGXDTOSYNHXJJ-UHFFFAOYSA-N 1 0 298.430 3.702 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2cc(C)cc(Cl)n2)c(O)c1 ZINC000282761548 1131889086 /nfs/dbraw/zinc/88/90/86/1131889086.db2.gz OHANJJLWGVASOH-GFCCVEGCSA-N 1 0 290.794 3.908 20 10 CHCDRO CCCCC1CC[NH+](Cc2ccc(O)c(C)c2O)CC1 ZINC001140743947 1131905234 /nfs/dbraw/zinc/90/52/34/1131905234.db2.gz FYCVIFZZWVNZEC-UHFFFAOYSA-N 1 0 277.408 3.808 20 10 CHCDRO CC[N@H+](Cc1ccc(O)c(C)c1O)C1CCCCC1 ZINC001140741789 1131905501 /nfs/dbraw/zinc/90/55/01/1131905501.db2.gz CDPCXLPBWIBYLQ-UHFFFAOYSA-N 1 0 263.381 3.561 20 10 CHCDRO Cc1c(O)ccc(C[N@H+](C)Cc2ccc(Cl)cc2)c1O ZINC001140746189 1131906061 /nfs/dbraw/zinc/90/60/61/1131906061.db2.gz VRGWTBBJFFSGRT-UHFFFAOYSA-N 1 0 291.778 3.692 20 10 CHCDRO Cc1ncc([C@H](C)[NH2+]Cc2ccc(N(C)C)c(C)c2)s1 ZINC000773000464 1131916057 /nfs/dbraw/zinc/91/60/57/1131916057.db2.gz PTQMEZHEUDGTLM-LBPRGKRZSA-N 1 0 289.448 3.677 20 10 CHCDRO CC[C@H]([NH2+]CC1(C)CCOCC1)c1ccc(N(C)C)cc1 ZINC000773044789 1131929649 /nfs/dbraw/zinc/92/96/49/1131929649.db2.gz RWBWCBBOPUESNW-KRWDZBQOSA-N 1 0 290.451 3.610 20 10 CHCDRO CC[C@H](C)CC[NH2+]Cc1c(O)cc(C)cc1Cl ZINC001203068659 1131932074 /nfs/dbraw/zinc/93/20/74/1131932074.db2.gz XBEWCDPBONCDMT-JTQLQIEISA-N 1 0 255.789 3.880 20 10 CHCDRO CCC[N@H+](CCSC(C)C)Cc1ccccc1O ZINC000801518460 1131934604 /nfs/dbraw/zinc/93/46/04/1131934604.db2.gz IYSWAZBJXPTNAA-UHFFFAOYSA-N 1 0 267.438 3.746 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CC[C@@H](C)C[C@H]2C)cc1 ZINC001171381785 1131942864 /nfs/dbraw/zinc/94/28/64/1131942864.db2.gz PQQQLFSXRHGGOB-HUUCEWRRSA-N 1 0 260.425 3.763 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1ccc[nH]1)c1ccc(N(C)C)cc1 ZINC000773113993 1131947463 /nfs/dbraw/zinc/94/74/63/1131947463.db2.gz CCQPHVWTTCDWCR-BBRMVZONSA-N 1 0 271.408 3.883 20 10 CHCDRO CC[C@@H]1CCC[N@@H+]1Cc1ccc(N(CC)CC)cc1O ZINC001140855440 1131949444 /nfs/dbraw/zinc/94/94/44/1131949444.db2.gz YZUPGOUQBZFLTJ-OAHLLOKOSA-N 1 0 276.424 3.613 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@H](C)c2ccc[nH]2)cc1 ZINC000773118333 1131951043 /nfs/dbraw/zinc/95/10/43/1131951043.db2.gz OBJVLKUDMMBYEO-UONOGXRCSA-N 1 0 271.408 3.883 20 10 CHCDRO Cc1ccc(C[N@@H+]2CC[C@H](Cc3ccccc3)C2)c(O)c1 ZINC001140949652 1131969460 /nfs/dbraw/zinc/96/94/60/1131969460.db2.gz HCFCPCLDCGSFGS-QGZVFWFLSA-N 1 0 281.399 3.765 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2ccc(C)cc2O)cc1 ZINC001140949732 1131969916 /nfs/dbraw/zinc/96/99/16/1131969916.db2.gz JZPVKYSIJNQXJJ-UHFFFAOYSA-N 1 0 255.361 3.641 20 10 CHCDRO Cc1ccc(C[N@H+](C)CCCc2ccccc2)c(O)c1 ZINC001140949735 1131970491 /nfs/dbraw/zinc/97/04/91/1131970491.db2.gz KFJCSRBIICSBTD-UHFFFAOYSA-N 1 0 269.388 3.765 20 10 CHCDRO Cc1ccc(C[N@@H+]2CCC[C@H]3CCCC[C@H]32)c(O)c1 ZINC001140951119 1131971326 /nfs/dbraw/zinc/97/13/26/1131971326.db2.gz ZOSNWXPCVLPRJK-GDBMZVCRSA-N 1 0 259.393 3.855 20 10 CHCDRO C[C@H]([NH3+])c1ccc(NCc2cc3ccccc3cc2O)cn1 ZINC001171406355 1131971574 /nfs/dbraw/zinc/97/15/74/1131971574.db2.gz JQIZIXFUCJAELX-LBPRGKRZSA-N 1 0 293.370 3.572 20 10 CHCDRO CC[C@H]([NH2+]CCc1cccc(F)c1)c1ccccc1O ZINC000036778657 1131974743 /nfs/dbraw/zinc/97/47/43/1131974743.db2.gz ZZEDWCJCECLQBE-INIZCTEOSA-N 1 0 273.351 3.815 20 10 CHCDRO CCCC[NH+](CCCC)Cc1c(O)cc(OC)cc1OC ZINC001141028268 1131986807 /nfs/dbraw/zinc/98/68/07/1131986807.db2.gz HVDYCXYCZMNODZ-UHFFFAOYSA-N 1 0 295.423 3.812 20 10 CHCDRO COc1cc(O)c(C[NH+](CC(C)C)CC(C)C)c(OC)c1 ZINC001141032379 1131988945 /nfs/dbraw/zinc/98/89/45/1131988945.db2.gz ZWFJPQUFOQXJJY-UHFFFAOYSA-N 1 0 295.423 3.523 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC[C@H]2CCCS2)c(O)c1 ZINC000715698581 1131990719 /nfs/dbraw/zinc/99/07/19/1131990719.db2.gz SIZAHPNTWVGVAP-QWHCGFSZSA-N 1 0 265.422 3.637 20 10 CHCDRO CCOc1ccc([C@H](C)[NH2+]Cc2ccccc2O)cc1 ZINC000037107899 1131996657 /nfs/dbraw/zinc/99/66/57/1131996657.db2.gz YPFVXEATIMMUKA-ZDUSSCGKSA-N 1 0 271.360 3.642 20 10 CHCDRO C[N@H+](CCC1CC1)Cc1cc2c3c(c1)CCCN3CCC2 ZINC001141077990 1132007532 /nfs/dbraw/zinc/00/75/32/1132007532.db2.gz HZJMZZOMHNDOCI-UHFFFAOYSA-N 1 0 284.447 3.617 20 10 CHCDRO CC[C@H](CSC)[N@H+](C)Cc1c(O)ccc2ccncc21 ZINC000773257491 1132012506 /nfs/dbraw/zinc/01/25/06/1132012506.db2.gz YERDLTGCFSGWAF-CYBMUJFWSA-N 1 0 290.432 3.514 20 10 CHCDRO C[C@H]([NH2+]CCc1ccccc1)c1ccc(N(C)C)cc1 ZINC000037202137 1132021239 /nfs/dbraw/zinc/02/12/39/1132021239.db2.gz YOZQYXSCQDDQPM-HNNXBMFYSA-N 1 0 268.404 3.646 20 10 CHCDRO C[C@H]([NH2+]CCc1cccs1)c1ccc(N(C)C)cc1 ZINC000037211817 1132022768 /nfs/dbraw/zinc/02/27/68/1132022768.db2.gz LGPSBSWJMJWUTM-ZDUSSCGKSA-N 1 0 274.433 3.707 20 10 CHCDRO Cc1cccc([C@@H](C)[NH2+]Cc2ccc(N(C)C)cc2)c1 ZINC000037233610 1132024414 /nfs/dbraw/zinc/02/44/14/1132024414.db2.gz AIKDWSPXUFTZCR-OAHLLOKOSA-N 1 0 268.404 3.912 20 10 CHCDRO Oc1ccc(O)c(C[NH+]2CCC3(CCCCC3)CC2)c1 ZINC001141155930 1132029969 /nfs/dbraw/zinc/02/99/69/1132029969.db2.gz AXYWHNMXTSEHAL-UHFFFAOYSA-N 1 0 275.392 3.644 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)Cc1ccc(C)cc1F ZINC001141195117 1132039660 /nfs/dbraw/zinc/03/96/60/1132039660.db2.gz AXOZAOMPGYEHGE-UHFFFAOYSA-N 1 0 273.351 3.862 20 10 CHCDRO CC[C@@H](C)OCC[C@H](C)[NH2+]Cc1c(C)cc(C)cc1O ZINC001172340108 1132177057 /nfs/dbraw/zinc/17/70/57/1132177057.db2.gz VYJGGJHZJNOKHP-LSDHHAIUSA-N 1 0 279.424 3.692 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H](C)CCCc2cccnc2)c1 ZINC000839150533 1132185935 /nfs/dbraw/zinc/18/59/35/1132185935.db2.gz LIOFMNKPVUTRFH-OAHLLOKOSA-N 1 0 284.403 3.597 20 10 CHCDRO Cc1cccc(C[NH2+][C@H](C)CCCc2cccnc2)c1O ZINC000839151512 1132186060 /nfs/dbraw/zinc/18/60/60/1132186060.db2.gz WQTFMQQRVOMONX-OAHLLOKOSA-N 1 0 284.403 3.597 20 10 CHCDRO C[C@@H](c1ccccc1)[N@H+](CCCCO)Cc1ccccc1O ZINC000839532688 1132221898 /nfs/dbraw/zinc/22/18/98/1132221898.db2.gz ZKHFMUSLTKJDRE-INIZCTEOSA-N 1 0 299.414 3.728 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@@H+]2CCC[C@]3(CCSC3)C2)c1 ZINC000840142300 1132247732 /nfs/dbraw/zinc/24/77/32/1132247732.db2.gz FRQPCQNQDVRDFQ-KRWDZBQOSA-N 1 0 291.460 3.728 20 10 CHCDRO Oc1ccc(CC[NH2+][C@H]2CC[C@@H](c3ccccc3)C2)cc1O ZINC001172550122 1132261779 /nfs/dbraw/zinc/26/17/79/1132261779.db2.gz CNECBROUCIAQJA-SJORKVTESA-N 1 0 297.398 3.566 20 10 CHCDRO Oc1cccc(C[NH2+][C@H]2CC[C@@H](c3ccccc3)C2)c1O ZINC001172554786 1132265420 /nfs/dbraw/zinc/26/54/20/1132265420.db2.gz DNKGLBMOBLLUFT-ZBFHGGJFSA-N 1 0 283.371 3.524 20 10 CHCDRO COC1CCC([NH2+][C@@H](C)c2c(C)cc(C)cc2O)CC1 ZINC000840791680 1132287486 /nfs/dbraw/zinc/28/74/86/1132287486.db2.gz BVCWBOXFIZPTEW-NFOMZHRRSA-N 1 0 277.408 3.617 20 10 CHCDRO COC1CCC([NH2+][C@@H](C)c2ccc(C)c(C)c2O)CC1 ZINC000840792085 1132287868 /nfs/dbraw/zinc/28/78/68/1132287868.db2.gz GPRFRPVNSMRIMO-NFOMZHRRSA-N 1 0 277.408 3.617 20 10 CHCDRO Cc1ncc(C[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)o1 ZINC000840794088 1132288179 /nfs/dbraw/zinc/28/81/79/1132288179.db2.gz CNLPCNBLSMUBKC-SECBINFHSA-N 1 0 280.755 3.501 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCC[C@@H]2C[C@@H]21)c1cc(Cl)ccc1O ZINC000840820049 1132290592 /nfs/dbraw/zinc/29/05/92/1132290592.db2.gz IYBBVCMIGKUHBJ-XYHOJCAOSA-N 1 0 265.784 3.885 20 10 CHCDRO CO[C@H]1c2ccccc2C[C@H]1[NH2+][C@H](C)c1cc(C)ccc1O ZINC000840847850 1132293577 /nfs/dbraw/zinc/29/35/77/1132293577.db2.gz QMVCDAWSQAHGKZ-XVSDVWIESA-N 1 0 297.398 3.664 20 10 CHCDRO COCC1CCC([NH2+][C@@H](C)c2ccc(C)cc2O)CC1 ZINC000840883488 1132303186 /nfs/dbraw/zinc/30/31/86/1132303186.db2.gz ZVMWNULRJMMFTK-NFOMZHRRSA-N 1 0 277.408 3.556 20 10 CHCDRO Cc1cc([C@H]2CCC[N@H+]2Cc2ccc(N(C)C)cc2C)on1 ZINC000840910773 1132308391 /nfs/dbraw/zinc/30/83/91/1132308391.db2.gz LWAACHKSAIOAMS-QGZVFWFLSA-N 1 0 299.418 3.695 20 10 CHCDRO CC[C@H](CC(F)(F)F)[NH2+]Cc1ccc(N(C)C)cc1C ZINC000840940278 1132309438 /nfs/dbraw/zinc/30/94/38/1132309438.db2.gz YHBFBIDWVCSELF-CYBMUJFWSA-N 1 0 288.357 3.882 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CC[C@H]2CCO[C@@H](C)C2)c(Cl)c1 ZINC000840939985 1132311163 /nfs/dbraw/zinc/31/11/63/1132311163.db2.gz STBZBFGGYBEARX-STQMWFEESA-N 1 0 297.826 3.649 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@H+](Cc1ccccn1)C1CC1 ZINC000840945391 1132311219 /nfs/dbraw/zinc/31/12/19/1132311219.db2.gz MEMMJWFZVMQBIF-UHFFFAOYSA-N 1 0 295.430 3.621 20 10 CHCDRO Cc1cc(O)c(C[NH2+]Cc2cnc(C)cc2C)c(Cl)c1 ZINC000840952245 1132311347 /nfs/dbraw/zinc/31/13/47/1132311347.db2.gz XQOVHVZRJJQTQY-UHFFFAOYSA-N 1 0 290.794 3.656 20 10 CHCDRO COC[C@@H]1CCC[N@H+](Cc2c(O)cc(C)cc2Cl)CC1 ZINC000840952478 1132311600 /nfs/dbraw/zinc/31/16/00/1132311600.db2.gz ATSVJLCZYVIWPL-CYBMUJFWSA-N 1 0 297.826 3.603 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+]CC(C)(C)OCC2CC2)c1O ZINC000840960832 1132313319 /nfs/dbraw/zinc/31/33/19/1132313319.db2.gz VNZUQMOUDNXQRL-UHFFFAOYSA-N 1 0 297.826 3.649 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CCC2CC(F)(F)C2)c(Cl)c1 ZINC000840953262 1132314354 /nfs/dbraw/zinc/31/43/54/1132314354.db2.gz MZRJQDRCIARCBA-UHFFFAOYSA-N 1 0 289.753 3.879 20 10 CHCDRO COc1cccc([C@@H]2C[C@H]2C[NH2+]Cc2cc(C)ccc2O)c1 ZINC000840973295 1132315552 /nfs/dbraw/zinc/31/55/52/1132315552.db2.gz IBSHNAIIOMDTOB-YJBOKZPZSA-N 1 0 297.398 3.603 20 10 CHCDRO Cc1cccc(C[NH+]2CCC3(CC[C@@H](F)C3)CC2)c1O ZINC001231592133 1132320969 /nfs/dbraw/zinc/32/09/69/1132320969.db2.gz CTUKFSAIKUJPOS-OAHLLOKOSA-N 1 0 277.383 3.805 20 10 CHCDRO C[C@H](CC[NH2+]CCc1ccc(N)cc1)c1ccccc1 ZINC000841036568 1132320966 /nfs/dbraw/zinc/32/09/66/1132320966.db2.gz VVEDSKRPJWGRFU-OAHLLOKOSA-N 1 0 268.404 3.595 20 10 CHCDRO Cc1cccc(C[NH+]2CCC(c3cccc(O)c3)CC2)c1O ZINC001231595312 1132321620 /nfs/dbraw/zinc/32/16/20/1132321620.db2.gz WGLYLYFIXDJQCV-UHFFFAOYSA-N 1 0 297.398 3.786 20 10 CHCDRO C[C@H](CCc1ccc(F)cc1)[NH2+]CCc1ccc(N)cc1 ZINC000841033766 1132321727 /nfs/dbraw/zinc/32/17/27/1132321727.db2.gz AMWIHDQNSYCZFX-CQSZACIVSA-N 1 0 286.394 3.561 20 10 CHCDRO C[C@H](CCCC(F)(F)F)[NH2+]CCc1ccc(N)cc1 ZINC000841033787 1132322256 /nfs/dbraw/zinc/32/22/56/1132322256.db2.gz BEFCTLUDFJDWBH-LLVKDONJSA-N 1 0 274.330 3.522 20 10 CHCDRO C[C@H](Cc1c(F)cccc1Cl)[NH2+]Cc1ccccc1O ZINC001172838579 1132332345 /nfs/dbraw/zinc/33/23/45/1132332345.db2.gz XLUYUKRGDVCYQV-LLVKDONJSA-N 1 0 293.769 3.906 20 10 CHCDRO C[C@@H](Cc1ccc(F)cc1Cl)[NH2+]Cc1ccccc1O ZINC001172860383 1132346495 /nfs/dbraw/zinc/34/64/95/1132346495.db2.gz CNGNBFHLXKQPBJ-NSHDSACASA-N 1 0 293.769 3.906 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CC[C@H](F)C(F)(F)CC2)c(O)c1 ZINC001231841882 1132375190 /nfs/dbraw/zinc/37/51/90/1132375190.db2.gz FOBLZDBYCMREFU-AWEZNQCLSA-N 1 0 287.325 3.578 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCC[C@@H]2c2ccncc2)c(O)c1 ZINC001231843813 1132375941 /nfs/dbraw/zinc/37/59/41/1132375941.db2.gz BIXMIWNXXDQTOW-QGZVFWFLSA-N 1 0 282.387 3.741 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCCc3ccccc3C2)c(O)c1 ZINC001231846480 1132378757 /nfs/dbraw/zinc/37/87/57/1132378757.db2.gz MRDJIWPXTDEHAK-UHFFFAOYSA-N 1 0 281.399 3.957 20 10 CHCDRO COc1cc(N(C)C)ccc1C[N@H+]1[C@H](C)CCC[C@@H]1C ZINC001231848673 1132379497 /nfs/dbraw/zinc/37/94/97/1132379497.db2.gz JTJIZPVBNISXPB-OKILXGFUSA-N 1 0 276.424 3.524 20 10 CHCDRO Cc1csc(C[NH2+][C@H](C)c2ccc(Cl)cc2O)n1 ZINC000841744642 1132387961 /nfs/dbraw/zinc/38/79/61/1132387961.db2.gz RDXZCLRPCJVYTQ-SECBINFHSA-N 1 0 282.796 3.661 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H](O)C1CCCCC1)c1ccc(Cl)cc1O ZINC000841746414 1132389009 /nfs/dbraw/zinc/38/90/09/1132389009.db2.gz GOXLRKGQCAAZNH-BDJLRTHQSA-N 1 0 297.826 3.637 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)[C@@H]1C[C@H]1c1cccs1 ZINC000841747840 1132389677 /nfs/dbraw/zinc/38/96/77/1132389677.db2.gz UFNNOMLFKAZICU-UHOFOFEASA-N 1 0 299.439 3.965 20 10 CHCDRO CCCCOCC[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841746995 1132389863 /nfs/dbraw/zinc/38/98/63/1132389863.db2.gz MJGGZSFMVUEKIV-NSHDSACASA-N 1 0 271.788 3.513 20 10 CHCDRO CCCO[C@H]1CC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC001231881974 1132390269 /nfs/dbraw/zinc/39/02/69/1132390269.db2.gz LVSYKISBGCNGCG-INIZCTEOSA-N 1 0 285.387 3.546 20 10 CHCDRO Oc1c(C[N@@H+]2CCC3(CC3)C2)ccc2ccccc21 ZINC001231879605 1132390588 /nfs/dbraw/zinc/39/05/88/1132390588.db2.gz KENQXMJKFSXDDD-UHFFFAOYSA-N 1 0 253.345 3.531 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCCC[C@H]1F)c1ccc(Cl)cc1O ZINC000841756476 1132392188 /nfs/dbraw/zinc/39/21/88/1132392188.db2.gz VVVZYDMGLXKUIA-OASPWFOLSA-N 1 0 271.763 3.977 20 10 CHCDRO CC1(C)CCC[N@@H+]1Cc1ccc2ccccc2c1O ZINC001231879956 1132392333 /nfs/dbraw/zinc/39/23/33/1132392333.db2.gz YFSDVUZHGFKAPD-UHFFFAOYSA-N 1 0 255.361 3.920 20 10 CHCDRO CO[C@H]1CCCC[C@@H]1[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000841752884 1132392988 /nfs/dbraw/zinc/39/29/88/1132392988.db2.gz QZDPWMUPBIIPQV-DGFSRKRXSA-N 1 0 283.799 3.654 20 10 CHCDRO C[C@@H]([NH2+]CCNc1ccccc1)c1ccc(Cl)cc1O ZINC000841757181 1132395208 /nfs/dbraw/zinc/39/52/08/1132395208.db2.gz FQVZXJGCFZCHSW-GFCCVEGCSA-N 1 0 290.794 3.808 20 10 CHCDRO C[C@@H]([NH2+][C@H](CO)CC1CCCCC1)c1cc(F)ccc1O ZINC000841761311 1132397211 /nfs/dbraw/zinc/39/72/11/1132397211.db2.gz IGVABUIPPXECBW-DOMZBBRYSA-N 1 0 295.398 3.513 20 10 CHCDRO CO[C@H](C[NH2+]Cc1ccc2ccccc2c1O)CC(C)C ZINC000841888008 1132399664 /nfs/dbraw/zinc/39/96/64/1132399664.db2.gz BUACWAWSXSRLJV-INIZCTEOSA-N 1 0 287.403 3.696 20 10 CHCDRO CC[C@@H]1CC[C@@H]([NH2+]Cc2cc(Br)ccc2O)C1 ZINC001173269554 1132434078 /nfs/dbraw/zinc/43/40/78/1132434078.db2.gz XHPKJESXGIZMAX-ZWNOBZJWSA-N 1 0 298.224 3.823 20 10 CHCDRO CC[N@H+](Cc1ccccc1)Cc1cc(Cl)c(O)cc1O ZINC001232258542 1132445594 /nfs/dbraw/zinc/44/55/94/1132445594.db2.gz KBBFKYSKWORSQV-UHFFFAOYSA-N 1 0 291.778 3.773 20 10 CHCDRO C[C@H]1C[N@H+](Cc2c(O)ccc3ccccc32)CC2(CCC2)O1 ZINC000842642331 1132447808 /nfs/dbraw/zinc/44/78/08/1132447808.db2.gz JFNNHBSZIIRCMT-AWEZNQCLSA-N 1 0 297.398 3.689 20 10 CHCDRO Cc1ccccc1C1([NH2+]Cc2ccc3c(c2)CCO3)CC1 ZINC000842732223 1132455420 /nfs/dbraw/zinc/45/54/20/1132455420.db2.gz JDCUZIDBUXSIEE-UHFFFAOYSA-N 1 0 279.383 3.709 20 10 CHCDRO COc1cc(C)c(C[N@H+](C)Cc2ccccc2O)c(C)c1 ZINC001142942585 1132486680 /nfs/dbraw/zinc/48/66/80/1132486680.db2.gz SRNAFZAUIAYMCR-UHFFFAOYSA-N 1 0 285.387 3.650 20 10 CHCDRO CC[N@H+](Cc1cc2ccoc2cn1)Cc1ccccc1O ZINC001232554466 1132487961 /nfs/dbraw/zinc/48/79/61/1132487961.db2.gz VVROEBFGHCRRKO-UHFFFAOYSA-N 1 0 282.343 3.556 20 10 CHCDRO CO[C@@H]1CC[N@H+](Cc2cccc(C(C)(C)C)c2O)[C@H](C)C1 ZINC001143117058 1132504384 /nfs/dbraw/zinc/50/43/84/1132504384.db2.gz RAPMIYMVUNJDBL-UKRRQHHQSA-N 1 0 291.435 3.689 20 10 CHCDRO COc1cccc(C[N@@H+]2CC3(CC=CC3)[C@H]2C(C)C)c1O ZINC000843431903 1132534513 /nfs/dbraw/zinc/53/45/13/1132534513.db2.gz NDCQSEZXTIYBFD-QGZVFWFLSA-N 1 0 287.403 3.577 20 10 CHCDRO C[C@H]1C[N@H+](Cc2ccc3ccccc3c2O)CC2(CCC2)O1 ZINC000843432791 1132535170 /nfs/dbraw/zinc/53/51/70/1132535170.db2.gz PZBDPVJAAMOWKF-AWEZNQCLSA-N 1 0 297.398 3.689 20 10 CHCDRO C[C@@H]1CCC[N@H+](Cc2cc(C(C)(C)C)ccc2O)C1 ZINC001233283482 1132595576 /nfs/dbraw/zinc/59/55/76/1132595576.db2.gz ILPZNIVJYQQJSN-CYBMUJFWSA-N 1 0 261.409 3.922 20 10 CHCDRO CC(C)[C@H]1C[N@H+](Cc2cc(C(C)(C)C)ccc2O)CCO1 ZINC001233287113 1132596557 /nfs/dbraw/zinc/59/65/57/1132596557.db2.gz WXZZJOQZJGVKDT-QGZVFWFLSA-N 1 0 291.435 3.547 20 10 CHCDRO CCSCC[C@H](C)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000135292174 1132655898 /nfs/dbraw/zinc/65/58/98/1132655898.db2.gz VKXOFGXAWFOZCA-HNNXBMFYSA-N 1 0 292.492 3.908 20 10 CHCDRO CC[C@@H](C)[N@H+](C)Cc1cccc(OC(F)(F)F)c1O ZINC001233736528 1132672902 /nfs/dbraw/zinc/67/29/02/1132672902.db2.gz MFHJILISNMJJRC-SECBINFHSA-N 1 0 277.286 3.521 20 10 CHCDRO Cc1cc(Nc2cc(Cl)c(C)c(Cl)c2O)cc[nH+]1 ZINC001174657010 1132951877 /nfs/dbraw/zinc/95/18/77/1132951877.db2.gz YVWJQIAECWTUCE-UHFFFAOYSA-N 1 0 283.158 3.876 20 10 CHCDRO Cc1cc(C)c(CNc2cc3[nH]ccc3c(C)[nH+]2)c(O)c1 ZINC001160811287 1132982567 /nfs/dbraw/zinc/98/25/67/1132982567.db2.gz JXINNXYCNXVXKU-UHFFFAOYSA-N 1 0 281.359 3.806 20 10 CHCDRO CNc1ccccc1NC[C@H](c1ccccc1)[NH+]1CCCC1 ZINC001166911068 1133294210 /nfs/dbraw/zinc/29/42/10/1133294210.db2.gz SKZADUDHTHPPGV-LJQANCHMSA-N 1 0 295.430 3.977 20 10 CHCDRO CCOCc1cc(C[NH2+][C@H](C)CC2CCC2)ccc1OC ZINC001203288853 1133310742 /nfs/dbraw/zinc/31/07/42/1133310742.db2.gz DZRYRIOGDSHXIE-CQSZACIVSA-N 1 0 291.435 3.900 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(OC)c(C)c1)[C@H](O)c1ccccc1 ZINC001203582594 1133342598 /nfs/dbraw/zinc/34/25/98/1133342598.db2.gz HGNDKJZEXZBWCX-IEBWSBKVSA-N 1 0 299.414 3.605 20 10 CHCDRO COc1cccc(C[N@H+](C)C/C=C/c2ccccc2)c1O ZINC001203596803 1133344305 /nfs/dbraw/zinc/34/43/05/1133344305.db2.gz NBCMVOIRSNODCA-JXMROGBWSA-N 1 0 283.371 3.546 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH+]1CC2(C1)CCCCC2 ZINC001203664253 1133352097 /nfs/dbraw/zinc/35/20/97/1133352097.db2.gz UKXYDSZEDXMOJR-UHFFFAOYSA-N 1 0 265.784 3.812 20 10 CHCDRO C[C@H](c1ccc(Cl)cc1)[N@H+](C)Cc1ccc(O)c(O)c1 ZINC001203879958 1133378024 /nfs/dbraw/zinc/37/80/24/1133378024.db2.gz KWGJXACMQVVZFX-LLVKDONJSA-N 1 0 291.778 3.944 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCC(C)(C)C2)cc1 ZINC001203938816 1133385789 /nfs/dbraw/zinc/38/57/89/1133385789.db2.gz FWUZTTHOCJAPBI-UHFFFAOYSA-N 1 0 260.425 3.765 20 10 CHCDRO Cc1ccc([C@@H]2CCC[N@H+]2Cc2ccc(N(C)C)cc2)cn1 ZINC001203937872 1133385942 /nfs/dbraw/zinc/38/59/42/1133385942.db2.gz WRTMEIIUOIRNAO-IBGZPJMESA-N 1 0 295.430 3.793 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CC[C@@](C)(CF)C2)cc1 ZINC001203940626 1133386078 /nfs/dbraw/zinc/38/60/78/1133386078.db2.gz RTGDFWQCMWOKEU-KRWDZBQOSA-N 1 0 278.415 3.714 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCC3(CC3)C2)cc1 ZINC001203940049 1133386215 /nfs/dbraw/zinc/38/62/15/1133386215.db2.gz HXKOVTSGKGDLGR-UHFFFAOYSA-N 1 0 258.409 3.519 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)C2CCCC2)cc1 ZINC001203939013 1133386230 /nfs/dbraw/zinc/38/62/30/1133386230.db2.gz ISMXDCMAFFIJLM-UHFFFAOYSA-N 1 0 260.425 3.907 20 10 CHCDRO Cc1cccc2c1CC[N@@H+](Cc1ccc(N(C)C)cc1)C2 ZINC001203929837 1133386247 /nfs/dbraw/zinc/38/62/47/1133386247.db2.gz HHPBKAPTENPHAU-UHFFFAOYSA-N 1 0 280.415 3.619 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCCC3(CCCC3)C2)cc1 ZINC001203930801 1133386587 /nfs/dbraw/zinc/38/65/87/1133386587.db2.gz IEBWPVZCKGKZJQ-UHFFFAOYSA-N 1 0 272.436 3.909 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCCC[C@@H](F)C2)cc1 ZINC001203936275 1133386813 /nfs/dbraw/zinc/38/68/13/1133386813.db2.gz LJECGTOZEBJCRJ-MRXNPFEDSA-N 1 0 278.415 3.857 20 10 CHCDRO Oc1ccc(C[N@@H+]2CCC[C@H]2C2CCCCC2)c(O)c1 ZINC001204281500 1133427571 /nfs/dbraw/zinc/42/75/71/1133427571.db2.gz SEGTYJJOWQWMLB-INIZCTEOSA-N 1 0 275.392 3.643 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[NH+]1C[C@H]2CCC[C@@H]2C1 ZINC001204319852 1133436408 /nfs/dbraw/zinc/43/64/08/1133436408.db2.gz HTAFZEACNRAANY-IAGOWNOFSA-N 1 0 270.420 3.519 20 10 CHCDRO FC1(F)CCC[N@H+](Cc2ccc(N3CCCC3)cc2)CC1 ZINC001204324124 1133437197 /nfs/dbraw/zinc/43/71/97/1133437197.db2.gz KSVKUHAEVOOYBA-UHFFFAOYSA-N 1 0 294.389 3.908 20 10 CHCDRO C[N@@H+](Cc1ccc(N2CCCC2)cc1)C[C@H]1CC1(C)C ZINC001204320869 1133437282 /nfs/dbraw/zinc/43/72/82/1133437282.db2.gz BSPLWEWYRRIVIV-MRXNPFEDSA-N 1 0 272.436 3.765 20 10 CHCDRO CCSCC[C@@H](C)[N@H+](C)Cc1ccc(C)cc1O ZINC001204348031 1133437921 /nfs/dbraw/zinc/43/79/21/1133437921.db2.gz NPRZNCRGFNSRKY-CYBMUJFWSA-N 1 0 267.438 3.664 20 10 CHCDRO CCc1ccc(C[N@H+](C)Cc2c(C)cc(OC)cc2O)cc1 ZINC001205148231 1133537264 /nfs/dbraw/zinc/53/72/64/1133537264.db2.gz DLXSBEDLNSPWJM-UHFFFAOYSA-N 1 0 299.414 3.904 20 10 CHCDRO COc1cc(C)cc(C[NH2+]C[C@@H](C)c2ccccc2)c1O ZINC001205277665 1133553457 /nfs/dbraw/zinc/55/34/57/1133553457.db2.gz SDDFCHSHIAEZEJ-CQSZACIVSA-N 1 0 285.387 3.603 20 10 CHCDRO COc1cc(C)cc(C[NH2+][C@H]2CCCC(C)(C)C2)c1O ZINC001205430528 1133576881 /nfs/dbraw/zinc/57/68/81/1133576881.db2.gz AXEUNIMDUBMDMK-AWEZNQCLSA-N 1 0 277.408 3.768 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CC[C@@H](C)[C@H](C)C2)cc1C ZINC000085041125 1133584546 /nfs/dbraw/zinc/58/45/46/1133584546.db2.gz NKENNUDCNDUWBY-XJKCOSOUSA-N 1 0 261.409 3.918 20 10 CHCDRO Cc1ccc(C[NH2+][C@H]2C[C@@H](OC(C)(C)C)C2(C)C)c(O)c1 ZINC001206247790 1133676051 /nfs/dbraw/zinc/67/60/51/1133676051.db2.gz NMECMKYPXXZQCB-JKSUJKDBSA-N 1 0 291.435 3.772 20 10 CHCDRO Nc1ccc(N(c2ccccc2)c2cc[nH+]c(N)c2)cc1 ZINC001206561637 1133718186 /nfs/dbraw/zinc/71/81/86/1133718186.db2.gz MJMPQIDEWZSPEZ-UHFFFAOYSA-N 1 0 276.343 3.716 20 10 CHCDRO CC(C)c1ccc(O)c(C[N@@H+]2CCO[C@@](C)(C3CC3)C2)c1 ZINC001206644902 1133731019 /nfs/dbraw/zinc/73/10/19/1133731019.db2.gz KUVAPHZRNAIEAR-GOSISDBHSA-N 1 0 289.419 3.517 20 10 CHCDRO CC(C)C[C@@H](CN(C)C)[NH2+]Cc1cc(C(C)C)ccc1O ZINC001207742907 1133844062 /nfs/dbraw/zinc/84/40/62/1133844062.db2.gz ZRVGQSMYUUVQAR-KRWDZBQOSA-N 1 0 292.467 3.582 20 10 CHCDRO C[C@@H](C[N@@H+]1CCc2cccc(O)c2C1)c1ccccc1 ZINC001207911531 1133861729 /nfs/dbraw/zinc/86/17/29/1133861729.db2.gz DJYXSHFLPSSOJY-AWEZNQCLSA-N 1 0 267.372 3.554 20 10 CHCDRO CC1(C[N@@H+]2CCc3cccc(O)c3C2)CCCCC1 ZINC001208902097 1133960013 /nfs/dbraw/zinc/96/00/13/1133960013.db2.gz HRJGNODWOLHITJ-UHFFFAOYSA-N 1 0 259.393 3.721 20 10 CHCDRO CC[N@@H+](Cc1ccc(N(C)C)cc1)C[C@H](C)C(F)(F)F ZINC001208902364 1133960781 /nfs/dbraw/zinc/96/07/81/1133960781.db2.gz RDKOEBBICHVWDB-LBPRGKRZSA-N 1 0 288.357 3.773 20 10 CHCDRO CC[N@H+](CCc1cc(F)cc(F)c1)Cc1ccccc1O ZINC001209131754 1133979638 /nfs/dbraw/zinc/97/96/38/1133979638.db2.gz DAPHUOZRIMIRRE-UHFFFAOYSA-N 1 0 291.341 3.735 20 10 CHCDRO Cc1cc(Nc2cccc(C)c2O)c2ccccc2[nH+]1 ZINC001210186808 1134161593 /nfs/dbraw/zinc/16/15/93/1134161593.db2.gz VHPFYKJJRFWKCZ-UHFFFAOYSA-N 1 0 264.328 3.723 20 10 CHCDRO C[C@@H]1CCC[C@H]([NH2+]Cc2ccc3c(c2)CCO3)CC1 ZINC000300587025 1134438165 /nfs/dbraw/zinc/43/81/65/1134438165.db2.gz ZDAJKGRLCINDOG-CJNGLKHVSA-N 1 0 259.393 3.680 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[NH2+][C@@H]1CC[C@@H]2C[C@@H]2C1 ZINC000403485261 1134788869 /nfs/dbraw/zinc/78/88/69/1134788869.db2.gz UBKUSZCJLTWWFS-BRWVUGGUSA-N 1 0 270.420 3.565 20 10 CHCDRO C[C@H]([NH2+]C1C[C@H]2CC[C@@H](C1)S2)c1ccc(N(C)C)cc1 ZINC000403659771 1134828597 /nfs/dbraw/zinc/82/85/97/1134828597.db2.gz XSPUPBHQSDLISJ-IICXIOTHSA-N 1 0 290.476 3.830 20 10 CHCDRO CC(C)=CCC[C@H](C)Oc1ccc(N2CC[NH2+]CC2)cc1 ZINC001218316840 1135087912 /nfs/dbraw/zinc/08/79/12/1135087912.db2.gz GEMGKSSHQLLTSG-INIZCTEOSA-N 1 0 288.435 3.610 20 10 CHCDRO Cc1cccc([C@H](C)Oc2ccc(N3CC[NH2+]CC3)cc2)c1 ZINC001218325205 1135088792 /nfs/dbraw/zinc/08/87/92/1135088792.db2.gz ILCILYFAAFUBHL-INIZCTEOSA-N 1 0 296.414 3.545 20 10 CHCDRO C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1Oc1ccc(N)cc1 ZINC001218337428 1135089853 /nfs/dbraw/zinc/08/98/53/1135089853.db2.gz YYZFFZJSYLGRKL-HNAYVOBHSA-N 1 0 296.414 3.558 20 10 CHCDRO C[C@H]1[NH2+]C[C@H]1Oc1ccccc1NN=C1C=CC=CC1=O ZINC001218388354 1135097171 /nfs/dbraw/zinc/09/71/71/1135097171.db2.gz SDAIORATIJLINL-SSRVBLDWSA-N 1 0 283.331 3.547 20 10 CHCDRO C[C@H]1[NH2+]C[C@@H]1Oc1ccc(/N=N/c2ccccc2)cc1 ZINC001218389377 1135097634 /nfs/dbraw/zinc/09/76/34/1135097634.db2.gz VIFKTUNXHJFNLO-PNIJCXDUSA-N 1 0 267.332 3.841 20 10 CHCDRO COc1cccc(C[NH2+][C@H](C)c2ccccc2Cl)c1O ZINC000020124049 171005433 /nfs/dbraw/zinc/00/54/33/171005433.db2.gz YFAOJTMFNCEUPF-LLVKDONJSA-N 1 0 291.778 3.905 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1ccccn1)c1ccc(N(C)C)cc1 ZINC000152369973 261063501 /nfs/dbraw/zinc/06/35/01/261063501.db2.gz CVCJYTOBDVULRH-RHSMWYFYSA-N 1 0 283.419 3.950 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCc2c1cccc2O)c1ccccc1O ZINC000155696405 261106147 /nfs/dbraw/zinc/10/61/47/261106147.db2.gz SMQOYOFOKPKQDN-JKSUJKDBSA-N 1 0 283.371 3.826 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H]1CCCO[C@@H]1C(C)C)c1ccccc1O ZINC000156698574 261130034 /nfs/dbraw/zinc/13/00/34/261130034.db2.gz SPKGIEXBRQVYSD-YXJHDRRASA-N 1 0 291.435 3.884 20 10 CHCDRO C[C@H]([NH2+]CCc1c(F)cccc1F)c1ccccc1O ZINC000183430327 261974577 /nfs/dbraw/zinc/97/45/77/261974577.db2.gz CDDYFHCRZNCQJQ-NSHDSACASA-N 1 0 277.314 3.564 20 10 CHCDRO C[C@@H]([NH2+]C1CCN(c2ccccc2)CC1)c1ccccc1O ZINC000183439071 261975233 /nfs/dbraw/zinc/97/52/33/261975233.db2.gz DKTRWJLJMGWACI-OAHLLOKOSA-N 1 0 296.414 3.712 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCC[C@H]2CCCCO2)c(O)c1 ZINC000183985634 262003870 /nfs/dbraw/zinc/00/38/70/262003870.db2.gz VUXKIFWSSLLDGS-LSDHHAIUSA-N 1 0 277.408 3.701 20 10 CHCDRO C[C@H]([NH2+]Cc1ccco1)c1cc2c(cc1O)CCCC2 ZINC000184843391 262030946 /nfs/dbraw/zinc/03/09/46/262030946.db2.gz VHKKFEMRXGPOLM-LBPRGKRZSA-N 1 0 271.360 3.715 20 10 CHCDRO CO[C@H](C[NH2+][C@H](C)c1cc(C)ccc1O)c1ccccc1 ZINC000185101706 262041340 /nfs/dbraw/zinc/04/13/40/262041340.db2.gz KHZNLPPSRRRSCI-RDTXWAMCSA-N 1 0 285.387 3.739 20 10 CHCDRO CCc1nc(CC[NH2+][C@@H](C)c2ccc(C)cc2O)cs1 ZINC000185310861 262049532 /nfs/dbraw/zinc/04/95/32/262049532.db2.gz MBRVHBMIIKTWEC-LBPRGKRZSA-N 1 0 290.432 3.613 20 10 CHCDRO Cc1noc(C)c1C[C@H](C)[NH2+][C@H](C)c1ccc(C)cc1O ZINC000185501703 262056923 /nfs/dbraw/zinc/05/69/23/262056923.db2.gz TVWSZVLNEBLQAA-NWDGAFQWSA-N 1 0 288.391 3.587 20 10 CHCDRO C[C@H]([NH2+][C@@H]1[C@@H]2CCO[C@@H]2C1(C)C)c1cc(Cl)ccc1O ZINC000185534227 262058650 /nfs/dbraw/zinc/05/86/50/262058650.db2.gz KQRHFUGRCSJOEH-NDMCHQMPSA-N 1 0 295.810 3.510 20 10 CHCDRO CCc1noc(CC)c1C[NH2+][C@H](C)c1ccc(C)cc1O ZINC000185678700 262066031 /nfs/dbraw/zinc/06/60/31/262066031.db2.gz ATUNJCHCDVAUPX-GFCCVEGCSA-N 1 0 288.391 3.664 20 10 CHCDRO COc1cc(C)ccc1C[NH2+][C@H](C)c1ccc(C)cc1O ZINC000185715116 262067797 /nfs/dbraw/zinc/06/77/97/262067797.db2.gz YZVXZIOPEFXREC-CQSZACIVSA-N 1 0 285.387 3.868 20 10 CHCDRO COC[C@@H]([NH2+][C@H](C)c1ccc(C)cc1O)c1ccccc1 ZINC000186034977 262076193 /nfs/dbraw/zinc/07/61/93/262076193.db2.gz WSCIRYJZTHGHLW-RHSMWYFYSA-N 1 0 285.387 3.739 20 10 CHCDRO CCOCCC1(C[NH2+][C@@H](C)c2cc(C)ccc2O)CCC1 ZINC000186115893 262080218 /nfs/dbraw/zinc/08/02/18/262080218.db2.gz JCIVGUPXXBSHIL-HNNXBMFYSA-N 1 0 291.435 3.948 20 10 CHCDRO COc1cc(C)cc(C[NH2+][C@@H](C)c2cc(C)ccc2O)c1 ZINC000186156151 262082115 /nfs/dbraw/zinc/08/21/15/262082115.db2.gz KQVNAZAHIYUUSU-AWEZNQCLSA-N 1 0 285.387 3.868 20 10 CHCDRO Cc1noc(C)c1[C@H](C)C[NH2+][C@H](C)c1cc(F)ccc1O ZINC000186158379 262082995 /nfs/dbraw/zinc/08/29/95/262082995.db2.gz NCQCGRSHQSQXOV-NXEZZACHSA-N 1 0 292.354 3.590 20 10 CHCDRO C[C@@H]([NH2+]CC[C@@H]1CCCCO1)c1cc(Cl)ccc1O ZINC000186515124 262096146 /nfs/dbraw/zinc/09/61/46/262096146.db2.gz YCANDAKMZMTIHR-YPMHNXCESA-N 1 0 283.799 3.655 20 10 CHCDRO Cc1csc([C@H](C)C[NH2+][C@H](C)c2cc(C)ccc2O)n1 ZINC000186561739 262098849 /nfs/dbraw/zinc/09/88/49/262098849.db2.gz WVOIPWXVSNRTFL-DGCLKSJQSA-N 1 0 290.432 3.920 20 10 CHCDRO CSCCCCC[NH2+][C@H](C)c1ccccc1O ZINC000186774135 262109463 /nfs/dbraw/zinc/10/94/63/262109463.db2.gz JFNAZHJWNHUWBF-GFCCVEGCSA-N 1 0 253.411 3.576 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCC[C@H](SC)C2)c1 ZINC000185483848 262304549 /nfs/dbraw/zinc/30/45/49/262304549.db2.gz QHIBNKLCLCGPRY-SCRDCRAPSA-N 1 0 295.448 3.726 20 10 CHCDRO CCCOc1ccc(C[NH2+]C[C@@H]2CCC(F)(F)C2)c(O)c1 ZINC000280412317 263061418 /nfs/dbraw/zinc/06/14/18/263061418.db2.gz BCHWWIONSLDALJ-GFCCVEGCSA-N 1 0 299.361 3.706 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C[C@H]2CCCC(F)(F)C2)c1 ZINC000281876328 263072726 /nfs/dbraw/zinc/07/27/26/263072726.db2.gz CYSIOIALEXFKLP-LBPRGKRZSA-N 1 0 269.335 3.616 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)[C@H]1CCOC1)c1cccc(Cl)c1[O-] ZINC000287850614 263102906 /nfs/dbraw/zinc/10/29/06/263102906.db2.gz WSWOTKSTSNZCDU-MJVIPROJSA-N 1 0 283.799 3.511 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@H]1CCc3c1cccc3F)CC2 ZINC000297946391 263212800 /nfs/dbraw/zinc/21/28/00/263212800.db2.gz YJACGXTVUACNFI-JKSUJKDBSA-N 1 0 283.346 3.796 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H](C)c2ccccc2O)c1 ZINC000037771110 326861080 /nfs/dbraw/zinc/86/10/80/326861080.db2.gz OAOKAGQRUFATSS-STQMWFEESA-N 1 0 271.360 3.813 20 10 CHCDRO Cc1ccc(C2CC[NH+](Cc3cccc(C)c3O)CC2)cn1 ZINC000378629412 329057081 /nfs/dbraw/zinc/05/70/81/329057081.db2.gz DKPXNNMAFDYJGD-UHFFFAOYSA-N 1 0 296.414 3.784 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+][C@H]1CCOC2(CCCC2)C1 ZINC000136705768 329673697 /nfs/dbraw/zinc/67/36/97/329673697.db2.gz TUWQPIMQANOEEZ-AWEZNQCLSA-N 1 0 295.810 3.627 20 10 CHCDRO COCCC1CC[NH+]([C@@H](C)c2ccc(C)cc2O)CC1 ZINC000527935690 330297913 /nfs/dbraw/zinc/29/79/13/330297913.db2.gz OJWRNGFORXHKHZ-AWEZNQCLSA-N 1 0 277.408 3.510 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2cccnc2C)c(O)c1 ZINC000527986278 330298795 /nfs/dbraw/zinc/29/87/95/330298795.db2.gz KYUOAEKADGLJBY-AWEZNQCLSA-N 1 0 270.376 3.563 20 10 CHCDRO CCC1(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)CCOCC1 ZINC000269003577 334719637 /nfs/dbraw/zinc/71/96/37/334719637.db2.gz VMEQMVAXNQAESK-HNNXBMFYSA-N 1 0 290.451 3.610 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]Cc2cnc(C)s2)cc1 ZINC000040443757 520908237 /nfs/dbraw/zinc/90/82/37/520908237.db2.gz AQSYTIJYZOWLDB-UHFFFAOYSA-N 1 0 289.448 3.588 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](C)[C@H](C)c2ccco2)c1 ZINC000131125567 521143376 /nfs/dbraw/zinc/14/33/76/521143376.db2.gz KFYFXAUVSBQIAW-GFCCVEGCSA-N 1 0 275.348 3.577 20 10 CHCDRO CC[C@@H](C)[NH2+]C1CCN(c2ccc(OC(F)F)cc2)CC1 ZINC000157733425 522226124 /nfs/dbraw/zinc/22/61/24/522226124.db2.gz UKQBIZGPBGPVEE-GFCCVEGCSA-N 1 0 298.377 3.645 20 10 CHCDRO CC[C@H]([NH2+]C1CC(F)(F)C1)c1ccc(C)cc1O ZINC000280235633 522559130 /nfs/dbraw/zinc/55/91/30/522559130.db2.gz VOTKALGEXANAQA-LBPRGKRZSA-N 1 0 255.308 3.539 20 10 CHCDRO CC[C@H]([NH2+]C1CCSCC1)c1ccc(C)cc1O ZINC000280229197 522563895 /nfs/dbraw/zinc/56/38/95/522563895.db2.gz VFTOFKKOZINJHT-AWEZNQCLSA-N 1 0 265.422 3.637 20 10 CHCDRO CC[C@H]([NH2+]CC(C)(C)CCOC)c1ccc(C)cc1O ZINC000280136302 522568964 /nfs/dbraw/zinc/56/89/64/522568964.db2.gz PINDCUJXLDINAQ-HNNXBMFYSA-N 1 0 279.424 3.804 20 10 CHCDRO CC[C@H]([NH2+]CC[C@@H]1CCO[C@@H](C)C1)c1ccccc1O ZINC000274776069 522600447 /nfs/dbraw/zinc/60/04/47/522600447.db2.gz OAEUXLLVLWDWOB-LZWOXQAQSA-N 1 0 277.408 3.638 20 10 CHCDRO CC[C@H]([NH2+]C[C@@](C)(OC)C1CC1)c1ccc(C)cc1O ZINC000291301161 522625501 /nfs/dbraw/zinc/62/55/01/522625501.db2.gz SKVIQRLRVNTEOW-DOTOQJQBSA-N 1 0 277.408 3.556 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCO[C@@H](C2CC2)C1)c1ccc(C)cc1O ZINC000280269176 522720734 /nfs/dbraw/zinc/72/07/34/522720734.db2.gz XTSJOZODXFZHLC-UWWQBHOKSA-N 1 0 289.419 3.699 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1cnn(C)c1C)c1ccc(C)cc1O ZINC000280269134 522741682 /nfs/dbraw/zinc/74/16/82/522741682.db2.gz XTNQQKNLAILEGO-WBMJQRKESA-N 1 0 287.407 3.544 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccncc1C)c1ccc(C)cc1O ZINC000280016676 522841903 /nfs/dbraw/zinc/84/19/03/522841903.db2.gz HCAYVSZMZNIPBO-QGZVFWFLSA-N 1 0 284.403 3.687 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](CO)c1ccccc1)c1ccc(C)cc1O ZINC000280105864 522850449 /nfs/dbraw/zinc/85/04/49/522850449.db2.gz NIWWFYHUXOKBOL-FUHWJXTLSA-N 1 0 299.414 3.517 20 10 CHCDRO COCc1cccc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)c1 ZINC000121426896 523058444 /nfs/dbraw/zinc/05/84/44/523058444.db2.gz IQBUNQYSHXSEKD-OAHLLOKOSA-N 1 0 298.430 3.750 20 10 CHCDRO COc1ccc(C[NH2+]Cc2ccc(F)c(F)c2)cc1C ZINC000049577520 524072980 /nfs/dbraw/zinc/07/29/80/524072980.db2.gz UVPOXWGUUGHBJS-UHFFFAOYSA-N 1 0 277.314 3.572 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@H](C)c2cc(F)ccc2O)c1 ZINC000094617668 524093106 /nfs/dbraw/zinc/09/31/06/524093106.db2.gz GSNCQJDQDNJLDY-VXGBXAGGSA-N 1 0 289.350 3.952 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H]2CSCCS2)c(O)c1 ZINC000294566254 524334377 /nfs/dbraw/zinc/33/43/77/524334377.db2.gz BSCNKLMHQVDAEX-QWHCGFSZSA-N 1 0 297.489 3.508 20 10 CHCDRO Cc1cccc(C[N@@H+]2CC(C)(C)[C@H]2c2cccnc2)c1O ZINC000292757608 524387152 /nfs/dbraw/zinc/38/71/52/524387152.db2.gz JDIBQWRDVSUTHH-QGZVFWFLSA-N 1 0 282.387 3.679 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)c2cc(F)ccc2O)s1 ZINC000094618035 524590369 /nfs/dbraw/zinc/59/03/69/524590369.db2.gz APXWKRYNTABCFR-JTQLQIEISA-N 1 0 265.353 3.752 20 10 CHCDRO C[C@]12CC[N@H+](Cc3c(O)cccc3Cl)C[C@H]1C2(F)F ZINC000292751283 525347204 /nfs/dbraw/zinc/34/72/04/525347204.db2.gz IMMCFQGMWZPWAS-OLZOCXBDSA-N 1 0 287.737 3.523 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCC(F)(F)C1)c1ccc(N(C)C)cc1 ZINC000281207790 525411012 /nfs/dbraw/zinc/41/10/12/525411012.db2.gz UBIGTTOLGCUXSO-STQMWFEESA-N 1 0 282.378 3.839 20 10 CHCDRO C[C@@H]1C[C@H]1c1ccc(C[NH2+]Cc2ccc(N(C)C)cc2)o1 ZINC000020146020 525510358 /nfs/dbraw/zinc/51/03/58/525510358.db2.gz ZEONXEUHLVAUEL-CXAGYDPISA-N 1 0 284.403 3.759 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccccc1OC(F)F)c1ccccc1O ZINC000020131623 525541473 /nfs/dbraw/zinc/54/14/73/525541473.db2.gz DGPQFDXCPQVYCY-LLVKDONJSA-N 1 0 293.313 3.844 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCCc2occc21)c1cc(F)ccc1O ZINC000094617005 525564638 /nfs/dbraw/zinc/56/46/38/525564638.db2.gz SOIPIERAOFOPDQ-IINYFYTJSA-N 1 0 275.323 3.853 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCOc2c(F)cccc21)c1ccccc1O ZINC000188053043 525626442 /nfs/dbraw/zinc/62/64/42/525626442.db2.gz FPJBANFGHHZTDK-NHYWBVRUSA-N 1 0 287.334 3.706 20 10 CHCDRO Cc1ccsc1[C@H](C)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000070090042 525886277 /nfs/dbraw/zinc/88/62/77/525886277.db2.gz SZDDPQYFABOGCG-ZDUSSCGKSA-N 1 0 274.433 3.973 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCC(F)(F)C2)c(O)c1 ZINC000281074181 525921929 /nfs/dbraw/zinc/92/19/29/525921929.db2.gz IOIMNMCHAAOMLS-NWDGAFQWSA-N 1 0 269.335 3.787 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc3c(n2)CCCC3)c(O)c1 ZINC000278454417 525927899 /nfs/dbraw/zinc/92/78/99/525927899.db2.gz LVWZEKAKSIZHRL-AWEZNQCLSA-N 1 0 296.414 3.825 20 10 CHCDRO COc1cccc(C[NH2+]Cc2c(C)cc(C)cc2C)c1O ZINC000237214506 526022666 /nfs/dbraw/zinc/02/26/66/526022666.db2.gz LMXVHIWEBMYWQT-UHFFFAOYSA-N 1 0 285.387 3.616 20 10 CHCDRO Oc1ccc(-c2ccccc2)cc1C[NH2+]CC1CCOCC1 ZINC000263729236 526338577 /nfs/dbraw/zinc/33/85/77/526338577.db2.gz XSOJCRNIQFUVGE-UHFFFAOYSA-N 1 0 297.398 3.575 20 10 CHCDRO c1cc(N2CCCCC2)ccc1C[NH2+]C[C@@H]1CCSC1 ZINC000226376778 526431009 /nfs/dbraw/zinc/43/10/09/526431009.db2.gz VFMVKBOGUZEUIP-INIZCTEOSA-N 1 0 290.476 3.520 20 10 CHCDRO Cc1ncsc1CC[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000296640931 527488846 /nfs/dbraw/zinc/48/88/46/527488846.db2.gz YARGXENFALQBRD-VIFPVBQESA-N 1 0 296.823 3.704 20 10 CHCDRO COc1cccc(C[N@@H+]2CCC[C@@H]3CCCC[C@H]32)c1O ZINC000228137299 1125462200 /nfs/dbraw/zinc/46/22/00/1125462200.db2.gz SZMRSYPRGFZBKG-DZGCQCFKSA-N 1 0 275.392 3.555 20 10 CHCDRO CC[C@@H](C)C[NH2+][C@H](C)Cc1ccc(N(C)C)cc1C ZINC001651228325 1118265579 /nfs/dbraw/zinc/26/55/79/1118265579.db2.gz VAXNMZWUVIHICM-UKRRQHHQSA-N 1 0 262.441 3.628 20 10 CHCDRO COc1ccccc1C(C)(C)[NH2+]Cc1cc(C)ccc1O ZINC000113335102 1125494052 /nfs/dbraw/zinc/49/40/52/1125494052.db2.gz CFVAGIFRUHOCOL-UHFFFAOYSA-N 1 0 285.387 3.734 20 10 CHCDRO CC[C@H](C[C@H](C)CO)[NH2+][C@H](CC)c1ccc(C)cc1O ZINC000794803675 1123953702 /nfs/dbraw/zinc/95/37/02/1123953702.db2.gz ROHLLAQICFWWSD-SQWLQELKSA-N 1 0 279.424 3.538 20 10 CHCDRO Cc1cc(C[NH2+][C@H](C)c2ccccc2O)c(C)s1 ZINC000877756474 1125072660 /nfs/dbraw/zinc/07/26/60/1125072660.db2.gz KSUJTUAAGNIGJQ-LLVKDONJSA-N 1 0 261.390 3.921 20 10 CHCDRO C[C@@H]([NH2+]CC1CCSCC1)c1ccc(N(C)C)cc1 ZINC000131154838 1125374912 /nfs/dbraw/zinc/37/49/12/1125374912.db2.gz PUMNMHNMGMYLJX-CYBMUJFWSA-N 1 0 278.465 3.546 20 10 CHCDRO CC[C@](C)(C[NH2+][C@H](C)c1cc(Cl)ccc1O)OC ZINC000834883163 1131717603 /nfs/dbraw/zinc/71/76/03/1131717603.db2.gz ZOWPICLAQJKAPE-QMTHXVAHSA-N 1 0 271.788 3.511 20 10 CHCDRO CC[C@H]1CCC[N@H+](Cc2ccc(Cl)cc2O)C1 ZINC001140465663 1131750392 /nfs/dbraw/zinc/75/03/92/1131750392.db2.gz QIIHWYQDJXFZQB-NSHDSACASA-N 1 0 253.773 3.668 20 10 CHCDRO CC[C@H](C)OCC[C@@H](C)[NH2+][C@H](C)c1ccccc1O ZINC001172328841 1132172396 /nfs/dbraw/zinc/17/23/96/1132172396.db2.gz QFMXGXDHTJRTLG-HZSPNIEDSA-N 1 0 265.397 3.637 20 10 CHCDRO COCC[C@@H](C)C[NH2+][C@H](C)c1cc(Cl)cc(C)c1O ZINC000840836238 1132291573 /nfs/dbraw/zinc/29/15/73/1132291573.db2.gz WFBKPPHNFMLGSI-ZYHUDNBSSA-N 1 0 285.815 3.677 20 10 CHCDRO CC1=C[C@H](C)[C@@H](C[N@H+](C)Cc2ccccc2O)CC1 ZINC001208179761 1133899683 /nfs/dbraw/zinc/89/96/83/1133899683.db2.gz BZTRLSXBPHQPQB-LSDHHAIUSA-N 1 0 259.393 3.816 20 10 CHCDRO Cc1cc(C[NH2+]Cc2cc(-c3ccccc3)ccc2O)on1 ZINC000729682802 1125549209 /nfs/dbraw/zinc/54/92/09/1125549209.db2.gz NMDBIEIRFUPSGN-UHFFFAOYSA-N 1 0 294.354 3.645 20 10 CHCDRO Oc1ccccc1C[NH2+]C1CC(c2cccc(F)c2)C1 ZINC000134486048 1125563870 /nfs/dbraw/zinc/56/38/70/1125563870.db2.gz JNVHHLAFOCDLRC-UHFFFAOYSA-N 1 0 271.335 3.567 20 10 CHCDRO Cc1occc1C[NH2+][C@@H](C)c1ccc(Cl)cc1O ZINC000841746854 1125575777 /nfs/dbraw/zinc/57/57/77/1125575777.db2.gz LPQZIZRIBXPOKF-VIFPVBQESA-N 1 0 265.740 3.798 20 10 CHCDRO CSC(C)(C)C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000135385309 1125589029 /nfs/dbraw/zinc/58/90/29/1125589029.db2.gz PLIQVJOOQHZLBG-UHFFFAOYSA-N 1 0 292.492 3.908 20 10 CHCDRO CCC[C@@H](C[NH2+][C@H](C)c1ccc(Cl)cc1O)OC ZINC000841758085 1125598191 /nfs/dbraw/zinc/59/81/91/1125598191.db2.gz RZMFTUYVUZGEIY-PWSUYJOCSA-N 1 0 271.788 3.511 20 10 CHCDRO CCOc1cccc(C[N@@H+]2[C@H](C)CC[C@H]2CC)c1O ZINC000136821670 1125647232 /nfs/dbraw/zinc/64/72/32/1125647232.db2.gz QXRZNKQAVXPVON-TZMCWYRMSA-N 1 0 263.381 3.554 20 10 CHCDRO CC[C@@H]1CC[C@@H](C)[N@@H+]1Cc1cc(Cl)ccc1O ZINC000136819824 1125647748 /nfs/dbraw/zinc/64/77/48/1125647748.db2.gz ANPCJPKVEYGTCG-ZWNOBZJWSA-N 1 0 253.773 3.809 20 10 CHCDRO Cc1ccccc1[C@H](C)[N@H+](C)Cc1ccccc1O ZINC000137278438 1125657840 /nfs/dbraw/zinc/65/78/40/1125657840.db2.gz VVEHKOLCSQTJQO-AWEZNQCLSA-N 1 0 255.361 3.894 20 10 CHCDRO COc1cccc(C[N@H+](C)[C@H](C)c2ccc(F)cc2)c1O ZINC000122184235 1125785319 /nfs/dbraw/zinc/78/53/19/1125785319.db2.gz ZDGUROOHROZSKM-GFCCVEGCSA-N 1 0 289.350 3.733 20 10 CHCDRO CC(C)[N@H+](CCC(F)(F)F)Cc1ccc(N(C)C)cc1 ZINC000741053482 1129427612 /nfs/dbraw/zinc/42/76/12/1129427612.db2.gz JMQPETYBJPLWSQ-UHFFFAOYSA-N 1 0 288.357 3.915 20 10 CHCDRO C[C@@H](F)CC[NH2+][C@@H](C)c1cc(Br)ccc1O ZINC000382155172 1129854977 /nfs/dbraw/zinc/85/49/77/1129854977.db2.gz QZBJXBYRVGLUSW-BDAKNGLRSA-N 1 0 290.176 3.553 20 10 CHCDRO CC1(C)CCC[C@H](C[NH2+]Cc2ccc3c(c2)CCO3)C1 ZINC001649004970 1126735019 /nfs/dbraw/zinc/73/50/19/1126735019.db2.gz KSOSSYDWENDDIG-HNNXBMFYSA-N 1 0 273.420 3.928 20 10 CHCDRO Cc1csc(C(C)(C)[NH2+]Cc2cc(C)c(C)cc2O)n1 ZINC000174403659 1126769825 /nfs/dbraw/zinc/76/98/25/1126769825.db2.gz UBVJSUQMKDVNPE-UHFFFAOYSA-N 1 0 290.432 3.799 20 10 CHCDRO CC[C@@](C)([NH2+]Cc1ccccc1O)c1nc(C)cs1 ZINC000174503548 1126771057 /nfs/dbraw/zinc/77/10/57/1126771057.db2.gz YEBKZYGYMXMULR-OAHLLOKOSA-N 1 0 276.405 3.572 20 10 CHCDRO CCCCC1([NH2+][C@H](C)c2cccc(OC)c2O)CC1 ZINC000903313562 1126801100 /nfs/dbraw/zinc/80/11/00/1126801100.db2.gz TVZDYSVANXXKPV-GFCCVEGCSA-N 1 0 263.381 3.774 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCN(c2ccccc2)C1)c1ccccc1O ZINC000183412609 1126886839 /nfs/dbraw/zinc/88/68/39/1126886839.db2.gz ICCBWRFPHKBHIB-HZPDHXFCSA-N 1 0 296.414 3.569 20 10 CHCDRO C[C@H]([NH2+]CCCNc1ccccc1)c1ccccc1O ZINC000183520134 1126887584 /nfs/dbraw/zinc/88/75/84/1126887584.db2.gz NLXKPPNGZDWPOD-AWEZNQCLSA-N 1 0 270.376 3.545 20 10 CHCDRO COc1cc(C[NH2+][C@H](C)c2ccccc2O)ccc1C ZINC000183460725 1126887736 /nfs/dbraw/zinc/88/77/36/1126887736.db2.gz BIENWIYIVXVTRF-CYBMUJFWSA-N 1 0 271.360 3.560 20 10 CHCDRO C[C@H]([NH2+]C1(c2cccc(F)c2)CC1)c1ccccc1O ZINC000183660787 1126889365 /nfs/dbraw/zinc/88/93/65/1126889365.db2.gz MTCJETSIDVVACB-LBPRGKRZSA-N 1 0 271.335 3.871 20 10 CHCDRO COC(C)(C)C[C@H](C)[NH2+][C@H](C)c1cc(C)ccc1O ZINC000185564283 1126900194 /nfs/dbraw/zinc/90/01/94/1126900194.db2.gz MQONWBZYBFYEOM-QWHCGFSZSA-N 1 0 265.397 3.555 20 10 CHCDRO COCCC1(C[NH2+][C@@H](C)c2cc(C)ccc2O)CCC1 ZINC000185752589 1126902276 /nfs/dbraw/zinc/90/22/76/1126902276.db2.gz PXASRQCCVLOCMX-AWEZNQCLSA-N 1 0 277.408 3.558 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)C[C@H](O)c2ccccc2)c1 ZINC000185833522 1126904017 /nfs/dbraw/zinc/90/40/17/1126904017.db2.gz BDCDYPLDPWECJA-VCBZYWHSSA-N 1 0 299.414 3.863 20 10 CHCDRO CCSc1cc(C[NH2+][C@H](C)c2ccccc2O)ccn1 ZINC000187789586 1126914342 /nfs/dbraw/zinc/91/43/42/1126914342.db2.gz UWOWIGSGFNCVJB-GFCCVEGCSA-N 1 0 288.416 3.750 20 10 CHCDRO CCSc1cc(C[NH2+][C@@H](C)c2ccccc2O)ccn1 ZINC000187789570 1126914813 /nfs/dbraw/zinc/91/48/13/1126914813.db2.gz UWOWIGSGFNCVJB-LBPRGKRZSA-N 1 0 288.416 3.750 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCC[C@@H]1CCO)c1ccc2ccccc2c1O ZINC000187975065 1126917973 /nfs/dbraw/zinc/91/79/73/1126917973.db2.gz QPRHFEQVTDMZFN-JOQOYGCGSA-N 1 0 299.414 3.747 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1C[C@H]1c1cccc(F)c1)c1ccccc1O ZINC000906594273 1126960825 /nfs/dbraw/zinc/96/08/25/1126960825.db2.gz CTSXMOLYWGBIOE-XFBWCDHKSA-N 1 0 271.335 3.738 20 10 CHCDRO CC[N@H+](Cc1ccc(N2CCCC2)cc1)C1CCC1 ZINC001319712676 1126981253 /nfs/dbraw/zinc/98/12/53/1126981253.db2.gz RXEPTUNMFDWPSN-UHFFFAOYSA-N 1 0 258.409 3.661 20 10 CHCDRO C[C@@H](CCc1ccco1)[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC000192945477 1126985762 /nfs/dbraw/zinc/98/57/62/1126985762.db2.gz COPUUKYYQKLSTM-INIZCTEOSA-N 1 0 298.430 3.991 20 10 CHCDRO COc1cccc(C[N@H+](Cc2cccs2)C(C)C)c1O ZINC000271051997 1127067457 /nfs/dbraw/zinc/06/74/57/1127067457.db2.gz AVDLMLYNOASWQQ-UHFFFAOYSA-N 1 0 291.416 3.873 20 10 CHCDRO CC[N@H+](CCc1nccs1)Cc1c(O)cccc1Cl ZINC000271188756 1127072674 /nfs/dbraw/zinc/07/26/74/1127072674.db2.gz OTAONYKOFZWIKP-UHFFFAOYSA-N 1 0 296.823 3.567 20 10 CHCDRO CC[C@H]([NH2+]CC(C)(C)CCCO)c1ccc(N(C)C)cc1 ZINC000271369370 1127076998 /nfs/dbraw/zinc/07/69/98/1127076998.db2.gz GJYSFRZSAYXMEM-KRWDZBQOSA-N 1 0 292.467 3.592 20 10 CHCDRO Cc1nnc([C@H](C)[NH2+][C@H](C)c2ccc(C)c(C)c2O)s1 ZINC000274150157 1127109592 /nfs/dbraw/zinc/10/95/92/1127109592.db2.gz FGJSIUDYEICJOF-MNOVXSKESA-N 1 0 291.420 3.581 20 10 CHCDRO CC(C)(C)c1cc(O)c(O)c(C[NH+]2C3CCC2CC3)c1 ZINC000912787036 1127111871 /nfs/dbraw/zinc/11/18/71/1127111871.db2.gz XTAOXCVAEDEHCK-UHFFFAOYSA-N 1 0 275.392 3.522 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+][C@@H](C)CSC)cc1 ZINC000150985208 1127116699 /nfs/dbraw/zinc/11/66/99/1127116699.db2.gz QIVSUSRABDSWPB-STQMWFEESA-N 1 0 266.454 3.545 20 10 CHCDRO CCCN(Cc1ccc(F)cc1)c1ccc(C[NH3+])cc1 ZINC000034654639 1127117283 /nfs/dbraw/zinc/11/72/83/1127117283.db2.gz VYEJOONHLZLFNQ-UHFFFAOYSA-N 1 0 272.367 3.701 20 10 CHCDRO Oc1ccc(C(F)(F)F)cc1C[N@@H+]1CCCC12CC2 ZINC001237137921 1131056109 /nfs/dbraw/zinc/05/61/09/1131056109.db2.gz RPODUIGSRAUPKM-UHFFFAOYSA-N 1 0 271.282 3.539 20 10 CHCDRO CCCCN(CCCC)c1ccc(C[NH+](C)C)c(O)c1 ZINC001237214145 1131071345 /nfs/dbraw/zinc/07/13/45/1131071345.db2.gz CULXCBVQXNNVDY-UHFFFAOYSA-N 1 0 278.440 3.860 20 10 CHCDRO c1cc(N2CCCCC2)ccc1C[NH2+]C1(C2CC2)CC1 ZINC000760712757 1127205137 /nfs/dbraw/zinc/20/51/37/1127205137.db2.gz LPESLWLZSREPJW-UHFFFAOYSA-N 1 0 270.420 3.709 20 10 CHCDRO C[C@H]1CC(CC[NH2+]Cc2cc(Cl)ccc2O)C[C@H](C)O1 ZINC000801732429 1129217600 /nfs/dbraw/zinc/21/76/00/1129217600.db2.gz KLXQAPISWBBURV-RYUDHWBXSA-N 1 0 297.826 3.729 20 10 CHCDRO Cc1ccnc([C@H](C)[NH2+]Cc2ccc3c(c2)CCCN3C)c1 ZINC000286019601 1127253883 /nfs/dbraw/zinc/25/38/83/1127253883.db2.gz JPPXLXVKSZABLH-HNNXBMFYSA-N 1 0 295.430 3.623 20 10 CHCDRO CS[C@H](C)C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC000168851509 1131187105 /nfs/dbraw/zinc/18/71/05/1131187105.db2.gz FQNYBHXAYCWJAG-IJLUTSLNSA-N 1 0 265.422 3.590 20 10 CHCDRO COC[C@@H]([NH2+]Cc1ccc(N(C)C)c(C)c1)c1ccccc1 ZINC000287675547 1127312201 /nfs/dbraw/zinc/31/22/01/1127312201.db2.gz MLGDCQMKQOACDS-GOSISDBHSA-N 1 0 298.430 3.538 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)C1CCOCC1)c1cccc(Cl)c1[O-] ZINC000287863358 1127314626 /nfs/dbraw/zinc/31/46/26/1127314626.db2.gz XNTOUOWKUYBKMQ-XHDPSFHLSA-N 1 0 297.826 3.901 20 10 CHCDRO COCCC(C)(C)C[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000760894218 1127319246 /nfs/dbraw/zinc/31/92/46/1127319246.db2.gz KCVBADBSHFOUQG-WCQYABFASA-N 1 0 295.398 3.732 20 10 CHCDRO C[C@H]([NH2+]CCC[C@H]1CCCCO1)c1cc(F)cc(F)c1[O-] ZINC000760904262 1127325416 /nfs/dbraw/zinc/32/54/16/1127325416.db2.gz BOTOEXUDUSJQNG-WCQYABFASA-N 1 0 299.361 3.670 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CCC[C@H](SC)C2)cc1C ZINC000227377359 1127475180 /nfs/dbraw/zinc/47/51/80/1127475180.db2.gz XDOGEBVMUCLEHV-CABCVRRESA-N 1 0 279.449 3.767 20 10 CHCDRO C[C@H]([NH2+][C@H](c1ccccc1)[C@@H]1CCOC1)c1ccccc1O ZINC000360697805 1127506750 /nfs/dbraw/zinc/50/67/50/1127506750.db2.gz IYZLLBXHXMBBEW-ZSZQSSIHSA-N 1 0 297.398 3.821 20 10 CHCDRO CCc1noc(C)c1C[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000293746388 1127517579 /nfs/dbraw/zinc/51/75/79/1127517579.db2.gz PVGQEECRBLXMNV-LBPRGKRZSA-N 1 0 288.391 3.719 20 10 CHCDRO C[C@@H](CC[NH2+]Cc1ccc2c(c1)CCO2)c1ccccc1 ZINC000060394185 1127521966 /nfs/dbraw/zinc/52/19/66/1127521966.db2.gz LCUNCJMHXGYXIJ-HNNXBMFYSA-N 1 0 281.399 3.905 20 10 CHCDRO Cc1cc(C[N@@H+](C)[C@@H](C)c2ccncc2)ccc1N(C)C ZINC000293917330 1127533201 /nfs/dbraw/zinc/53/32/01/1127533201.db2.gz XPKNXXCKKRAFDK-HNNXBMFYSA-N 1 0 283.419 3.649 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CC[C@H]3CCC[C@H]3C2)cc1Cl ZINC001231868388 1127544616 /nfs/dbraw/zinc/54/46/16/1127544616.db2.gz UTBHXSWHKGMAAS-OLZOCXBDSA-N 1 0 279.811 3.976 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@H]2CCO[C@@H](C3CC3)C2)c(O)c1 ZINC000294343921 1127566764 /nfs/dbraw/zinc/56/67/64/1127566764.db2.gz PNRDBDTZMOZXHN-JLJPHGGASA-N 1 0 289.419 3.617 20 10 CHCDRO CCC1CC[NH+](Cc2cc(Cl)cc(OC)c2O)CC1 ZINC000228630959 1127576470 /nfs/dbraw/zinc/57/64/70/1127576470.db2.gz PUNNAKZBJAZZOQ-UHFFFAOYSA-N 1 0 283.799 3.676 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]C[C@@H]2CC=CCC2)c1O ZINC000228672711 1127582637 /nfs/dbraw/zinc/58/26/37/1127582637.db2.gz WYIHRJCIJCFEHM-LLVKDONJSA-N 1 0 281.783 3.500 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+][C@H](C)CCC(C)C)c1O ZINC000228668990 1127583039 /nfs/dbraw/zinc/58/30/39/1127583039.db2.gz OGGFJBSBRBFROU-LLVKDONJSA-N 1 0 285.815 3.969 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H](c2ccccc2)[C@H]2CCOC2)c1O ZINC000362043345 1127607897 /nfs/dbraw/zinc/60/78/97/1127607897.db2.gz WVFCTHQQUHUESH-ROUUACIJSA-N 1 0 297.398 3.568 20 10 CHCDRO CCCC[N@H+](CCc1cscn1)Cc1ccccc1O ZINC000295146204 1127623788 /nfs/dbraw/zinc/62/37/88/1127623788.db2.gz FJBRFNKHRUXEJU-UHFFFAOYSA-N 1 0 290.432 3.694 20 10 CHCDRO C[C@@H](CC[NH2+]Cc1ccccc1O)c1ccccc1 ZINC000060942209 1127624826 /nfs/dbraw/zinc/62/48/26/1127624826.db2.gz NVECVHVHNCFRMD-AWEZNQCLSA-N 1 0 255.361 3.676 20 10 CHCDRO FC1(F)CCC([NH2+]Cc2ccc(N3CCCC3)cc2)CC1 ZINC000761336011 1127666839 /nfs/dbraw/zinc/66/68/39/1127666839.db2.gz BXZOQBHJPFCTLI-UHFFFAOYSA-N 1 0 294.389 3.954 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccsc1 ZINC000061361706 1127685919 /nfs/dbraw/zinc/68/59/19/1127685919.db2.gz MMVJRQOKKZSKQH-LLVKDONJSA-N 1 0 259.374 3.534 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]Cc1c(F)cccc1Cl)CC2 ZINC000297909193 1127711760 /nfs/dbraw/zinc/71/17/60/1127711760.db2.gz WNYJMUNZTMJJBH-CQSZACIVSA-N 1 0 291.753 3.962 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]C[C@@H]2CCC[C@@H]2C)c1O ZINC000230659100 1127771761 /nfs/dbraw/zinc/77/17/61/1127771761.db2.gz KPIBWMDBRLKETC-QWRGUYRKSA-N 1 0 283.799 3.580 20 10 CHCDRO CN(C)c1ccc(CN2CCC[C@H]2c2nccs2)cc1 ZINC000374302212 1127887497 /nfs/dbraw/zinc/88/74/97/1127887497.db2.gz NVLKOEOHHQZYTM-HNNXBMFYSA-N 1 0 287.432 3.546 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]CCc2c[nH]c3c2cccc3C)c1 ZINC000174448734 1127893580 /nfs/dbraw/zinc/89/35/80/1127893580.db2.gz YYBDFTNEKWXEQR-UHFFFAOYSA-N 1 0 294.398 3.823 20 10 CHCDRO C[C@@]1(F)CCCN(Cc2cccc(C(F)(F)F)c2O)C1 ZINC001233415954 1127960352 /nfs/dbraw/zinc/96/03/52/1127960352.db2.gz PXGWKIDWWCVCLK-CYBMUJFWSA-N 1 0 291.288 3.735 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cc2ccccc2[nH]1 ZINC000924899454 1128115961 /nfs/dbraw/zinc/11/59/61/1128115961.db2.gz FXTQYUWRBOVJTC-CYBMUJFWSA-N 1 0 292.382 3.954 20 10 CHCDRO C[C@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)[C@H]1C ZINC000252178073 1128129045 /nfs/dbraw/zinc/12/90/45/1128129045.db2.gz PKNQACNRWZBPEN-QWRGUYRKSA-N 1 0 253.773 3.666 20 10 CHCDRO CC[C@@H](COC)[NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1 ZINC000152853341 1128153634 /nfs/dbraw/zinc/15/36/34/1128153634.db2.gz CXXDZBMOECMHOQ-RDJZCZTQSA-N 1 0 290.451 3.753 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCCC2(CCC2)O1)c1ccccc1O ZINC000927016794 1128207970 /nfs/dbraw/zinc/20/79/70/1128207970.db2.gz KZRQOFWMIKXVLQ-UONOGXRCSA-N 1 0 275.392 3.535 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@@H]1CCSC3(CCC3)C1)CC2 ZINC000927039838 1128211201 /nfs/dbraw/zinc/21/12/01/1128211201.db2.gz SSQWVQPEGCKPKC-KGLIPLIRSA-N 1 0 289.444 3.787 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCCc3cccnc32)c1 ZINC000927060369 1128212231 /nfs/dbraw/zinc/21/22/31/1128212231.db2.gz ASPFPMVBLCABBQ-XJKSGUPXSA-N 1 0 282.387 3.824 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCCc3cccnc32)c(O)c1 ZINC000927061484 1128213556 /nfs/dbraw/zinc/21/35/56/1128213556.db2.gz PQLPBKYHQOSFQS-XJKSGUPXSA-N 1 0 282.387 3.824 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@H]2CCCc3cccnc32)c1O ZINC000927064260 1128214047 /nfs/dbraw/zinc/21/40/47/1128214047.db2.gz RJIQJWBQMUHIDR-DOMZBBRYSA-N 1 0 298.386 3.524 20 10 CHCDRO Cc1cc(F)c(C[NH2+][C@@H](C)c2cc(F)ccc2O)c(F)c1 ZINC000927093951 1128216176 /nfs/dbraw/zinc/21/61/76/1128216176.db2.gz OWKKRNLZVYNHPG-JTQLQIEISA-N 1 0 295.304 3.969 20 10 CHCDRO C[C@H]([NH2+]C[C@]1(c2ccccc2)CCCO1)c1ccccc1O ZINC000927114179 1128219252 /nfs/dbraw/zinc/21/92/52/1128219252.db2.gz CSSUIOCKCLRWKO-KXBFYZLASA-N 1 0 297.398 3.749 20 10 CHCDRO C[C@@H]([NH2+]CC[C@H]1OCCc2ccccc21)c1ccccc1O ZINC000927117360 1128219492 /nfs/dbraw/zinc/21/94/92/1128219492.db2.gz UUYDKGCTYXNKHP-AUUYWEPGSA-N 1 0 297.398 3.747 20 10 CHCDRO CC[C@H](c1ccccc1OC)[N@H+](C)Cc1ccccc1O ZINC000777824834 1128288519 /nfs/dbraw/zinc/28/85/19/1128288519.db2.gz HNARFBUSBHDNGF-MRXNPFEDSA-N 1 0 285.387 3.984 20 10 CHCDRO CCC[N@H+](Cc1ccccc1O)[C@H](C)c1snnc1C ZINC000929753965 1128284871 /nfs/dbraw/zinc/28/48/71/1128284871.db2.gz YYISCOIVNGOKDU-GFCCVEGCSA-N 1 0 291.420 3.525 20 10 CHCDRO Cc1c(C[N@@H+]2CCC[C@@H](F)CC2)c2ccccc2n1C ZINC001138252887 1128286141 /nfs/dbraw/zinc/28/61/41/1128286141.db2.gz XCXJKHIUHFOYBE-CQSZACIVSA-N 1 0 274.383 3.811 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCO[C@@H](C(C)C)C2)cc1C(C)C ZINC000777969207 1128352423 /nfs/dbraw/zinc/35/24/23/1128352423.db2.gz OREVNBALUSUXHE-GOSISDBHSA-N 1 0 291.435 3.681 20 10 CHCDRO CCOc1cccc(C[NH2+][C@H]2CCCC[C@H]2CC)c1O ZINC000037032040 1128408149 /nfs/dbraw/zinc/40/81/49/1128408149.db2.gz MPAKLSVJWKMMHE-HIFRSBDPSA-N 1 0 277.408 3.849 20 10 CHCDRO CC(C)[N@@H+](Cc1ccc(N(C)C)cc1)C[C@H]1CCCCO1 ZINC000917074622 1128473894 /nfs/dbraw/zinc/47/38/94/1128473894.db2.gz DCQLMAABACTDNW-GOSISDBHSA-N 1 0 290.451 3.532 20 10 CHCDRO Cc1cccc(C[N@@H+](C)Cc2cc3c(cc2O)CCC3)c1 ZINC000917482472 1128501196 /nfs/dbraw/zinc/50/11/96/1128501196.db2.gz IDATZPSNADDMPN-UHFFFAOYSA-N 1 0 281.399 3.821 20 10 CHCDRO Cc1cc(C[N@@H+](C)Cc2ccc(N(C)C)cc2)cc(C)c1O ZINC000918067422 1128532542 /nfs/dbraw/zinc/53/25/42/1128532542.db2.gz ILINHJRYJGTLAB-UHFFFAOYSA-N 1 0 298.430 3.707 20 10 CHCDRO C[C@H]1CCCC[C@@H]1C[NH2+]Cc1ccc2c(c1)CCO2 ZINC000042859550 1128587817 /nfs/dbraw/zinc/58/78/17/1128587817.db2.gz PREOXHAETZUGAC-XJKSGUPXSA-N 1 0 259.393 3.537 20 10 CHCDRO CC[C@@H]([NH2+]CCN(C)Cc1ccccc1)c1ccccc1O ZINC000155273029 1128604411 /nfs/dbraw/zinc/60/44/11/1128604411.db2.gz DOBMJFXWORDIBX-GOSISDBHSA-N 1 0 298.430 3.565 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CC(C)(C)OC1(C)C)c1ccccc1O ZINC000157881274 1128662980 /nfs/dbraw/zinc/66/29/80/1128662980.db2.gz OATQJUNYPQJBKZ-DZGCQCFKSA-N 1 0 277.408 3.779 20 10 CHCDRO C[N@H+](Cc1ccc(Cl)cc1)Cc1cc(F)ccc1O ZINC000778993977 1128674728 /nfs/dbraw/zinc/67/47/28/1128674728.db2.gz ZQXUTSJZCMSORL-UHFFFAOYSA-N 1 0 279.742 3.817 20 10 CHCDRO COc1cccc(C[C@@H]2CCC[N@@H+]2Cc2ccccc2O)c1 ZINC000779000417 1128675765 /nfs/dbraw/zinc/67/57/65/1128675765.db2.gz VJTRIJDFFQEVOJ-KRWDZBQOSA-N 1 0 297.398 3.608 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CCC[C@H]1c1ccsc1 ZINC000778996983 1128675877 /nfs/dbraw/zinc/67/58/77/1128675877.db2.gz YGFULWCOZSSSEY-AWEZNQCLSA-N 1 0 277.364 3.930 20 10 CHCDRO Cc1cc(Br)cc([C@H](C)[NH2+]C[C@H]2C[C@H]2C)c1O ZINC000779008554 1128677142 /nfs/dbraw/zinc/67/71/42/1128677142.db2.gz RIEOPKAHLLHLJL-DVVUODLYSA-N 1 0 298.224 3.770 20 10 CHCDRO Cc1[nH]c2ccc(C[NH2+]Cc3cc(F)ccc3O)cc2c1C ZINC000779062519 1128713904 /nfs/dbraw/zinc/71/39/04/1128713904.db2.gz WOVLXXLLDAHROE-UHFFFAOYSA-N 1 0 298.361 3.919 20 10 CHCDRO C[C@@H]1C[C@@H]1c1ccc(C[NH2+]Cc2cc(F)ccc2O)o1 ZINC000779065329 1128716470 /nfs/dbraw/zinc/71/64/70/1128716470.db2.gz PDUVMHROXBXODX-YGRLFVJLSA-N 1 0 275.323 3.538 20 10 CHCDRO Cc1ccc2c(CC[NH2+]Cc3cc(F)ccc3O)c[nH]c2c1 ZINC000779067053 1128716726 /nfs/dbraw/zinc/71/67/26/1128716726.db2.gz NGLOLRSZTQECNS-UHFFFAOYSA-N 1 0 298.361 3.653 20 10 CHCDRO c1cc(C[NH2+]C(C2CCC2)C2CCC2)cc2c1OCC2 ZINC000325047060 1117843779 /nfs/dbraw/zinc/84/37/79/1117843779.db2.gz OFVCLFVNSBHUPZ-UHFFFAOYSA-N 1 0 271.404 3.680 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2cccc(C)c2C)c1 ZINC000083411467 1118005251 /nfs/dbraw/zinc/00/52/51/1118005251.db2.gz AIUGDMDPIDKASG-UHFFFAOYSA-N 1 0 255.361 3.607 20 10 CHCDRO C[C@H]1CCCCC[N@@H+]1Cc1cc(Cl)ccc1O ZINC000211433378 1118030019 /nfs/dbraw/zinc/03/00/19/1118030019.db2.gz DVQCITIBAWBIHS-NSHDSACASA-N 1 0 253.773 3.810 20 10 CHCDRO CC(C)(C[NH2+]Cc1cc(F)ccc1O)CC(F)(F)F ZINC000827980839 1118053195 /nfs/dbraw/zinc/05/31/95/1118053195.db2.gz RWLUHMXBNKHVCK-UHFFFAOYSA-N 1 0 279.277 3.600 20 10 CHCDRO C[C@H]1CC[N@H+](Cc2ccc(N3CCCCC3)cc2)C[C@@H]1F ZINC000779151213 1128753414 /nfs/dbraw/zinc/75/34/14/1128753414.db2.gz VSMHNPYEGFYKIQ-YJBOKZPZSA-N 1 0 290.426 3.857 20 10 CHCDRO Oc1ccc2ccncc2c1C[N@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000749976356 1118087259 /nfs/dbraw/zinc/08/72/59/1118087259.db2.gz LHCVHXPHDNPJKH-GASCZTMLSA-N 1 0 282.387 3.562 20 10 CHCDRO Cc1cccc2[nH]cc(CC[NH2+]Cc3ccccc3O)c21 ZINC000237742865 1128756002 /nfs/dbraw/zinc/75/60/02/1128756002.db2.gz WTVGGESYUIMJTN-UHFFFAOYSA-N 1 0 280.371 3.514 20 10 CHCDRO COCCC1(C[NH2+]Cc2cccc(C)c2O)CCCCC1 ZINC000187698246 1128756222 /nfs/dbraw/zinc/75/62/22/1128756222.db2.gz WKCZEYSIEUEETO-UHFFFAOYSA-N 1 0 291.435 3.777 20 10 CHCDRO CC[C@@H]([NH2+]CCCOCC(C)C)c1ccc(N(C)C)cc1 ZINC000764687946 1118107468 /nfs/dbraw/zinc/10/74/68/1118107468.db2.gz SPJMNHKOULDDIJ-GOSISDBHSA-N 1 0 292.467 3.856 20 10 CHCDRO CC[C@@H](C)N(C)CC[NH2+][C@H](C)c1ccc(N(C)CC)cc1 ZINC000765653569 1118187830 /nfs/dbraw/zinc/18/78/30/1118187830.db2.gz BOCUDLJRWPBEGN-HZPDHXFCSA-N 1 0 291.483 3.524 20 10 CHCDRO Oc1ccc(C2=CC[N@H+](Cc3cc(F)ccc3O)CC2)cc1 ZINC000179893878 1128764063 /nfs/dbraw/zinc/76/40/63/1128764063.db2.gz IPHJROYRFOUORD-UHFFFAOYSA-N 1 0 299.345 3.526 20 10 CHCDRO C[C@@H]([NH2+]Cc1coc(-c2ccccc2)n1)c1ccccc1O ZINC000179894553 1128764435 /nfs/dbraw/zinc/76/44/35/1128764435.db2.gz QVUWEMISRQYZPA-CYBMUJFWSA-N 1 0 294.354 3.898 20 10 CHCDRO CCOC(C)(C)C[NH2+][C@@H](C)c1ccc(N(C)CC)cc1 ZINC000188690627 1128764538 /nfs/dbraw/zinc/76/45/38/1128764538.db2.gz XSPRAVLCTJOOAP-AWEZNQCLSA-N 1 0 278.440 3.608 20 10 CHCDRO COc1cccc2c1C[N@H+](Cc1c(C)ccc(C)c1O)CC2 ZINC001140178351 1118242528 /nfs/dbraw/zinc/24/25/28/1118242528.db2.gz JFJQWTNWOHXWMF-UHFFFAOYSA-N 1 0 297.398 3.576 20 10 CHCDRO Cc1ccc(C)c(C[NH+]2CC(c3ccccc3)C2)c1O ZINC001140182489 1118250637 /nfs/dbraw/zinc/25/06/37/1118250637.db2.gz RYDGXJZAFPDEMY-UHFFFAOYSA-N 1 0 267.372 3.608 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCC[C@H]2c2nccs2)c1O ZINC001140182745 1118250762 /nfs/dbraw/zinc/25/07/62/1118250762.db2.gz YTFOSIMJNIYQLO-AWEZNQCLSA-N 1 0 288.416 3.803 20 10 CHCDRO COc1ccccc1C[C@H](C)[N@H+](C)Cc1cccc(C)c1O ZINC000317254269 1118251758 /nfs/dbraw/zinc/25/17/58/1118251758.db2.gz KXYFYWDJTKZTIS-HNNXBMFYSA-N 1 0 299.414 3.772 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC000147937283 1118254567 /nfs/dbraw/zinc/25/45/67/1118254567.db2.gz HIKMRWYGWQHMHI-GASCZTMLSA-N 1 0 267.372 3.777 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1cc(F)ccc1O)c1c(C)noc1C ZINC000186187578 1118291834 /nfs/dbraw/zinc/29/18/34/1118291834.db2.gz NTLVJJDHVCFSHH-XPTSAGLGSA-N 1 0 292.354 3.938 20 10 CHCDRO C[C@@H]1CC([NH2+]Cc2ccc3c(c2)CCO3)C[C@@H](C)C1 ZINC000084461596 1118360047 /nfs/dbraw/zinc/36/00/47/1118360047.db2.gz GJEFQHRUAAZIJL-STQMWFEESA-N 1 0 259.393 3.536 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H]2CCc3cccc(O)c32)cc1F ZINC000834496376 1118399701 /nfs/dbraw/zinc/39/97/01/1118399701.db2.gz FUJUIDGZYMWFHL-OAHLLOKOSA-N 1 0 271.335 3.617 20 10 CHCDRO COc1ccc(C[NH2+]Cc2ccc(F)cc2F)cc1C ZINC000050198598 1118443305 /nfs/dbraw/zinc/44/33/05/1118443305.db2.gz FLFGPMGQJRPDMV-UHFFFAOYSA-N 1 0 277.314 3.572 20 10 CHCDRO Cc1ccc(O)c(C[N@H+](C)Cc2ccccc2C)c1 ZINC000160526305 1118469402 /nfs/dbraw/zinc/46/94/02/1118469402.db2.gz OVGRXAMUBSCPJK-UHFFFAOYSA-N 1 0 255.361 3.641 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CC[C@H](CC(C)C)C2)c1O ZINC000307782521 1118528378 /nfs/dbraw/zinc/52/83/78/1118528378.db2.gz VRAXMJZOBILRKY-CQSZACIVSA-N 1 0 277.408 3.659 20 10 CHCDRO CC[C@H]([NH2+]CC1(OC)CCCC1)c1ccc(C)cc1O ZINC000834815406 1118571428 /nfs/dbraw/zinc/57/14/28/1118571428.db2.gz VKIRDWTXJMTNHA-HNNXBMFYSA-N 1 0 277.408 3.701 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)CCc2ccncc2)cc1 ZINC000177999377 1118594819 /nfs/dbraw/zinc/59/48/19/1118594819.db2.gz CDFBLBYTGDIMMU-UHFFFAOYSA-N 1 0 297.446 3.602 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@@H+]2CCC[C@H]2C2CCC2)c1 ZINC000754727439 1118646656 /nfs/dbraw/zinc/64/66/56/1118646656.db2.gz VTEOQAGEYZIZLC-INIZCTEOSA-N 1 0 259.393 3.774 20 10 CHCDRO C[C@H]([NH2+]C/C=C\c1ccccc1)c1ccccc1O ZINC000588424097 1118667587 /nfs/dbraw/zinc/66/75/87/1118667587.db2.gz WDVPTBKWXMSDLB-YHAOYDPOSA-N 1 0 253.345 3.756 20 10 CHCDRO CCOCC[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000161894812 1118697509 /nfs/dbraw/zinc/69/75/09/1118697509.db2.gz QHRMMFWHCHQZFM-AWEZNQCLSA-N 1 0 294.414 3.503 20 10 CHCDRO CC(C)([NH2+]Cc1cc(F)ccc1O)c1ccc(F)cc1 ZINC000180618828 1128800272 /nfs/dbraw/zinc/80/02/72/1128800272.db2.gz SFRTWDWWJMDNKV-UHFFFAOYSA-N 1 0 277.314 3.695 20 10 CHCDRO CCC[N@@H+](Cc1ccccc1O)C[C@@H](COC)C(C)C ZINC001167522278 1118987071 /nfs/dbraw/zinc/98/70/71/1118987071.db2.gz XEZFVJMAGHEJDY-INIZCTEOSA-N 1 0 279.424 3.523 20 10 CHCDRO CC[C@]1(C)C[N@H+](Cc2c(O)ccc3ccccc32)CCO1 ZINC000190348359 1128818682 /nfs/dbraw/zinc/81/86/82/1128818682.db2.gz LKAFLFXWPJPDOC-GOSISDBHSA-N 1 0 285.387 3.546 20 10 CHCDRO COc1ccc(C[NH2+]CCc2cc(F)cc(F)c2)cc1C ZINC000051634519 1119061118 /nfs/dbraw/zinc/06/11/18/1119061118.db2.gz LNPOWNCZMZEZPK-UHFFFAOYSA-N 1 0 291.341 3.614 20 10 CHCDRO COc1ccc(C[NH2+]CCCOc2ccccc2)cc1C ZINC000049943347 1119133093 /nfs/dbraw/zinc/13/30/93/1119133093.db2.gz QSNVWPKFZODCOK-UHFFFAOYSA-N 1 0 285.387 3.562 20 10 CHCDRO CC[N@H+](Cc1cc(F)ccc1O)C1CCCCC1 ZINC000226561425 1119156998 /nfs/dbraw/zinc/15/69/98/1119156998.db2.gz WQNILIBWBGVECM-UHFFFAOYSA-N 1 0 251.345 3.686 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]Cc1ccc(Cl)s1 ZINC000226583679 1119209666 /nfs/dbraw/zinc/20/96/66/1119209666.db2.gz KJANNBYCDYNXSB-UHFFFAOYSA-N 1 0 271.744 3.536 20 10 CHCDRO C[N@H+](Cc1ccccc1O)Cc1ccccc1N1CCCC1 ZINC000120061156 1119229328 /nfs/dbraw/zinc/22/93/28/1119229328.db2.gz ZPYHVIDTNRNFOK-UHFFFAOYSA-N 1 0 296.414 3.624 20 10 CHCDRO CC1(C)CC([NH3+])CC(C)(C)N1c1ccc2c(c1)C=CC2 ZINC001167625588 1119232266 /nfs/dbraw/zinc/23/22/66/1119232266.db2.gz WGYYATIDWGBXSA-UHFFFAOYSA-N 1 0 270.420 3.741 20 10 CHCDRO CO/C=C/c1ccc(N2C(C)(C)CC([NH3+])CC2(C)C)cc1 ZINC001167626483 1119235661 /nfs/dbraw/zinc/23/56/61/1119235661.db2.gz LAOJMWYYFMXUHU-ZHACJKMWSA-N 1 0 288.435 3.788 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCCC3(CC(F)C3)CC2)c1 ZINC001140622925 1119292676 /nfs/dbraw/zinc/29/26/76/1119292676.db2.gz HPNRSMNYCWBYOU-UHFFFAOYSA-N 1 0 277.383 3.805 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccc(C)nc1)c1ccc(N(C)C)cc1 ZINC000161587861 1119314786 /nfs/dbraw/zinc/31/47/86/1119314786.db2.gz QUMBVQIJTHXWHU-LJQANCHMSA-N 1 0 297.446 3.739 20 10 CHCDRO C[C@@H]([NH2+]CCCC(F)(F)F)c1cc(F)ccc1O ZINC000148593163 1119336637 /nfs/dbraw/zinc/33/66/37/1119336637.db2.gz UEYPGXGIPPAGKK-MRVPVSSYSA-N 1 0 265.250 3.524 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(F)cc1F)c1ccccc1O ZINC000051016631 1119361207 /nfs/dbraw/zinc/36/12/07/1119361207.db2.gz NNVOXZQVEWQXNX-JTQLQIEISA-N 1 0 263.287 3.521 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+][C@H]1CCCSC1 ZINC000252806155 1119445130 /nfs/dbraw/zinc/44/51/30/1119445130.db2.gz GSEQTXFDZZPBCO-AGIUHOORSA-N 1 0 277.433 3.734 20 10 CHCDRO C[C@@H]1CCC[C@@H](C[NH2+]Cc2ccc3c(c2)CCO3)C1 ZINC000219471014 1119472191 /nfs/dbraw/zinc/47/21/91/1119472191.db2.gz BJSBRMLGPDMRTL-ZIAGYGMSSA-N 1 0 259.393 3.537 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCCOc2ccccc2)c1 ZINC000052092054 1119781285 /nfs/dbraw/zinc/78/12/85/1119781285.db2.gz RBKROHKNCKBFIE-HNNXBMFYSA-N 1 0 285.387 3.820 20 10 CHCDRO CCSCC[C@@H](C)[NH2+][C@H](C)c1ccccc1O ZINC000167455490 1120080584 /nfs/dbraw/zinc/08/05/84/1120080584.db2.gz BQLBDTATNNGIHP-VXGBXAGGSA-N 1 0 253.411 3.575 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCCC(F)(F)C1)c1ccc(N(C)C)cc1 ZINC000695064581 1120099639 /nfs/dbraw/zinc/09/96/39/1120099639.db2.gz GFBUNNTUYVMQFH-GXTWGEPZSA-N 1 0 282.378 3.981 20 10 CHCDRO CCC[N@H+](CCc1scnc1C)Cc1ccccc1O ZINC000172532252 1120104136 /nfs/dbraw/zinc/10/41/36/1120104136.db2.gz HXWSEDOQTUJPIN-UHFFFAOYSA-N 1 0 290.432 3.612 20 10 CHCDRO CCc1ccc(C[N@H+](CC)Cc2ccccc2)c(O)c1 ZINC001236783722 1128890778 /nfs/dbraw/zinc/89/07/78/1128890778.db2.gz OKZDOUKLSYFWBJ-UHFFFAOYSA-N 1 0 269.388 3.977 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CC[C@H](C)[C@H](C)C2)c1 ZINC000251911110 1128891180 /nfs/dbraw/zinc/89/11/80/1128891180.db2.gz UALMBNTYYISJFD-RFQIPJPRSA-N 1 0 277.408 3.876 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]CCc1ccc(Cl)s1)CC2 ZINC000311847780 1120113445 /nfs/dbraw/zinc/11/34/45/1120113445.db2.gz IOLFBJYLTHVMLK-LBPRGKRZSA-N 1 0 293.819 3.927 20 10 CHCDRO C[C@H]([NH2+]CC(C)(C)C)c1ccc(Br)cc1O ZINC000309567317 1120127508 /nfs/dbraw/zinc/12/75/08/1120127508.db2.gz MNJYOSSKINSQGJ-VIFPVBQESA-N 1 0 286.213 3.851 20 10 CHCDRO COc1cc(O)c(C[NH+]2[C@@H](C)CCC[C@@H]2C)c(Cl)c1 ZINC001236801206 1128893901 /nfs/dbraw/zinc/89/39/01/1128893901.db2.gz BQEXIUUCZYJYHL-QWRGUYRKSA-N 1 0 283.799 3.817 20 10 CHCDRO Cc1ccc(C[NH+]2CCC3(CC[C@@H](F)C3)CC2)c(O)c1 ZINC001140957739 1120148847 /nfs/dbraw/zinc/14/88/47/1120148847.db2.gz MDGQOMVPXCFSGF-OAHLLOKOSA-N 1 0 277.383 3.805 20 10 CHCDRO CC(C)n1cc([C@H](C)[NH2+]Cc2ccc3c(c2)CCCO3)cn1 ZINC000921734840 1120179227 /nfs/dbraw/zinc/17/92/27/1120179227.db2.gz IEUZEKRIBDTTNW-AWEZNQCLSA-N 1 0 299.418 3.640 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CC2(c3ccccn3)CCC2)c1 ZINC000367608210 1120195513 /nfs/dbraw/zinc/19/55/13/1120195513.db2.gz QTHUOAIIJUQAEM-OAHLLOKOSA-N 1 0 296.414 3.868 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(C)c(C)c2)c1 ZINC000191031857 1128899770 /nfs/dbraw/zinc/89/97/70/1128899770.db2.gz MIWAKFKYOCVLTC-AWEZNQCLSA-N 1 0 285.387 3.868 20 10 CHCDRO CCOc1cccc(C[N@H+](CC)[C@H](C)C(C)C)c1O ZINC000092590300 1120221637 /nfs/dbraw/zinc/22/16/37/1120221637.db2.gz WDQKQEFKBCHAEK-CYBMUJFWSA-N 1 0 265.397 3.657 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1Cc2cccc(Cl)c2C1)c1ccccc1O ZINC001168690241 1120256149 /nfs/dbraw/zinc/25/61/49/1120256149.db2.gz KKIPHXCLSWICIA-DGCLKSJQSA-N 1 0 287.790 3.864 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCS[C@H]3CCCC[C@@H]32)c1O ZINC000180483207 1120276682 /nfs/dbraw/zinc/27/66/82/1120276682.db2.gz CXDJOSOZUFFGEP-GJZGRUSLSA-N 1 0 277.433 3.561 20 10 CHCDRO Cc1nc(C)c(C[NH2+][C@@H](C)c2cc(C)ccc2O)s1 ZINC000312100533 1120294762 /nfs/dbraw/zinc/29/47/62/1120294762.db2.gz UHCULCIUOIMAQU-JTQLQIEISA-N 1 0 276.405 3.625 20 10 CHCDRO CCc1ccc(C[NH2+][C@H](C)c2ccccc2O)s1 ZINC000183419655 1120341451 /nfs/dbraw/zinc/34/14/51/1120341451.db2.gz OSXDJFOVYVZLMZ-LLVKDONJSA-N 1 0 261.390 3.867 20 10 CHCDRO FC1(F)CC[C@H](C[NH2+]Cc2ccc3c(c2)CCCO3)C1 ZINC000922085253 1120358404 /nfs/dbraw/zinc/35/84/04/1120358404.db2.gz PVLDEYLCUGYUQE-ZDUSSCGKSA-N 1 0 281.346 3.537 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CCC3(CCCC3)C2)c1O ZINC000312447195 1120426800 /nfs/dbraw/zinc/42/68/00/1120426800.db2.gz CDVPYRFBKAHZDG-UHFFFAOYSA-N 1 0 295.810 3.820 20 10 CHCDRO Cc1ccccc1CC[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000312458676 1120429992 /nfs/dbraw/zinc/42/99/92/1120429992.db2.gz ADPBHBMPFBJENH-MRXNPFEDSA-N 1 0 267.372 3.520 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](C)c1ccccn1)c1ccccc1O ZINC000692692682 1120488396 /nfs/dbraw/zinc/48/83/96/1120488396.db2.gz VFRACNDNDPZGNR-HIFRSBDPSA-N 1 0 270.376 3.632 20 10 CHCDRO CC[C@@H]([NH2+]CC1(CC)CCOCC1)c1ccccc1O ZINC000312625780 1120495464 /nfs/dbraw/zinc/49/54/64/1120495464.db2.gz BICWCTPYHZKJLD-OAHLLOKOSA-N 1 0 277.408 3.640 20 10 CHCDRO CC(C)SCC[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000310978441 1120507361 /nfs/dbraw/zinc/50/73/61/1120507361.db2.gz XHNCXWNSIBWOOT-CYBMUJFWSA-N 1 0 266.454 3.545 20 10 CHCDRO Cc1cnc(Cl)c(C[NH2+][C@H](C)c2ccccc2O)c1 ZINC000922328275 1120515923 /nfs/dbraw/zinc/51/59/23/1120515923.db2.gz ALIUWBRUOUSKTC-LLVKDONJSA-N 1 0 276.767 3.600 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCc2ccccc21)c1cc(F)ccc1O ZINC000756562054 1120522948 /nfs/dbraw/zinc/52/29/48/1120522948.db2.gz FDLFNUPBRMQHTJ-OCCSQVGLSA-N 1 0 285.362 3.912 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2c(O)ccc3ccccc32)CCS1 ZINC000191666167 1120525657 /nfs/dbraw/zinc/52/56/57/1120525657.db2.gz NVIOGKCEZQTWRY-CYBMUJFWSA-N 1 0 287.428 3.873 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(F)cc1)c1ccccc1O ZINC000019943903 1120552834 /nfs/dbraw/zinc/55/28/34/1120552834.db2.gz CJRWCCYTZLXJLR-HNNXBMFYSA-N 1 0 259.324 3.772 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H](c2ccccn2)C2CC2)cc1C ZINC000922586054 1120558803 /nfs/dbraw/zinc/55/88/03/1120558803.db2.gz JUDWPCLBCXNVSC-GOSISDBHSA-N 1 0 282.387 3.645 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1[C@@H]2CCCO[C@@H]2C1(C)C)c1ccccc1O ZINC000364363105 1120567846 /nfs/dbraw/zinc/56/78/46/1120567846.db2.gz NFNXGWYUKADYFJ-DIECFANBSA-N 1 0 289.419 3.637 20 10 CHCDRO COc1ccc([C@H](C)[NH2+]Cc2ccccc2O)cc1C ZINC000922672061 1120575007 /nfs/dbraw/zinc/57/50/07/1120575007.db2.gz KQCNDAAJTYBORA-ZDUSSCGKSA-N 1 0 271.360 3.560 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CC2(SC)CC2)cc1 ZINC000193825978 1120584476 /nfs/dbraw/zinc/58/44/76/1120584476.db2.gz HIDBXBTVWXUTPY-CYBMUJFWSA-N 1 0 278.465 3.689 20 10 CHCDRO Cc1cc(O)c(C[NH2+]Cc2ccc3c(c2)C[C@@H](C)O3)cc1C ZINC000922702694 1120585036 /nfs/dbraw/zinc/58/50/36/1120585036.db2.gz OPQAMLBIVGEPCY-CQSZACIVSA-N 1 0 297.398 3.622 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]CC2C(C)(C)C2(C)C)c1O ZINC000229053091 1120599156 /nfs/dbraw/zinc/59/91/56/1120599156.db2.gz NLKKAVUPJIATGG-UHFFFAOYSA-N 1 0 297.826 3.826 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H]2CCSC3(CCC3)C2)cc1C ZINC000922844884 1120612675 /nfs/dbraw/zinc/61/26/75/1120612675.db2.gz IFIKRKWELLIPHE-OAHLLOKOSA-N 1 0 291.460 3.917 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H]2CCCc3cccnc32)cc1C ZINC000922882529 1120618772 /nfs/dbraw/zinc/61/87/72/1120618772.db2.gz UDKHKCUQEWUFDV-INIZCTEOSA-N 1 0 282.387 3.571 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CSC2(C)C)cc1 ZINC000393846826 1120621549 /nfs/dbraw/zinc/62/15/49/1120621549.db2.gz AESJZUBGGQMFQL-OAHLLOKOSA-N 1 0 278.465 3.516 20 10 CHCDRO CSCCCCC[NH2+][C@H](C)c1cc(C)ccc1O ZINC000186777189 1120666984 /nfs/dbraw/zinc/66/69/84/1120666984.db2.gz KDPGDCSRMDAUIH-CYBMUJFWSA-N 1 0 267.438 3.885 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@H](C)Cc1cccs1 ZINC000766027965 1120671084 /nfs/dbraw/zinc/67/10/84/1120671084.db2.gz BSXLFXZIMGKFAR-CQSZACIVSA-N 1 0 288.460 3.843 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCOCC2CCCC2)c(O)c1 ZINC000313299081 1120706491 /nfs/dbraw/zinc/70/64/91/1120706491.db2.gz NDERGAWVHBZZHL-AWEZNQCLSA-N 1 0 277.408 3.558 20 10 CHCDRO COc1cccc(C[N@@H+]2[C@H](C)C[C@H]3CCCC[C@@H]32)c1O ZINC000093383565 1120797001 /nfs/dbraw/zinc/79/70/01/1120797001.db2.gz GHZOTOPTAGAWBR-NFAWXSAZSA-N 1 0 275.392 3.554 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CC[C@@H](C)C[C@@H]2C)cc1C ZINC000070111895 1128941502 /nfs/dbraw/zinc/94/15/02/1128941502.db2.gz ATWBKMRBXNDJMR-DVOMOZLQSA-N 1 0 261.409 3.918 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCc3cccc(C)c3C2)c1O ZINC000763509072 1128941650 /nfs/dbraw/zinc/94/16/50/1128941650.db2.gz XLPHDGRGLKJAEF-UHFFFAOYSA-N 1 0 297.398 3.658 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2ccc(C)c(C)n2)c1 ZINC000314352811 1120932618 /nfs/dbraw/zinc/93/26/18/1120932618.db2.gz WIASFLMRXAYCAW-CQSZACIVSA-N 1 0 270.376 3.563 20 10 CHCDRO Cc1ccccc1CC[NH2+][C@@H](C)c1ccccc1O ZINC000094182665 1120980179 /nfs/dbraw/zinc/98/01/79/1120980179.db2.gz UIGCJAVNVXCHQE-AWEZNQCLSA-N 1 0 255.361 3.594 20 10 CHCDRO Oc1ccccc1C[N@@H+](Cc1ccccc1)C[C@@H]1CCCO1 ZINC000078680581 1128955094 /nfs/dbraw/zinc/95/50/94/1128955094.db2.gz RXFRELYLZWRFOJ-SFHVURJKSA-N 1 0 297.398 3.573 20 10 CHCDRO CCCC[N@H+](Cc1ccccc1O)[C@@H](C)c1cnccn1 ZINC000282498666 1121033776 /nfs/dbraw/zinc/03/37/76/1121033776.db2.gz QQIIYRFRTSHYLN-AWEZNQCLSA-N 1 0 285.391 3.546 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C[C@H]2CCc3ccccc3C2)c1 ZINC000773425783 1121090118 /nfs/dbraw/zinc/09/01/18/1121090118.db2.gz CXMBACHYTAXKOE-HNNXBMFYSA-N 1 0 281.399 3.595 20 10 CHCDRO COCc1cccc(C[NH2+][C@H](C)c2ccc(C)cc2O)c1 ZINC000038010616 1121094288 /nfs/dbraw/zinc/09/42/88/1121094288.db2.gz SWXZPZKGBYEGPY-CQSZACIVSA-N 1 0 285.387 3.698 20 10 CHCDRO CCc1cnccc1[C@@H](C)[NH2+]Cc1ccc(OC)c(C)c1 ZINC000773427432 1121098662 /nfs/dbraw/zinc/09/86/62/1121098662.db2.gz LWBNPTWBCOBMAV-CQSZACIVSA-N 1 0 284.403 3.812 20 10 CHCDRO C[C@@H](c1ccccc1)N1CCCc2cc(C[NH3+])ccc21 ZINC000700868255 1121124967 /nfs/dbraw/zinc/12/49/67/1121124967.db2.gz OIDVRTQBGVNCJO-AWEZNQCLSA-N 1 0 266.388 3.659 20 10 CHCDRO CN(C)c1ccc(C[NH2+]Cc2ccc3cnccc3c2)cc1 ZINC000318661739 1121130839 /nfs/dbraw/zinc/13/08/39/1121130839.db2.gz HZGJDYRIBLKVGY-UHFFFAOYSA-N 1 0 291.398 3.591 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)C2CCCC2)c1 ZINC000070305438 1128966636 /nfs/dbraw/zinc/96/66/36/1128966636.db2.gz GNVKTZMWQSMXCT-NWDGAFQWSA-N 1 0 263.381 3.630 20 10 CHCDRO CS[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)c1ccccc1O ZINC000228794005 1121191994 /nfs/dbraw/zinc/19/19/94/1121191994.db2.gz UZNYOWUOIKXXCT-NJZAAPMLSA-N 1 0 265.422 3.717 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+][C@H](C)c2ccccc2C)c1 ZINC000236851351 1121221774 /nfs/dbraw/zinc/22/17/74/1121221774.db2.gz UYWLRNMLHFYOFC-CQSZACIVSA-N 1 0 285.387 3.950 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc3c(c2)CCO3)cc1F ZINC000094952896 1121247704 /nfs/dbraw/zinc/24/77/04/1121247704.db2.gz MLKZVUCOUNMNMN-ZDUSSCGKSA-N 1 0 285.362 3.920 20 10 CHCDRO COc1ccc(N2CCC([NH2+]C[C@@H](C)C(C)C)CC2)cc1 ZINC000766113548 1121266032 /nfs/dbraw/zinc/26/60/32/1121266032.db2.gz OCNPWPQPPYPPAB-OAHLLOKOSA-N 1 0 290.451 3.546 20 10 CHCDRO CC(C)CC[C@@](C)(O)C[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000766128972 1121291459 /nfs/dbraw/zinc/29/14/59/1121291459.db2.gz NPDDBPXJPHWFQA-MAUKXSAKSA-N 1 0 292.467 3.590 20 10 CHCDRO CC[C@H](C)[C@@H](C)[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1 ZINC000178604723 1121360494 /nfs/dbraw/zinc/36/04/94/1121360494.db2.gz YZYVBURMFKCHCN-XHSDSOJGSA-N 1 0 290.451 3.608 20 10 CHCDRO CCc1ccc(C(C)(C)[NH2+]Cc2cc(OC)ccc2O)cc1 ZINC000182565451 1128984372 /nfs/dbraw/zinc/98/43/72/1128984372.db2.gz IYBVDYVJNHIQIM-UHFFFAOYSA-N 1 0 299.414 3.988 20 10 CHCDRO Oc1ccc(Br)cc1C[NH2+][C@H]1CCCC12CC2 ZINC000706932471 1121446590 /nfs/dbraw/zinc/44/65/90/1121446590.db2.gz BEPORTMFYKTNMR-ZDUSSCGKSA-N 1 0 296.208 3.577 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCCC23CC3)c1 ZINC000707043756 1121448483 /nfs/dbraw/zinc/44/84/83/1121448483.db2.gz PUVYQDSSYBTGGJ-STQMWFEESA-N 1 0 275.392 3.632 20 10 CHCDRO C[C@H](CC1CCC1)[NH2+]Cc1cc(Br)ccc1O ZINC000710188618 1121474484 /nfs/dbraw/zinc/47/44/84/1121474484.db2.gz FZOCPHSDEJVEAY-SNVBAGLBSA-N 1 0 298.224 3.823 20 10 CHCDRO Cc1cc(Nc2c(O)cccc2C(F)(F)F)cc(C)[nH+]1 ZINC001176057329 1121543437 /nfs/dbraw/zinc/54/34/37/1121543437.db2.gz NBQBSOMUGLHBRQ-UHFFFAOYSA-N 1 0 282.265 3.588 20 10 CHCDRO CCO[C@H]1C[C@@H]([NH2+]Cc2cc(C)ccc2O)C12CCCC2 ZINC000236974319 1121568653 /nfs/dbraw/zinc/56/86/53/1121568653.db2.gz ZZWAYNSHEZNTNE-SJORKVTESA-N 1 0 289.419 3.528 20 10 CHCDRO CCCC[N@H+](Cc1ccncc1)Cc1ccccc1O ZINC000282547274 1121589384 /nfs/dbraw/zinc/58/93/84/1121589384.db2.gz WQLLGPOOZXCSMD-UHFFFAOYSA-N 1 0 270.376 3.590 20 10 CHCDRO COCCC[NH2+][C@@H](C)c1ccc(N2CCCCC2)c(F)c1 ZINC000020550955 1121698805 /nfs/dbraw/zinc/69/88/05/1121698805.db2.gz IIZIOAWKJKCNTF-AWEZNQCLSA-N 1 0 294.414 3.503 20 10 CHCDRO COc1ccc(C[NH2+]C2CCC(F)(F)CC2)cc1C ZINC000688499236 1129003874 /nfs/dbraw/zinc/00/38/74/1129003874.db2.gz IJEMSXKJJRHCDY-UHFFFAOYSA-N 1 0 269.335 3.671 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C2CCC(F)(F)CC2)c(O)c1 ZINC000688499271 1129003945 /nfs/dbraw/zinc/00/39/45/1129003945.db2.gz INVPTEGQTVLYTE-LLVKDONJSA-N 1 0 269.335 3.929 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C2CCC(F)(F)CC2)c(O)c1 ZINC000688499272 1129003957 /nfs/dbraw/zinc/00/39/57/1129003957.db2.gz INVPTEGQTVLYTE-NSHDSACASA-N 1 0 269.335 3.929 20 10 CHCDRO COc1cc(C)cc(C[NH2+]Cc2ccc(C)cc2C)c1O ZINC000894192192 1121729352 /nfs/dbraw/zinc/72/93/52/1121729352.db2.gz YZKFECRHKFWNPM-UHFFFAOYSA-N 1 0 285.387 3.616 20 10 CHCDRO CSC1CC[NH+](Cc2c(O)cc(C)cc2Cl)CC1 ZINC000877662961 1121737861 /nfs/dbraw/zinc/73/78/61/1121737861.db2.gz AVCNLMUUQLYZKW-UHFFFAOYSA-N 1 0 285.840 3.681 20 10 CHCDRO CCCC(C)(C)[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC001177683332 1121745132 /nfs/dbraw/zinc/74/51/32/1121745132.db2.gz AWCOKJKFMIBBTH-FPLPWBNLSA-N 1 0 260.425 3.934 20 10 CHCDRO CCC[N@H+](CCc1ccccc1)Cc1ccccc1O ZINC000727831338 1121750158 /nfs/dbraw/zinc/75/01/58/1121750158.db2.gz WVAFWTOYZIEUPI-UHFFFAOYSA-N 1 0 269.388 3.847 20 10 CHCDRO CCO[C@@H](CC[NH2+]Cc1c(O)cc(C)cc1Cl)C(C)C ZINC001177942942 1121759369 /nfs/dbraw/zinc/75/93/69/1121759369.db2.gz KFTQFJPVOCEULT-INIZCTEOSA-N 1 0 299.842 3.895 20 10 CHCDRO CCN(C)c1ccc(C[N@H+](C)Cc2ccc(C)o2)cc1 ZINC000773734901 1121774026 /nfs/dbraw/zinc/77/40/26/1121774026.db2.gz SQZTWWYDCUUXDB-UHFFFAOYSA-N 1 0 272.392 3.676 20 10 CHCDRO C[C@]1([NH2+]Cc2ccc3c(c2)CCCO3)CC=CCC1 ZINC001178930804 1121828203 /nfs/dbraw/zinc/82/82/03/1121828203.db2.gz HOADPJHNKKLRCT-KRWDZBQOSA-N 1 0 257.377 3.600 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@@H]2C[C@@H]3CC[C@@H](C3)C2)c1 ZINC001179054228 1121843707 /nfs/dbraw/zinc/84/37/07/1121843707.db2.gz SGWLJJBQWGWVTL-YIYPIFLZSA-N 1 0 275.392 3.630 20 10 CHCDRO COc1cc(C[NH2+][C@]2(C)CC2(C)C)c(O)c(C(C)(C)C)c1 ZINC001179217250 1121859318 /nfs/dbraw/zinc/85/93/18/1121859318.db2.gz XIETYXQVOFODHA-GOSISDBHSA-N 1 0 291.435 3.977 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C[C@H]2C(C)(C)C2(F)F)cc1 ZINC001179228219 1121861321 /nfs/dbraw/zinc/86/13/21/1121861321.db2.gz FMGHDNAAULZMSR-HNNXBMFYSA-N 1 0 296.405 3.914 20 10 CHCDRO Cc1ccc(-c2n[nH]cc2C[NH2+][C@H](C)c2ccccc2O)o1 ZINC001179489801 1121882857 /nfs/dbraw/zinc/88/28/57/1121882857.db2.gz VQISXHCGJLTTTI-GFCCVEGCSA-N 1 0 297.358 3.535 20 10 CHCDRO CC[C@H](CSC)[N@H+](C)Cc1ccc(N(C)CC)cc1 ZINC000773816289 1121883060 /nfs/dbraw/zinc/88/30/60/1121883060.db2.gz FQBJAPUKGIKOSN-OAHLLOKOSA-N 1 0 280.481 3.716 20 10 CHCDRO CC(C)(C)OCC[N@H+](Cc1ccccc1O)C1CCCC1 ZINC000731847683 1121887279 /nfs/dbraw/zinc/88/72/79/1121887279.db2.gz MEPSXXIMSVLHHM-UHFFFAOYSA-N 1 0 291.435 3.952 20 10 CHCDRO CCCOc1ccc(C[NH2+]C[C@@H](COC)C(C)C)cc1C ZINC001179661792 1121895226 /nfs/dbraw/zinc/89/52/26/1121895226.db2.gz ABONBIZXSLKXBO-KRWDZBQOSA-N 1 0 293.451 3.792 20 10 CHCDRO CC1(C)CC[C@H](CC[NH2+]Cc2c(O)cccc2Cl)OC1 ZINC001179685394 1121899045 /nfs/dbraw/zinc/89/90/45/1121899045.db2.gz LUDXYLIGKTVHSQ-GFCCVEGCSA-N 1 0 297.826 3.731 20 10 CHCDRO COc1cc(C)c(C[NH+]2C3CCCC2CCC3)c(O)c1 ZINC001179877161 1121924101 /nfs/dbraw/zinc/92/41/01/1121924101.db2.gz AIGWFAIBMWSWCL-UHFFFAOYSA-N 1 0 275.392 3.616 20 10 CHCDRO CC(C)c1ccc(O)c(C[N@@H+]2CC[C@@H]3OCCC[C@@H]3C2)c1 ZINC001180203731 1121961773 /nfs/dbraw/zinc/96/17/73/1121961773.db2.gz YJCBLTKYXIITKB-QAPCUYQASA-N 1 0 289.419 3.517 20 10 CHCDRO CN(C)c1ccc(C[NH2+]CC2(C)CCCC2)cc1F ZINC000733328160 1121977443 /nfs/dbraw/zinc/97/74/43/1121977443.db2.gz PKSBYJQIXBRUKC-UHFFFAOYSA-N 1 0 264.388 3.562 20 10 CHCDRO Oc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)c(O)c1 ZINC001204277263 1122008233 /nfs/dbraw/zinc/00/82/33/1122008233.db2.gz XMLXTRAEDYJVPL-INIZCTEOSA-N 1 0 287.334 3.574 20 10 CHCDRO Cc1ncsc1C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC000071212511 1122033659 /nfs/dbraw/zinc/03/36/59/1122033659.db2.gz IPKKCWLUXQBJBE-PWSUYJOCSA-N 1 0 288.416 3.804 20 10 CHCDRO COc1ccc(C[NH+]2CCCCCCCC2)c(O)c1OC ZINC001181818983 1122083317 /nfs/dbraw/zinc/08/33/17/1122083317.db2.gz RKPKNGWGURBVBD-UHFFFAOYSA-N 1 0 293.407 3.566 20 10 CHCDRO CCOCC[N@H+](C)Cc1cc(-c2ccccc2)ccc1O ZINC000779598371 1129030908 /nfs/dbraw/zinc/03/09/08/1129030908.db2.gz HBQIIKKMVIOCCL-UHFFFAOYSA-N 1 0 285.387 3.528 20 10 CHCDRO FC(F)(F)[C@@H]1CC[N@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001204321930 1122116025 /nfs/dbraw/zinc/11/60/25/1122116025.db2.gz MAWYZDLJXZWWMO-CQSZACIVSA-N 1 0 298.352 3.671 20 10 CHCDRO Cc1cccc(C[N@H+]2CC[C@H](C)C3(CCC3)C2)c1O ZINC000779604333 1129032112 /nfs/dbraw/zinc/03/21/12/1129032112.db2.gz JNPOXNKZISSTHR-AWEZNQCLSA-N 1 0 259.393 3.713 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)C(C)(C)O)c1cc(Cl)c(Cl)cc1[O-] ZINC000774284334 1122153285 /nfs/dbraw/zinc/15/32/85/1122153285.db2.gz FDUOHGNAMGTGBI-HTQZYQBOSA-N 1 0 292.206 3.509 20 10 CHCDRO CC(C)c1ccc(O)c(C[N@@H+]2C[C@H](C)[C@H](C)[C@@H]2C)c1 ZINC001182450839 1122160134 /nfs/dbraw/zinc/16/01/34/1122160134.db2.gz AFRZTEZZALITFH-IHRRRGAJSA-N 1 0 261.409 3.992 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+][C@H]2CCO[C@@H](C(C)C)C2)c1O ZINC000271814019 1122176443 /nfs/dbraw/zinc/17/64/43/1122176443.db2.gz LHXVBRCWJOUQGU-LSDHHAIUSA-N 1 0 297.826 3.647 20 10 CHCDRO COc1cccc(C[NH2+][C@@H](C)[C@H](C)c2ccccc2)c1O ZINC000271834517 1122178336 /nfs/dbraw/zinc/17/83/36/1122178336.db2.gz PORHVRLIPDODJB-KBPBESRZSA-N 1 0 285.387 3.683 20 10 CHCDRO COc1cc(C)c(C[NH2+][C@H]2CCc3ccc(C)cc32)c(O)c1 ZINC001182683729 1122182607 /nfs/dbraw/zinc/18/26/07/1122182607.db2.gz FSHRCKZNSGQAGB-SFHVURJKSA-N 1 0 297.398 3.795 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C2CCC3(CCC3)CC2)c1 ZINC001182960742 1122196949 /nfs/dbraw/zinc/19/69/49/1122196949.db2.gz UKRAJPYYVKYZMF-UHFFFAOYSA-N 1 0 259.393 3.903 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CCC[C@@H](C2CCC2)C1 ZINC001182969778 1122198484 /nfs/dbraw/zinc/19/84/84/1122198484.db2.gz JVEBMEVLFDACBV-CYBMUJFWSA-N 1 0 263.356 3.543 20 10 CHCDRO COCC[C@H]([NH2+]Cc1cccc(Cl)c1[O-])c1ccco1 ZINC000272474351 1122203991 /nfs/dbraw/zinc/20/39/91/1122203991.db2.gz AZMCQVOHVJVHGW-ZDUSSCGKSA-N 1 0 295.766 3.506 20 10 CHCDRO COCC[C@H]([NH2+][C@H](C)c1ccccc1O)c1ccc(C)o1 ZINC000272812067 1122213558 /nfs/dbraw/zinc/21/35/58/1122213558.db2.gz DGYZMDKKFMGFAW-HIFRSBDPSA-N 1 0 289.375 3.722 20 10 CHCDRO Cc1cccc2oc(CC[NH2+][C@@H](C)c3ccccc3O)nc21 ZINC000272872612 1122214672 /nfs/dbraw/zinc/21/46/72/1122214672.db2.gz OYBDDUCKMAPUJA-ZDUSSCGKSA-N 1 0 296.370 3.735 20 10 CHCDRO CC1=CCC[C@H](C)[C@@H]1C[N@@H+]1Cc2cccc(O)c2C1 ZINC001183454572 1122224133 /nfs/dbraw/zinc/22/41/33/1122224133.db2.gz MHLFGBRQEDGYBA-DZGCQCFKSA-N 1 0 257.377 3.700 20 10 CHCDRO COc1ccc(O)c(C[NH+]2CC([C@H]3CCC[C@H](C)C3)C2)c1 ZINC001183442191 1122224247 /nfs/dbraw/zinc/22/42/47/1122224247.db2.gz CTDPVKTWHYGMID-KBPBESRZSA-N 1 0 289.419 3.659 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@H](CF)C2)c(Cl)c1 ZINC001183521188 1122226327 /nfs/dbraw/zinc/22/63/27/1122226327.db2.gz VYQBLYKVADYGCZ-NSHDSACASA-N 1 0 271.763 3.536 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccccc2F)c(O)c1C ZINC000273362767 1122230852 /nfs/dbraw/zinc/23/08/52/1122230852.db2.gz DIRYUOPKIGHFIZ-ZDUSSCGKSA-N 1 0 273.351 3.999 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCO[C@@H](C(C)C)C2)c1 ZINC000273491802 1122236429 /nfs/dbraw/zinc/23/64/29/1122236429.db2.gz OKDBLFJBAMCUFA-GRDNDAEWSA-N 1 0 277.408 3.555 20 10 CHCDRO CCC(CC)(CCO)C[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000273561299 1122239240 /nfs/dbraw/zinc/23/92/40/1122239240.db2.gz ICGLZGBCVFPMGX-HNNXBMFYSA-N 1 0 293.451 3.848 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2cccc(O)c2)c(O)c1C ZINC000273603133 1122240129 /nfs/dbraw/zinc/24/01/29/1122240129.db2.gz SKESMNIZULGEEW-ZDUSSCGKSA-N 1 0 271.360 3.565 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2cn3cc(C)ccc3n2)c(O)c1 ZINC000273613411 1122240738 /nfs/dbraw/zinc/24/07/38/1122240738.db2.gz WTGQFGYVWKWQEM-CQSZACIVSA-N 1 0 295.386 3.508 20 10 CHCDRO C[C@@H](CCc1ccsc1)[NH2+]Cc1c([O-])cccc1F ZINC001183920447 1122248214 /nfs/dbraw/zinc/24/82/14/1122248214.db2.gz YVZOJZKZWZFHGJ-NSHDSACASA-N 1 0 279.380 3.704 20 10 CHCDRO Cc1cc(C[NH2+]Cc2c([O-])cccc2F)ccc1Cl ZINC001183919448 1122248554 /nfs/dbraw/zinc/24/85/54/1122248554.db2.gz KSCSRCBPSOJIGM-UHFFFAOYSA-N 1 0 279.742 3.783 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](c1ccccc1)N(C)C)c1ccccc1O ZINC000192907394 1129046738 /nfs/dbraw/zinc/04/67/38/1129046738.db2.gz XQMRTVSJKPDIMO-ZWKOTPCHSA-N 1 0 298.430 3.736 20 10 CHCDRO CCCCC1CC[NH+](Cc2ccc(OC)cc2O)CC1 ZINC001203622301 1122354385 /nfs/dbraw/zinc/35/43/85/1122354385.db2.gz XKLXXBXATZHXPP-UHFFFAOYSA-N 1 0 277.408 3.803 20 10 CHCDRO CCCN(C[C@H]1CCO[C@@H](CC)C1)c1ccc(C[NH3+])cc1 ZINC000775139659 1122438219 /nfs/dbraw/zinc/43/82/19/1122438219.db2.gz DMOKFXAQQFWHRH-WMZOPIPTSA-N 1 0 290.451 3.567 20 10 CHCDRO COc1cccc(C[N@H+](C)Cc2cc(C)cc(C)c2)c1O ZINC000775147384 1122444689 /nfs/dbraw/zinc/44/46/89/1122444689.db2.gz BNFSKLZNFXKTNL-UHFFFAOYSA-N 1 0 285.387 3.650 20 10 CHCDRO Cc1cccc(O)c1C[N@@H+]1CCSc2ccccc2C1 ZINC001237489706 1129058161 /nfs/dbraw/zinc/05/81/61/1129058161.db2.gz DEBREOJSXGIKBR-UHFFFAOYSA-N 1 0 285.412 3.809 20 10 CHCDRO C[C@H](C[NH2+][C@H](C)c1ccccc1O)N(C)Cc1ccccc1 ZINC000183506640 1129058850 /nfs/dbraw/zinc/05/88/50/1129058850.db2.gz JRMVWLVLLHTXJL-HZPDHXFCSA-N 1 0 298.430 3.563 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCCN(c2ccccc2)C1)c1ccccc1O ZINC000183514169 1129059699 /nfs/dbraw/zinc/05/96/99/1129059699.db2.gz XJGCZCLLONZOOY-HZPDHXFCSA-N 1 0 296.414 3.712 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccc(C)cc1)c1ccccc1O ZINC000775412536 1122555402 /nfs/dbraw/zinc/55/54/02/1122555402.db2.gz OAGLFLVNRBXTKQ-KRWDZBQOSA-N 1 0 269.388 3.984 20 10 CHCDRO CCC[N@@H+](Cc1ccccc1O)C[C@H]1C[C@@H]2[C@H](C1)C2(F)F ZINC001191276905 1122588737 /nfs/dbraw/zinc/58/87/37/1122588737.db2.gz GNPITAZISPHBCC-YOWGUQMCSA-N 1 0 295.373 3.896 20 10 CHCDRO C[N@H+](CCCSC(C)(C)C)Cc1ccccc1O ZINC001191681853 1122608431 /nfs/dbraw/zinc/60/84/31/1122608431.db2.gz JGXSPLZDVUVWDK-UHFFFAOYSA-N 1 0 267.438 3.746 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](C)N1CCC[C@@H](C)C1)c1ccccc1O ZINC000775486516 1122616828 /nfs/dbraw/zinc/61/68/28/1122616828.db2.gz COAMLESNKKFORQ-INMHGKMJSA-N 1 0 290.451 3.553 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)COc1ccccc1)c1ccccc1O ZINC000775495872 1122624277 /nfs/dbraw/zinc/62/42/77/1122624277.db2.gz DYECPANTQMFFKX-YOEHRIQHSA-N 1 0 285.387 3.900 20 10 CHCDRO CC[C@H]([NH2+]CCN1[C@H](C)CCC[C@@H]1C)c1ccccc1O ZINC000775502972 1122630977 /nfs/dbraw/zinc/63/09/77/1122630977.db2.gz ZHCZGPFXDOFQKM-UXLLHSPISA-N 1 0 290.451 3.696 20 10 CHCDRO CC[C@@H](COC)[NH2+][C@@H](CC)c1cc(Cl)ccc1O ZINC000775510202 1122631218 /nfs/dbraw/zinc/63/12/18/1122631218.db2.gz WQRWWTBPWKCNHE-AAEUAGOBSA-N 1 0 271.788 3.511 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCC[C@@H](O)C1)c1cc(Cl)ccc1O ZINC000775508365 1122631281 /nfs/dbraw/zinc/63/12/81/1122631281.db2.gz BOTLXBFAWXZTFF-KYOSRNDESA-N 1 0 297.826 3.637 20 10 CHCDRO CC[C@H]([NH2+]CCN1[C@@H](C)CCC[C@@H]1C)c1ccccc1O ZINC000775502973 1122631601 /nfs/dbraw/zinc/63/16/01/1122631601.db2.gz ZHCZGPFXDOFQKM-ZOBUZTSGSA-N 1 0 290.451 3.696 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCCC[C@H]1O)c1cc(Cl)ccc1O ZINC000775508265 1122632046 /nfs/dbraw/zinc/63/20/46/1122632046.db2.gz BANLWBSYWOJBDX-TUKIKUTGSA-N 1 0 297.826 3.637 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)[C@H]1CCOC1)c1cc(Cl)ccc1O ZINC000775510013 1122632179 /nfs/dbraw/zinc/63/21/79/1122632179.db2.gz WZMBVZLHOFAZJI-SUNKGSAMSA-N 1 0 283.799 3.511 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccncc1)c1cc(Cl)ccc1O ZINC000775513765 1122634935 /nfs/dbraw/zinc/63/49/35/1122634935.db2.gz MASMYCWACJZPSR-OAHLLOKOSA-N 1 0 290.794 3.724 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CO)c1sccc1C)c1ccccc1O ZINC000775524497 1122642805 /nfs/dbraw/zinc/64/28/05/1122642805.db2.gz APNUEOUFYRDOHK-KGLIPLIRSA-N 1 0 291.416 3.536 20 10 CHCDRO CC[C@@H]1CC[C@H](C)[N@@H+]1Cc1ccc(N(C)CC)cc1 ZINC001192645540 1122655068 /nfs/dbraw/zinc/65/50/68/1122655068.db2.gz OJSPZLDCYYXLOD-GOEBONIOSA-N 1 0 260.425 3.906 20 10 CHCDRO CC(C)OC1CCC([NH2+][C@@H](C)c2ccccc2O)CC1 ZINC000183627224 1129072704 /nfs/dbraw/zinc/07/27/04/1129072704.db2.gz ULPWRGLQDPNJEL-NFOMZHRRSA-N 1 0 277.408 3.779 20 10 CHCDRO CC[N@@H+](Cc1ccc(N(C)C)c(C)c1)CC1CCC1 ZINC001193761701 1122717955 /nfs/dbraw/zinc/71/79/55/1122717955.db2.gz JHRXZMZEIFJTKH-UHFFFAOYSA-N 1 0 260.425 3.683 20 10 CHCDRO Cc1cc2cc(C[NH2+][C@@H]3CCc4cccc(O)c43)ccc2[nH]1 ZINC000297309300 1122793139 /nfs/dbraw/zinc/79/31/39/1122793139.db2.gz MTEJWVYXPNJTHJ-QGZVFWFLSA-N 1 0 292.382 3.959 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2CCc3sccc3C2)c1O ZINC000775648047 1122856332 /nfs/dbraw/zinc/85/63/32/1122856332.db2.gz NWMCRXNZWMILIJ-UHFFFAOYSA-N 1 0 293.819 3.974 20 10 CHCDRO Cc1cccc(C[N@@H+](C)Cc2cccc(C)c2O)c1 ZINC000775648402 1122857095 /nfs/dbraw/zinc/85/70/95/1122857095.db2.gz HKXMMHBIFKJVMA-UHFFFAOYSA-N 1 0 255.361 3.641 20 10 CHCDRO CC[N@H+](CCc1ccccc1)Cc1cccc(C)c1O ZINC000775652825 1122867887 /nfs/dbraw/zinc/86/78/87/1122867887.db2.gz VQLAKHGOMVQDDK-UHFFFAOYSA-N 1 0 269.388 3.765 20 10 CHCDRO C[N@H+](Cc1cccc(Cl)c1[O-])C1Cc2ccccc2C1 ZINC000775661558 1122875695 /nfs/dbraw/zinc/87/56/95/1122875695.db2.gz QLBJQHBMBHGWRH-UHFFFAOYSA-N 1 0 287.790 3.645 20 10 CHCDRO [O-]c1c(Cl)cccc1C[N@@H+]1CCC[C@@H]1C1CCC1 ZINC000775669061 1122882608 /nfs/dbraw/zinc/88/26/08/1122882608.db2.gz DECAAQSVZKRFQA-CQSZACIVSA-N 1 0 265.784 3.810 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCC[C@@H]3CCCC[C@H]32)c1O ZINC000228173454 1122900915 /nfs/dbraw/zinc/90/09/15/1122900915.db2.gz MJZIKPXPQRHHSQ-GOEBONIOSA-N 1 0 259.393 3.855 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCc3c(C)cccc3C2)c1O ZINC000775681777 1122902090 /nfs/dbraw/zinc/90/20/90/1122902090.db2.gz TWBDIOGGUGSOIC-UHFFFAOYSA-N 1 0 267.372 3.567 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2CC[C@H](c3ccco3)C2)c1O ZINC000775692927 1122911298 /nfs/dbraw/zinc/91/12/98/1122911298.db2.gz QPGGGFXDRIJAPZ-LBPRGKRZSA-N 1 0 291.778 3.937 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CC[C@@H](c3ccccc3)[C@@H]2C)c1 ZINC000775723015 1122925165 /nfs/dbraw/zinc/92/51/65/1122925165.db2.gz BNKFRYHACYFYLN-KBXCAEBGSA-N 1 0 297.398 3.779 20 10 CHCDRO Cc1cccc(C[N@@H+]2CC[C@@H]2c2cccc(F)c2)c1O ZINC000775726650 1122927745 /nfs/dbraw/zinc/92/77/45/1122927745.db2.gz YTQAHJWSAGHSCM-MRXNPFEDSA-N 1 0 271.335 3.787 20 10 CHCDRO CC[C@@H]1CC[N@H+](Cc2cc(Cl)cc(C)c2O)C1 ZINC000775736966 1122928389 /nfs/dbraw/zinc/92/83/89/1122928389.db2.gz ILUUJUATUVMVHB-LLVKDONJSA-N 1 0 253.773 3.586 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+]2CC[C@H](C)[C@H]2C)c1O ZINC000775737053 1122928853 /nfs/dbraw/zinc/92/88/53/1122928853.db2.gz NXWGJKWGEHFONA-GXSJLCMTSA-N 1 0 253.773 3.584 20 10 CHCDRO Cc1cccc(C[N@@H+](C)[C@@H](C)[C@H]2Cc3ccccc3O2)c1O ZINC000775741594 1122933155 /nfs/dbraw/zinc/93/31/55/1122933155.db2.gz TVWKODAQLJFZRM-KBXCAEBGSA-N 1 0 297.398 3.525 20 10 CHCDRO C[C@H]1C[N@H+](Cc2ccc(N(C)C)cc2)Cc2ccccc21 ZINC001197552638 1122960359 /nfs/dbraw/zinc/96/03/59/1122960359.db2.gz LPVJAHPLSPWLPM-HNNXBMFYSA-N 1 0 280.415 3.872 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@@H]2C[C@H]2C(C)C)cc1Cl ZINC001205831614 1122986297 /nfs/dbraw/zinc/98/62/97/1122986297.db2.gz JJQDINMQSFWIBH-AAEUAGOBSA-N 1 0 267.800 3.736 20 10 CHCDRO Cc1ccc(CC[NH2+]Cc2cc(Cl)cc(C)c2O)o1 ZINC000775981698 1123030760 /nfs/dbraw/zinc/03/07/60/1123030760.db2.gz JQPQGISPPBODRE-UHFFFAOYSA-N 1 0 279.767 3.588 20 10 CHCDRO C[C@H]1CCC[C@H](C[NH2+]Cc2cc(F)c(N(C)C)cc2F)C1 ZINC001199759394 1123039454 /nfs/dbraw/zinc/03/94/54/1123039454.db2.gz JIGQJWLDJPERJS-STQMWFEESA-N 1 0 296.405 3.947 20 10 CHCDRO CCCOc1ccc(C[NH2+]CCOC(C)(C)C)cc1C ZINC001199843965 1123042836 /nfs/dbraw/zinc/04/28/36/1123042836.db2.gz STEYURQBMOFMKM-UHFFFAOYSA-N 1 0 279.424 3.689 20 10 CHCDRO CC1=CCC[C@@H](C)[C@@H]1C[NH2+]Cc1ccc(N(C)C)c(F)c1 ZINC001199865678 1123045112 /nfs/dbraw/zinc/04/51/12/1123045112.db2.gz SXYSFGKKYMYNNG-GDBMZVCRSA-N 1 0 290.426 3.974 20 10 CHCDRO Cc1ccccc1CC[NH2+]Cc1cc(Cl)cc(F)c1[O-] ZINC001200977947 1123065975 /nfs/dbraw/zinc/06/59/75/1123065975.db2.gz BLPWGLWSJPVCSS-UHFFFAOYSA-N 1 0 293.769 3.825 20 10 CHCDRO CCOc1cccc(C[NH2+][C@H]2CCc3ccc(C)cc32)c1O ZINC000776174123 1123102639 /nfs/dbraw/zinc/10/26/39/1123102639.db2.gz AFYRVNZFFQDDDT-KRWDZBQOSA-N 1 0 297.398 3.876 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2CCCc3ccc(O)cc32)cc1 ZINC000284064538 1123145727 /nfs/dbraw/zinc/14/57/27/1123145727.db2.gz LALJAZUUMSPHBA-LJQANCHMSA-N 1 0 296.414 3.625 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]CC(C)(C)C(C)(F)F)c1 ZINC000696567194 1123195292 /nfs/dbraw/zinc/19/52/92/1123195292.db2.gz GPAXTNQRLDYVJA-JTQLQIEISA-N 1 0 287.350 3.733 20 10 CHCDRO C[N@H+](CCC(F)(F)F)Cc1ccc(N2CCCC2)cc1 ZINC001202347913 1123196879 /nfs/dbraw/zinc/19/68/79/1123196879.db2.gz MJCCBPBGGJFWMN-UHFFFAOYSA-N 1 0 286.341 3.671 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)CCCC(F)(F)F)cc1 ZINC001202443917 1123209365 /nfs/dbraw/zinc/20/93/65/1123209365.db2.gz ZLFYHJPJLFCIDP-UHFFFAOYSA-N 1 0 274.330 3.527 20 10 CHCDRO C[N@@H+]1CCCC[C@@H]1CCSc1ncc(Cl)s1 ZINC000849998588 1123236165 /nfs/dbraw/zinc/23/61/65/1123236165.db2.gz PJNDELGLDINKFB-SECBINFHSA-N 1 0 276.858 3.763 20 10 CHCDRO COc1cc(C[NH2+][C@H](C)C2CC2)c(O)c(C(C)(C)C)c1 ZINC000850010353 1123236807 /nfs/dbraw/zinc/23/68/07/1123236807.db2.gz DQFABYDKAOJARB-LLVKDONJSA-N 1 0 277.408 3.586 20 10 CHCDRO COc1cc(C[NH2+]C2CC(F)(F)C2)c(O)c(C(C)(C)C)c1 ZINC000850278948 1123250759 /nfs/dbraw/zinc/25/07/59/1123250759.db2.gz SCQKNRSETSLAJE-UHFFFAOYSA-N 1 0 299.361 3.586 20 10 CHCDRO C[C@@]1(C[NH2+]Cc2ccc(N3CCCCC3)cc2)CC1(F)F ZINC000850378938 1123260623 /nfs/dbraw/zinc/26/06/23/1123260623.db2.gz BKEIAVNFRRVFNV-INIZCTEOSA-N 1 0 294.389 3.812 20 10 CHCDRO Oc1ccc2c(c1)[C@H]([NH2+]Cc1cc(Cl)ccc1O)CC2 ZINC000850386327 1123261284 /nfs/dbraw/zinc/26/12/84/1123261284.db2.gz HSZSMWGFEIMKAQ-OAHLLOKOSA-N 1 0 289.762 3.528 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)C(C)(C)C(F)F ZINC000850422523 1123265727 /nfs/dbraw/zinc/26/57/27/1123265727.db2.gz TTWMFMOGJHADBF-NSHDSACASA-N 1 0 270.367 3.522 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)C(C)(C)C(F)F ZINC000850435136 1123266158 /nfs/dbraw/zinc/26/61/58/1123266158.db2.gz IOESXIYVNFMXBH-LBPRGKRZSA-N 1 0 284.394 3.830 20 10 CHCDRO C[C@H](C[NH2+][C@@H](C)c1ccc(N(C)C)cc1)c1ccccn1 ZINC000850481495 1123273141 /nfs/dbraw/zinc/27/31/41/1123273141.db2.gz HJKFRANJFGJNHC-CABCVRRESA-N 1 0 283.419 3.602 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCN1C(C)(C)C)c1ccc(Cl)cc1O ZINC000850481923 1123273513 /nfs/dbraw/zinc/27/35/13/1123273513.db2.gz OQJJSJLLFSBDFI-WCQYABFASA-N 1 0 296.842 3.569 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@H](C)c2ccccn2)c(O)c1 ZINC000850480643 1123273628 /nfs/dbraw/zinc/27/36/28/1123273628.db2.gz BAPLGDIQAGWADC-GJZGRUSLSA-N 1 0 284.403 3.858 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CCC2CC(OC)C2)cc1 ZINC000850481451 1123273693 /nfs/dbraw/zinc/27/36/93/1123273693.db2.gz LJJLDCWTIYZUNW-SYJJWHGVSA-N 1 0 290.451 3.608 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCc2noc3ccccc23)c1 ZINC000850482621 1123273815 /nfs/dbraw/zinc/27/38/15/1123273815.db2.gz KPOOFNPFPLUTBO-CYBMUJFWSA-N 1 0 296.370 3.735 20 10 CHCDRO CC[C@@H]([NH2+]CCc1cnccc1C)c1ccc(N(C)C)cc1 ZINC000850509155 1123277181 /nfs/dbraw/zinc/27/71/81/1123277181.db2.gz YUJXFJBVGCCVGU-LJQANCHMSA-N 1 0 297.446 3.739 20 10 CHCDRO C[C@@H]([NH2+][C@H]1C=CCC1)c1cc(Br)ccc1O ZINC000850507189 1123277357 /nfs/dbraw/zinc/27/73/57/1123277357.db2.gz DOONKBVDHDCJHK-KOLCDFICSA-N 1 0 282.181 3.524 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+][C@@H]2COC3(CCC3)C2)c1O ZINC000850523805 1123279781 /nfs/dbraw/zinc/27/97/81/1123279781.db2.gz POSWUSCFRWMVEB-YPMHNXCESA-N 1 0 295.810 3.716 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CCc2ccc(C)c(C)c2)c1O ZINC000850522154 1123280208 /nfs/dbraw/zinc/28/02/08/1123280208.db2.gz FTGIIYZUDZFQRE-HNNXBMFYSA-N 1 0 299.414 3.911 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1COC2(CCC2)C1)c1ccc2ccccc2c1O ZINC000850525080 1123280762 /nfs/dbraw/zinc/28/07/62/1123280762.db2.gz KYGCOUWPAYIGCM-HIFRSBDPSA-N 1 0 297.398 3.908 20 10 CHCDRO C[C@H]1C[C@@H]([NH2+]CCc2ccoc2)c2c1c(F)ccc2O ZINC000850531527 1123285353 /nfs/dbraw/zinc/28/53/53/1123285353.db2.gz LGESARSSHVHUPV-GXFFZTMASA-N 1 0 275.323 3.505 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CCCC2CCC2)c1O ZINC000850535811 1123286741 /nfs/dbraw/zinc/28/67/41/1123286741.db2.gz BYBYZGLWLJOBPF-GFCCVEGCSA-N 1 0 263.381 3.632 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2C(C)(C)C2(F)F)c(O)c1 ZINC000850553588 1123289752 /nfs/dbraw/zinc/28/97/52/1123289752.db2.gz ZEXGILRLJMNFKZ-ZWNOBZJWSA-N 1 0 269.335 3.643 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1C(C)(C)C1(F)F)c1ccc(N(C)C)cc1 ZINC000850552664 1123289850 /nfs/dbraw/zinc/28/98/50/1123289850.db2.gz PHPNQAXRFJTJJG-BXUZGUMPSA-N 1 0 282.378 3.695 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1C(C)(C)C1(F)F)c1ccc(Cl)cc1O ZINC000850553200 1123290178 /nfs/dbraw/zinc/29/01/78/1123290178.db2.gz TZJMQSLDDJEHIC-PRHODGIISA-N 1 0 289.753 3.988 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1CCOC1(C)C)c1ccc(N(C)C)cc1 ZINC000850570327 1123294153 /nfs/dbraw/zinc/29/41/53/1123294153.db2.gz GADXEFLGULFTAY-NVXWUHKLSA-N 1 0 290.451 3.608 20 10 CHCDRO CC[C@H]([NH2+]C[C@H]1CCOC1(C)C)c1ccc(C)cc1O ZINC000850570395 1123294343 /nfs/dbraw/zinc/29/43/43/1123294343.db2.gz GWAPYVALFBJQGD-HIFRSBDPSA-N 1 0 277.408 3.556 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1nccn1C)c1cc(Cl)ccc1O ZINC000850572746 1123294952 /nfs/dbraw/zinc/29/49/52/1123294952.db2.gz OZPINMUYRXDPMP-ZWNOBZJWSA-N 1 0 293.798 3.581 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H](O)[C@H](C)c2ccccc2)c1 ZINC000850572770 1123295269 /nfs/dbraw/zinc/29/52/69/1123295269.db2.gz GEIZFIHDVANASM-ZRGWGRIASA-N 1 0 299.414 3.516 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1nccn1C)c1cc(Cl)ccc1O ZINC000850572744 1123295642 /nfs/dbraw/zinc/29/56/42/1123295642.db2.gz OZPINMUYRXDPMP-GXFFZTMASA-N 1 0 293.798 3.581 20 10 CHCDRO CC[C@@H]([NH2+]Cc1sc(C)nc1C)c1ccccc1O ZINC000271737215 1129114794 /nfs/dbraw/zinc/11/47/94/1129114794.db2.gz UKXMZQHRQSDKKT-CYBMUJFWSA-N 1 0 276.405 3.706 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H](C)c2ccc3c(c2)CCCO3)c1 ZINC000853095510 1123423984 /nfs/dbraw/zinc/42/39/84/1123423984.db2.gz ZLMLHTSMTZQWBP-AWEZNQCLSA-N 1 0 297.398 3.876 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCOC2CCCCC2)c(O)c1 ZINC000111635674 1123457529 /nfs/dbraw/zinc/45/75/29/1123457529.db2.gz CNVPQGRKJPGGBZ-CQSZACIVSA-N 1 0 277.408 3.701 20 10 CHCDRO C[C@@H]([NH2+]Cc1cccc2c1NCCC2)c1ccccc1O ZINC000895459777 1123481945 /nfs/dbraw/zinc/48/19/45/1123481945.db2.gz IJDCXNHUAADCFK-CYBMUJFWSA-N 1 0 282.387 3.601 20 10 CHCDRO Cc1ccc(C[NH2+]CC[C@H]2CCCC2(F)F)c(O)c1 ZINC000895546061 1123491267 /nfs/dbraw/zinc/49/12/67/1123491267.db2.gz YHHPTDHTADMFKF-CYBMUJFWSA-N 1 0 269.335 3.616 20 10 CHCDRO Cc1cc(Cl)cc(C[NH+]2C[C@@H]3CCCC[C@H]3C2)c1O ZINC001237681090 1129128014 /nfs/dbraw/zinc/12/80/14/1129128014.db2.gz KYLCTESTTFMLEQ-STQMWFEESA-N 1 0 279.811 3.976 20 10 CHCDRO C[C@H]([NH2+]CCCOC(F)F)c1ccc2ccccc2c1O ZINC000194030169 1129129206 /nfs/dbraw/zinc/12/92/06/1129129206.db2.gz ZAFGEMDWZFRCON-NSHDSACASA-N 1 0 295.329 3.825 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CCOC(C)(C)C)cc1 ZINC000776890695 1123561070 /nfs/dbraw/zinc/56/10/70/1123561070.db2.gz TUJGHQCFNADFOF-AWEZNQCLSA-N 1 0 278.440 3.608 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]CC[C@H]1CC1(Cl)Cl ZINC000856806758 1123570093 /nfs/dbraw/zinc/57/00/93/1123570093.db2.gz HKYYETVGVHPNAE-QMMMGPOBSA-N 1 0 294.609 3.719 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+]CC[C@@H]1CC1(Cl)Cl)CC2 ZINC000857080439 1123584682 /nfs/dbraw/zinc/58/46/82/1123584682.db2.gz GMZPYJFFPITURH-MNOVXSKESA-N 1 0 286.202 3.553 20 10 CHCDRO C[C@@H]1C[C@@H]([NH2+]CC[C@H]2CC2(F)F)c2c1c(F)ccc2O ZINC000857082195 1123586031 /nfs/dbraw/zinc/58/60/31/1123586031.db2.gz UQVBZMUNPQCGOE-WCABBAIRSA-N 1 0 285.309 3.715 20 10 CHCDRO CC[C@@H]([NH2+]CC[C@@H]1CC1(F)F)c1ccc(N(C)C)cc1 ZINC000857082199 1123586130 /nfs/dbraw/zinc/58/61/30/1123586130.db2.gz URSJRLZSOYGBIT-UKRRQHHQSA-N 1 0 282.378 3.839 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]C(C)(C)/C=C/Cl)c1O ZINC000896747419 1123618485 /nfs/dbraw/zinc/61/84/85/1123618485.db2.gz LNOQQPJCBJISOK-SNAWJCMRSA-N 1 0 290.190 3.675 20 10 CHCDRO Cc1cc(C[NH2+]Cc2ccn(C)c2)c(C)n1-c1ccccc1 ZINC000858293854 1123642609 /nfs/dbraw/zinc/64/26/09/1123642609.db2.gz REFJGVTZHPMOJU-UHFFFAOYSA-N 1 0 293.414 3.722 20 10 CHCDRO Oc1c(C[NH2+]C[C@@H]2C[C@H]2C(F)(F)F)ccc2ccccc21 ZINC000896862992 1123649984 /nfs/dbraw/zinc/64/99/84/1123649984.db2.gz LWWBTWNWSIYQHK-GXTWGEPZSA-N 1 0 295.304 3.833 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1Cc2ccccc2CO1)c1ccccc1O ZINC000858452528 1123655408 /nfs/dbraw/zinc/65/54/08/1123655408.db2.gz FHJPMVOPZNTLSV-WMZOPIPTSA-N 1 0 297.398 3.574 20 10 CHCDRO Cc1ccc(C(C)(C)C[NH2+][C@@H]2CCc3cccc(O)c32)nc1 ZINC000858487796 1123657455 /nfs/dbraw/zinc/65/74/55/1123657455.db2.gz IPCSARFWOPTALP-OAHLLOKOSA-N 1 0 296.414 3.650 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)c1ccns1 ZINC000858576112 1123664001 /nfs/dbraw/zinc/66/40/01/1123664001.db2.gz IIYJXCMNJOWRFU-DTWKUNHWSA-N 1 0 282.796 3.914 20 10 CHCDRO Cc1cc(C[N@@H+](C)CC2(C)COC2)c(C)n1-c1ccccc1 ZINC001137858152 1123717684 /nfs/dbraw/zinc/71/76/84/1123717684.db2.gz YLLSJDYUYOSZMR-UHFFFAOYSA-N 1 0 298.430 3.562 20 10 CHCDRO CS[C@@H]1CCC[C@@H]([NH2+]Cc2ccc(N(C)C)cc2)C1 ZINC000117394262 1123728771 /nfs/dbraw/zinc/72/87/71/1123728771.db2.gz CTXYTDAIMFVXEK-GDBMZVCRSA-N 1 0 278.465 3.516 20 10 CHCDRO Cc1cc(O)c(C[NH+]2C[C@@H](C)C(F)(F)[C@H](C)C2)cc1C ZINC000862444491 1123812001 /nfs/dbraw/zinc/81/20/01/1123812001.db2.gz XGDYLZWKZDRFCD-CHWSQXEVSA-N 1 0 283.362 3.732 20 10 CHCDRO C[C@@H]1C[N@@H+](Cc2c(O)cccc2Cl)C[C@H](C)C1(F)F ZINC000862444307 1123812135 /nfs/dbraw/zinc/81/21/35/1123812135.db2.gz VEGBPWOMORMMNN-AOOOYVTPSA-N 1 0 289.753 3.769 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCCC(F)(F)CC2)c(Cl)c1 ZINC000862467310 1123813501 /nfs/dbraw/zinc/81/35/01/1123813501.db2.gz RVDDUJVRDDMIEL-UHFFFAOYSA-N 1 0 289.753 3.975 20 10 CHCDRO COc1cccc2c1C[N@H+](Cc1cc(C)cc(C)c1O)C2 ZINC000863320055 1123860127 /nfs/dbraw/zinc/86/01/27/1123860127.db2.gz GCIYTVVBRPJUQV-UHFFFAOYSA-N 1 0 283.371 3.533 20 10 CHCDRO CO[C@@](C)([C@H](C)[NH2+][C@H](C)c1cc(C)ccc1O)C1CC1 ZINC000840859983 1123862024 /nfs/dbraw/zinc/86/20/24/1123862024.db2.gz RAKRLUGBLSIOSL-IGCXYCKISA-N 1 0 277.408 3.555 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(C)cc1O)c1ccccc1 ZINC000083411186 1129150105 /nfs/dbraw/zinc/15/01/05/1129150105.db2.gz ZSJXZABVXYEULM-INIZCTEOSA-N 1 0 255.361 3.942 20 10 CHCDRO CC(=O)Nc1cccc([C@H](C)[NH2+][C@@H](C)c2ccccc2O)c1 ZINC000192946470 1123866785 /nfs/dbraw/zinc/86/67/85/1123866785.db2.gz FLRSDLXLTQANGA-STQMWFEESA-N 1 0 298.386 3.762 20 10 CHCDRO CC(=O)Nc1cccc([C@@H](C)[NH2+][C@H](C)c2ccccc2O)c1 ZINC000192946505 1123867354 /nfs/dbraw/zinc/86/73/54/1123867354.db2.gz FLRSDLXLTQANGA-CHWSQXEVSA-N 1 0 298.386 3.762 20 10 CHCDRO CN(C)c1ccc(C[NH2+]Cc2sccc2Cl)cc1 ZINC000192983843 1123868971 /nfs/dbraw/zinc/86/89/71/1123868971.db2.gz AYAYYGBSRHGSLD-UHFFFAOYSA-N 1 0 280.824 3.757 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]Cc2cccc3cccnc32)c1 ZINC000083552296 1129151097 /nfs/dbraw/zinc/15/10/97/1129151097.db2.gz NPXSYVDOYKSSIK-UHFFFAOYSA-N 1 0 278.355 3.539 20 10 CHCDRO C[C@H]([NH2+]CC(C)(C)OCC1CC1)c1cc(Cl)ccc1O ZINC000840876487 1123894465 /nfs/dbraw/zinc/89/44/65/1123894465.db2.gz NDUQEKMGANCWPD-NSHDSACASA-N 1 0 297.826 3.901 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCCC[C@H]1F)c1ccc(N(C)C)cc1 ZINC000840876399 1123896282 /nfs/dbraw/zinc/89/62/82/1123896282.db2.gz PVSYEEYAGDRYKA-APHBMKBZSA-N 1 0 264.388 3.684 20 10 CHCDRO COc1cccc(C[NH2+]C[C@@H](C)c2ccc(C)cc2)c1O ZINC000119684765 1123901096 /nfs/dbraw/zinc/90/10/96/1123901096.db2.gz RCCVBPJGRPPBOF-CQSZACIVSA-N 1 0 285.387 3.603 20 10 CHCDRO COc1cc(C[N@H+](C)[C@@H]2CCC(C)(C)C2)c(O)cc1C ZINC000794686856 1123927727 /nfs/dbraw/zinc/92/77/27/1123927727.db2.gz SIMYNTATZWPMAR-CQSZACIVSA-N 1 0 277.408 3.720 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccccc1)c1ccc(C)cc1O ZINC000794791559 1123949128 /nfs/dbraw/zinc/94/91/28/1123949128.db2.gz AUDGTSJDKLONPK-KRWDZBQOSA-N 1 0 269.388 3.984 20 10 CHCDRO CC[C@H]([NH2+]CCSC(F)(F)F)c1ccc(C)cc1O ZINC000794796379 1123949359 /nfs/dbraw/zinc/94/93/59/1123949359.db2.gz KALTUVALLYXJBG-NSHDSACASA-N 1 0 293.354 3.994 20 10 CHCDRO CC[C@H](C[NH2+][C@@H](CC)c1ccc(C)cc1O)N1CCCC1 ZINC000794797032 1123949512 /nfs/dbraw/zinc/94/95/12/1123949512.db2.gz LPKLNEDHEKQQBB-WBVHZDCISA-N 1 0 290.451 3.616 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)Cc1ccncc1)c1ccc(C)cc1O ZINC000794799977 1123950861 /nfs/dbraw/zinc/95/08/61/1123950861.db2.gz ASYDBTZTPCUUHI-YOEHRIQHSA-N 1 0 284.403 3.768 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc([C@@H](C)O)cc1)c1ccc(C)cc1O ZINC000794801681 1123950910 /nfs/dbraw/zinc/95/09/10/1123950910.db2.gz JWTKUVDISCBWOU-KDOFPFPSSA-N 1 0 299.414 3.995 20 10 CHCDRO CC[C@H]([NH2+]CCN1CCCCCC1)c1ccc(C)cc1O ZINC000794793366 1123951024 /nfs/dbraw/zinc/95/10/24/1123951024.db2.gz NXCMGORVFSVFGF-KRWDZBQOSA-N 1 0 290.451 3.617 20 10 CHCDRO CC[C@H]([NH2+]CCCCCOC)c1ccc(C)cc1O ZINC000794803515 1123952058 /nfs/dbraw/zinc/95/20/58/1123952058.db2.gz JMPUBPFTFORYLR-HNNXBMFYSA-N 1 0 265.397 3.558 20 10 CHCDRO CC[C@@H]([NH2+]C(C1CC1)C1CC1)c1ccc(C)cc1O ZINC000794804588 1123953113 /nfs/dbraw/zinc/95/31/13/1123953113.db2.gz VDWUERMIXLWQSS-OAHLLOKOSA-N 1 0 259.393 3.930 20 10 CHCDRO CC[C@H]([NH2+]C[C@@]1(C)CCCC[C@H]1O)c1ccc(C)cc1O ZINC000794806276 1123955827 /nfs/dbraw/zinc/95/58/27/1123955827.db2.gz ZSUJAZFQANNXRN-CGTJXYLNSA-N 1 0 291.435 3.683 20 10 CHCDRO CC[C@H]([NH2+][C@@H]1CCC(F)(F)C1)c1ccc(C)cc1O ZINC000794815570 1123956990 /nfs/dbraw/zinc/95/69/90/1123956990.db2.gz WJYJNXDGDXEEIL-YPMHNXCESA-N 1 0 269.335 3.929 20 10 CHCDRO CC[C@@H]([NH2+]CCC(F)(F)F)c1ccc(C)cc1O ZINC000794812563 1123958828 /nfs/dbraw/zinc/95/88/28/1123958828.db2.gz XFOIDRJLYNCUEZ-LLVKDONJSA-N 1 0 261.287 3.694 20 10 CHCDRO CC[C@H]([NH2+][C@H](CO)c1ccsc1)c1ccc(C)cc1O ZINC000794812450 1123959151 /nfs/dbraw/zinc/95/91/51/1123959151.db2.gz CZEGYROTTSVKRH-LSDHHAIUSA-N 1 0 291.416 3.536 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)C[C@@H]1CCOC1)c1ccc(C)cc1O ZINC000794811924 1123959883 /nfs/dbraw/zinc/95/98/83/1123959883.db2.gz UTNHRGDYIKGPQR-YCPHGPKFSA-N 1 0 277.408 3.556 20 10 CHCDRO CC[C@@H]([NH2+]CC1([C@@H](O)C(C)C)CC1)c1ccc(C)cc1O ZINC000794817112 1123959970 /nfs/dbraw/zinc/95/99/70/1123959970.db2.gz MYHXOYXZTZMCPZ-WBVHZDCISA-N 1 0 291.435 3.538 20 10 CHCDRO CC[C@H]1CCC[C@H]([NH2+]Cc2ccc3c(c2)CCO3)C1 ZINC000085064330 1129156056 /nfs/dbraw/zinc/15/60/56/1129156056.db2.gz HFNYRIQITCQIHP-BBRMVZONSA-N 1 0 259.393 3.680 20 10 CHCDRO CC[C@H]([NH2+]Cc1cccnc1F)c1ccc(N(C)C)cc1 ZINC000794832705 1123969945 /nfs/dbraw/zinc/96/99/45/1123969945.db2.gz DBXXBPQJXPDEIA-INIZCTEOSA-N 1 0 287.382 3.528 20 10 CHCDRO CC[C@H]([NH2+][C@H](CO)CC1CCC1)c1cc(Cl)ccc1O ZINC000794836583 1123971535 /nfs/dbraw/zinc/97/15/35/1123971535.db2.gz UIOBUFADZFQZSH-ZFWWWQNUSA-N 1 0 297.826 3.637 20 10 CHCDRO CC[C@H]([NH2+][C@@H](CO)CC1CCC1)c1cc(Cl)ccc1O ZINC000794836581 1123971599 /nfs/dbraw/zinc/97/15/99/1123971599.db2.gz UIOBUFADZFQZSH-HIFRSBDPSA-N 1 0 297.826 3.637 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1ccc(N(C)CC)cc1)[C@H](O)C(C)C ZINC000840882090 1123981961 /nfs/dbraw/zinc/98/19/61/1123981961.db2.gz MCBXPBIREKEPLA-JCGIZDLHSA-N 1 0 292.467 3.589 20 10 CHCDRO CC[C@H]([NH2+][C@@H](CC)[C@@H](O)C(C)C)c1ccc(N(C)C)cc1 ZINC000840884151 1123995946 /nfs/dbraw/zinc/99/59/46/1123995946.db2.gz ZUCHOABMWLUFTE-BZSNNMDCSA-N 1 0 292.467 3.589 20 10 CHCDRO Cc1ccc(C[C@@H](C)[NH2+]Cc2ccc3c(c2)CCO3)c(C)c1 ZINC000303289517 1124002165 /nfs/dbraw/zinc/00/21/65/1124002165.db2.gz AUQWPFRZEDHTGM-MRXNPFEDSA-N 1 0 295.426 3.959 20 10 CHCDRO CC[C@@H]([NH2+]CC[C@@H]1CCSC1)c1ccc(C)cc1O ZINC000866401597 1124062676 /nfs/dbraw/zinc/06/26/76/1124062676.db2.gz BEDWOIYKYSKALX-UKRRQHHQSA-N 1 0 279.449 3.885 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+]CC[C@@H]2CCSC2)c2c1c(F)ccc2O ZINC000866402434 1124063086 /nfs/dbraw/zinc/06/30/86/1124063086.db2.gz JQWUGAGBTGJQLZ-WZRBSPASSA-N 1 0 295.423 3.812 20 10 CHCDRO CCC[C@@H](CCO)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000866414763 1124064844 /nfs/dbraw/zinc/06/48/44/1124064844.db2.gz KKPDLQKPWVHRRL-ZFWWWQNUSA-N 1 0 287.403 3.747 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]Cc2cccc(F)c2F)c1 ZINC000866476498 1124069607 /nfs/dbraw/zinc/06/96/07/1124069607.db2.gz OCABQTSFRZETOK-LLVKDONJSA-N 1 0 277.314 3.830 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCC23CCOCC3)c1 ZINC000866528914 1124077864 /nfs/dbraw/zinc/07/78/64/1124077864.db2.gz KEYWWMWURGQINE-GJZGRUSLSA-N 1 0 289.419 3.558 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCC23CCOCC3)c(O)c1 ZINC000866529663 1124078961 /nfs/dbraw/zinc/07/89/61/1124078961.db2.gz RJXDFCMBXDFFCP-LSDHHAIUSA-N 1 0 289.419 3.558 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1c2ccccc2CN1C)c1ccccc1O ZINC000866562730 1124083380 /nfs/dbraw/zinc/08/33/80/1124083380.db2.gz GNWZXAPBGPWMEB-ZWKOTPCHSA-N 1 0 296.414 3.620 20 10 CHCDRO C[C@H](CCC1CCCC1)[NH2+]CCc1ccc(N)cc1 ZINC000841034643 1124110586 /nfs/dbraw/zinc/11/05/86/1124110586.db2.gz IYRAFWDZBMMNRD-CQSZACIVSA-N 1 0 260.425 3.760 20 10 CHCDRO C[C@H]1C[C@H]([NH2+]CCCC(F)F)c2c1c(F)ccc2O ZINC001119607228 1131259636 /nfs/dbraw/zinc/25/96/36/1131259636.db2.gz ZDOJKWLARDQFGJ-WPRPVWTQSA-N 1 0 273.298 3.715 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCc2cc(F)ccc21 ZINC000122655993 1124519007 /nfs/dbraw/zinc/51/90/07/1124519007.db2.gz BDQPKPZYPUFGMK-LJQANCHMSA-N 1 0 298.405 3.977 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCS[C@@H]2C)cc1F ZINC000783628735 1124589899 /nfs/dbraw/zinc/58/98/99/1124589899.db2.gz LUNLMTYOWGOYJX-DOMZBBRYSA-N 1 0 296.455 3.656 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1C[C@H]2CCC[C@@H]2O1)c1cc(Cl)ccc1O ZINC000872110039 1124686456 /nfs/dbraw/zinc/68/64/56/1124686456.db2.gz VJWXYKSLFAAPAA-DZJQYVJYSA-N 1 0 295.810 3.654 20 10 CHCDRO C[C@H]([NH2+]C1CC(Nc2ccccc2)C1)c1ccccc1O ZINC000872133230 1124692305 /nfs/dbraw/zinc/69/23/05/1124692305.db2.gz NVFRQYXJUNEEHP-JEYLPNPQSA-N 1 0 282.387 3.686 20 10 CHCDRO C[C@@H]([NH2+]C1CC(Nc2ccccc2)C1)c1ccccc1O ZINC000872133229 1124692494 /nfs/dbraw/zinc/69/24/94/1124692494.db2.gz NVFRQYXJUNEEHP-IUDNXUCKSA-N 1 0 282.387 3.686 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CC[C@@H]2CSC[C@@H]2C1 ZINC000872721385 1124728133 /nfs/dbraw/zinc/72/81/33/1124728133.db2.gz FOYCPQFUFMWBLJ-CABCVRRESA-N 1 0 299.439 3.730 20 10 CHCDRO Oc1ccccc1C[NH2+]CCCn1ccc2ccccc21 ZINC000020188702 1124811371 /nfs/dbraw/zinc/81/13/71/1124811371.db2.gz XLKYUMRECGGREY-UHFFFAOYSA-N 1 0 280.371 3.527 20 10 CHCDRO Cc1cccc(O)c1C[NH+]1CCC(OC2CCCC2)CC1 ZINC000876659912 1124968013 /nfs/dbraw/zinc/96/80/13/1124968013.db2.gz JLEBCYNHEVJWCJ-UHFFFAOYSA-N 1 0 289.419 3.624 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]Cc1ccccc1COC(C)C ZINC000876914041 1124990110 /nfs/dbraw/zinc/99/01/10/1124990110.db2.gz WIGSPCMRVHPMLD-UHFFFAOYSA-N 1 0 299.414 3.915 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]Cc1ccccc1OC(F)F ZINC000876909840 1124990453 /nfs/dbraw/zinc/99/04/53/1124990453.db2.gz JSDNREKZJFBKNL-UHFFFAOYSA-N 1 0 293.313 3.592 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2ccc([C@@H]3C[C@@H]3C)o2)c(O)c1 ZINC000876946429 1124991792 /nfs/dbraw/zinc/99/17/92/1124991792.db2.gz QYMUWTZBQIPMTM-SWLSCSKDSA-N 1 0 271.360 3.707 20 10 CHCDRO Cc1ccc2c(c1)CC[C@@H]2[NH2+]Cc1ccc(C)cc1O ZINC000876973326 1124993840 /nfs/dbraw/zinc/99/38/40/1124993840.db2.gz DMGJVWDPWVEMRF-KRWDZBQOSA-N 1 0 267.372 3.786 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]Cc1nc(C(C)(C)C)cs1 ZINC000877017940 1124998428 /nfs/dbraw/zinc/99/84/28/1124998428.db2.gz XMYGDQUYNFKXTD-UHFFFAOYSA-N 1 0 290.432 3.744 20 10 CHCDRO CCc1nc([C@H](C)[NH2+]Cc2ccc(C)cc2O)cs1 ZINC000877045901 1125001200 /nfs/dbraw/zinc/00/12/00/1125001200.db2.gz FULFMBMJFYKQBS-NSHDSACASA-N 1 0 276.405 3.570 20 10 CHCDRO COc1cc(Cl)ccc1C[NH2+]Cc1c(C)cccc1O ZINC000877046838 1125002567 /nfs/dbraw/zinc/00/25/67/1125002567.db2.gz QBGRWZDTAIMWKX-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]C[C@H](c1cccnc1)C(C)C ZINC000877082499 1125007383 /nfs/dbraw/zinc/00/73/83/1125007383.db2.gz WFYVQXQLPZZOTM-INIZCTEOSA-N 1 0 284.403 3.625 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](c2ccccc2)[C@@H]2CCOC2)c(O)c1 ZINC000877133653 1125013665 /nfs/dbraw/zinc/01/36/65/1125013665.db2.gz FUJLSVVXKLLCPK-MJGOQNOKSA-N 1 0 297.398 3.568 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H]2CCCc3cn(C(C)C)nc32)c(O)c1 ZINC000877375948 1125023269 /nfs/dbraw/zinc/02/32/69/1125023269.db2.gz JOSBBHXHBAIMEU-MRXNPFEDSA-N 1 0 299.418 3.645 20 10 CHCDRO CSCc1cccc(C[NH2+]Cc2ccc(C)cc2O)c1 ZINC000877462685 1125029686 /nfs/dbraw/zinc/02/96/86/1125029686.db2.gz VXGDVMKDYILFTG-UHFFFAOYSA-N 1 0 287.428 3.853 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)CCCC(F)(F)F)c(O)c1 ZINC000877475890 1125030326 /nfs/dbraw/zinc/03/03/26/1125030326.db2.gz PRCGWYWDHCGCJW-NSHDSACASA-N 1 0 275.314 3.911 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2ccc(C3CC3)cc2)c(O)c1 ZINC000877473290 1125030557 /nfs/dbraw/zinc/03/05/57/1125030557.db2.gz KMZSCHWYLDPSNX-UHFFFAOYSA-N 1 0 267.372 3.868 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]Cc1ccc(C2CC2)cc1 ZINC000877473456 1125031209 /nfs/dbraw/zinc/03/12/09/1125031209.db2.gz MMZMLWNBRUWWEZ-UHFFFAOYSA-N 1 0 267.372 3.868 20 10 CHCDRO COc1cccc(Cl)c1C[NH2+]Cc1ccc(C)cc1O ZINC000877471995 1125031725 /nfs/dbraw/zinc/03/17/25/1125031725.db2.gz GUAXRTUMQVGFNG-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO Cc1ccc(C[N@@H+]2CC(C)(C)[C@@H]2c2ccncc2)c(O)c1 ZINC000877548698 1125042256 /nfs/dbraw/zinc/04/22/56/1125042256.db2.gz RRAOFKJHKCJCTB-KRWDZBQOSA-N 1 0 282.387 3.679 20 10 CHCDRO CSCC1CCC([NH2+]Cc2c(C)cccc2O)CC1 ZINC000877561615 1125045341 /nfs/dbraw/zinc/04/53/41/1125045341.db2.gz OZVIGVXJOBMHLF-UHFFFAOYSA-N 1 0 279.449 3.712 20 10 CHCDRO Cc1ccc(C[NH2+][C@H](C)CCCc2cccnc2)c(O)c1 ZINC000877584167 1125048732 /nfs/dbraw/zinc/04/87/32/1125048732.db2.gz PGMUUDUURNMJKM-OAHLLOKOSA-N 1 0 284.403 3.597 20 10 CHCDRO Cc1ccc(CNc2ccc(C[NH+](C)C)c(C)c2)c(O)c1 ZINC000877585411 1125048926 /nfs/dbraw/zinc/04/89/26/1125048926.db2.gz GSSLYUOFTVOKEV-UHFFFAOYSA-N 1 0 284.403 3.683 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[C@H](C)[NH2+][C@H](C)[C@H]1CC1(F)F ZINC000877592649 1125050993 /nfs/dbraw/zinc/05/09/93/1125050993.db2.gz RIZDJRARIHCSNT-WOSRLPQWSA-N 1 0 296.405 3.625 20 10 CHCDRO CC(C)(C)OC1CCC([NH2+]Cc2cc(F)ccc2O)CC1 ZINC000877684050 1125063221 /nfs/dbraw/zinc/06/32/21/1125063221.db2.gz OFOJWCDIGSISFX-UHFFFAOYSA-N 1 0 295.398 3.747 20 10 CHCDRO Cc1cccc(O)c1C[NH2+]CC1([C@@H]2CCCCO2)CCC1 ZINC000877697858 1125064348 /nfs/dbraw/zinc/06/43/48/1125064348.db2.gz OKGGLPCTSGIWJB-KRWDZBQOSA-N 1 0 289.419 3.530 20 10 CHCDRO Cc1scc(C[N@@H+]2Cc3cccc(O)c3C2)c1C ZINC000877702761 1125066331 /nfs/dbraw/zinc/06/63/31/1125066331.db2.gz GTORPPLFNGEONC-UHFFFAOYSA-N 1 0 259.374 3.586 20 10 CHCDRO C[C@H](CCC(F)(F)F)[NH2+][C@H](C)c1ccccc1O ZINC000877755633 1125072471 /nfs/dbraw/zinc/07/24/71/1125072471.db2.gz IUYDFVRXPOUCER-NXEZZACHSA-N 1 0 261.287 3.774 20 10 CHCDRO Cc1ccc(F)c(C[NH2+][C@H](C)c2ccccc2O)c1 ZINC000877756513 1125072962 /nfs/dbraw/zinc/07/29/62/1125072962.db2.gz OIEUJQQJUDXUND-GFCCVEGCSA-N 1 0 259.324 3.691 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)c2ccccc2O)c(F)c1 ZINC000877758085 1125074280 /nfs/dbraw/zinc/07/42/80/1125074280.db2.gz IHQSBOAQIVLYKK-LBPRGKRZSA-N 1 0 259.324 3.691 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)C1CCSCC1)c1ccccc1O ZINC000877758152 1125074753 /nfs/dbraw/zinc/07/47/53/1125074753.db2.gz KWPAHUYBZNFWQH-RYUDHWBXSA-N 1 0 265.422 3.575 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCO[C@H](C(C)(C)C)C1)c1ccccc1O ZINC000877756887 1125075164 /nfs/dbraw/zinc/07/51/64/1125075164.db2.gz BVOAYNYNDAAAAI-WWGRRREGSA-N 1 0 277.408 3.637 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)c2ccccc2O)cc1C ZINC000877756585 1125075256 /nfs/dbraw/zinc/07/52/56/1125075256.db2.gz VSHQVRWNKTWYBX-AWEZNQCLSA-N 1 0 255.361 3.860 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]CC[C@H]2CCCC2(F)F)c1 ZINC000878361025 1125144638 /nfs/dbraw/zinc/14/46/38/1125144638.db2.gz VTMGHPYGWZCLCD-VXGBXAGGSA-N 1 0 299.361 3.877 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2cccc(C)n2)cc1 ZINC000127228788 1125163851 /nfs/dbraw/zinc/16/38/51/1125163851.db2.gz LWJQWQCIIAUUOJ-OAHLLOKOSA-N 1 0 283.419 3.697 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC[C@@H](c3cccnc3)C2)cc1 ZINC000878753347 1125177111 /nfs/dbraw/zinc/17/71/11/1125177111.db2.gz JBYZWXGYUKGUPF-GOSISDBHSA-N 1 0 295.430 3.527 20 10 CHCDRO CCN(C)c1ccc(C[NH2+][C@@H](C)c2ccccc2O)cc1 ZINC000879650897 1125224706 /nfs/dbraw/zinc/22/47/06/1125224706.db2.gz VYGBBRCLSQCFHR-AWEZNQCLSA-N 1 0 284.403 3.699 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+][C@@H]2CCC[C@@H](C)C2)c1O ZINC000228670559 1125250767 /nfs/dbraw/zinc/25/07/67/1125250767.db2.gz LOAQSJXTHRIJCL-ZWNOBZJWSA-N 1 0 283.799 3.723 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccc(Cl)nc1 ZINC000760170169 1125285428 /nfs/dbraw/zinc/28/54/28/1125285428.db2.gz INWCJHIKSFEFIP-NSHDSACASA-N 1 0 288.778 3.521 20 10 CHCDRO COc1ccc([C@@H](C)[NH2+]Cc2ccc(C)cc2O)cc1C ZINC000897414496 1125317638 /nfs/dbraw/zinc/31/76/38/1125317638.db2.gz DTTYTZVDEREWJN-CQSZACIVSA-N 1 0 285.387 3.868 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C2CCC(OC(C)C)CC2)c1 ZINC000130297710 1125358817 /nfs/dbraw/zinc/35/88/17/1125358817.db2.gz BFUKHJDXYWAABD-UHFFFAOYSA-N 1 0 277.408 3.526 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+]CCc2ccns2)c1O ZINC000883247716 1125384466 /nfs/dbraw/zinc/38/44/66/1125384466.db2.gz TWCRHGCGDWOESG-JTQLQIEISA-N 1 0 296.823 3.704 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CC2(CC3CC3)CC2)c1O ZINC000883254201 1125385351 /nfs/dbraw/zinc/38/53/51/1125385351.db2.gz MKVRBPLMDGCDBD-LBPRGKRZSA-N 1 0 275.392 3.632 20 10 CHCDRO C[C@@H]([NH2+]CC(C)(C)CC(F)F)c1cc(F)ccc1O ZINC000883259500 1125387121 /nfs/dbraw/zinc/38/71/21/1125387121.db2.gz OOKUFTKYLDYBFH-SECBINFHSA-N 1 0 275.314 3.863 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCCC[C@@H]2CC)c1O ZINC000131545785 1125397650 /nfs/dbraw/zinc/39/76/50/1125397650.db2.gz YBBMYPOKXGZUGR-AWEZNQCLSA-N 1 0 263.381 3.555 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1cc(Cl)ccc1O)[C@@H]1CCCOC1 ZINC000883353588 1125400210 /nfs/dbraw/zinc/40/02/10/1125400210.db2.gz XXEWIPKXASMTEJ-ZOWXZIJZSA-N 1 0 297.826 3.901 20 10 CHCDRO CSCC[C@H](C)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000131610545 1125401218 /nfs/dbraw/zinc/40/12/18/1125401218.db2.gz PZMJEOOKHYKJEF-STQMWFEESA-N 1 0 266.454 3.545 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](CC)Cc2ccncc2)cc1 ZINC000027907755 1125412803 /nfs/dbraw/zinc/41/28/03/1125412803.db2.gz FGIJKZJJXRZACL-UHFFFAOYSA-N 1 0 297.446 3.950 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1nc(C)cs1 ZINC000105504043 1125436230 /nfs/dbraw/zinc/43/62/30/1125436230.db2.gz HFTOAIRNCGPPDI-HNNXBMFYSA-N 1 0 289.448 3.758 20 10 CHCDRO Cc1cc(C[N@H+]2CC[C@H](C)C(F)(F)CC2)ccc1N(C)C ZINC001139669861 1131356544 /nfs/dbraw/zinc/35/65/44/1131356544.db2.gz QKLXFEOAUOYKOV-AWEZNQCLSA-N 1 0 296.405 3.928 20 10 CHCDRO Cc1cc(C[N@H+](C)C2CCCCC2)ccc1N(C)C ZINC001139669805 1131357080 /nfs/dbraw/zinc/35/70/80/1131357080.db2.gz OTTQGWGEQPLJBY-UHFFFAOYSA-N 1 0 260.425 3.826 20 10 CHCDRO CSC(C)(C)C[C@H](C)[NH2+][C@@H](C)c1ccccc1O ZINC001258324813 1129200293 /nfs/dbraw/zinc/20/02/93/1129200293.db2.gz XIUOZJMZJLSEBO-RYUDHWBXSA-N 1 0 267.438 3.963 20 10 CHCDRO Cc1cc(C[NH+]2C[C@@H]3CCCC[C@H]3C2)ccc1N(C)C ZINC001139670023 1131358243 /nfs/dbraw/zinc/35/82/43/1131358243.db2.gz VPYBMQNBMVLNFJ-IRXDYDNUSA-N 1 0 272.436 3.683 20 10 CHCDRO COc1ccccc1[C@@H](C)[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000296095476 1129220316 /nfs/dbraw/zinc/22/03/16/1129220316.db2.gz UCKQXESTYMORDI-IUODEOHRSA-N 1 0 283.371 3.739 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCCC(C)(F)F)c1 ZINC000297449058 1129225201 /nfs/dbraw/zinc/22/52/01/1129225201.db2.gz WVZGKUONZVZHQL-NSHDSACASA-N 1 0 257.324 3.787 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CCCC2(CC2)C1 ZINC000184867467 1129260377 /nfs/dbraw/zinc/26/03/77/1129260377.db2.gz ATLZALWYJWFTAU-UHFFFAOYSA-N 1 0 267.372 3.921 20 10 CHCDRO CN(C)c1ccc(C[NH2+]CCSc2ccccc2)cc1 ZINC000037854587 1129276737 /nfs/dbraw/zinc/27/67/37/1129276737.db2.gz KLSNHBIXSIANST-UHFFFAOYSA-N 1 0 286.444 3.635 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]Cc1ccc(Cl)o1 ZINC000734509600 1129310724 /nfs/dbraw/zinc/31/07/24/1129310724.db2.gz MANZITZKACYCSB-UHFFFAOYSA-N 1 0 278.783 3.597 20 10 CHCDRO CC[C@H]([NH2+]C[C@H](C)SC)c1ccc(N(C)C)cc1 ZINC000090725668 1129326420 /nfs/dbraw/zinc/32/64/20/1129326420.db2.gz RKWTWTWVWBGHLY-WFASDCNBSA-N 1 0 266.454 3.545 20 10 CHCDRO CCCCC[C@@H](CC)[NH2+]CCc1ccc(O)c(O)c1 ZINC001258427442 1129327098 /nfs/dbraw/zinc/32/70/98/1129327098.db2.gz DLISTNVBJWOZHN-CQSZACIVSA-N 1 0 265.397 3.589 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCOC1)c1ccc(N2CCCCCC2)cc1 ZINC000090774536 1129330378 /nfs/dbraw/zinc/33/03/78/1129330378.db2.gz MOSHDOYEOGRCDG-WBVHZDCISA-N 1 0 288.435 3.507 20 10 CHCDRO CC[C@@H](CSC)[N@H+](C)Cc1cc(C)c(C)cc1O ZINC000091024762 1129341743 /nfs/dbraw/zinc/34/17/43/1129341743.db2.gz CNJPWWXIWILKIW-AWEZNQCLSA-N 1 0 267.438 3.582 20 10 CHCDRO CC[C@@H]([NH2+]Cc1nc2c(s1)CCC2)c1ccccc1O ZINC000719570642 1129344995 /nfs/dbraw/zinc/34/49/95/1129344995.db2.gz KZGOTVSQPFEJML-GFCCVEGCSA-N 1 0 288.416 3.578 20 10 CHCDRO C[N@H+](Cc1cccc2[nH]ccc21)Cc1ccccc1O ZINC000091974694 1129376471 /nfs/dbraw/zinc/37/64/71/1129376471.db2.gz SMNBVPNGKRHARY-UHFFFAOYSA-N 1 0 266.344 3.506 20 10 CHCDRO CC[N@H+](Cc1cc(C(C)(C)C)cc(O)c1O)C1CCC1 ZINC000738051529 1129390142 /nfs/dbraw/zinc/39/01/42/1129390142.db2.gz ADAKQIJQOASNEC-UHFFFAOYSA-N 1 0 277.408 3.770 20 10 CHCDRO CC[C@@H]1CCC[N@H+](Cc2c(O)ccc3ccncc32)CC1 ZINC000738257259 1129392359 /nfs/dbraw/zinc/39/23/59/1129392359.db2.gz VQYOTGVQTMKCEY-CQSZACIVSA-N 1 0 284.403 3.953 20 10 CHCDRO Cc1ccc([C@H](C)C[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC000738435172 1129393986 /nfs/dbraw/zinc/39/39/86/1129393986.db2.gz BMQOTEUDRMEEIV-OAHLLOKOSA-N 1 0 281.399 3.823 20 10 CHCDRO Cc1ccc(O)c(C[N@H+]2C[C@@H](C)O[C@H](c3ccccc3)C2)c1 ZINC000092486525 1129395652 /nfs/dbraw/zinc/39/56/52/1129395652.db2.gz HVCFHJHLHWILHV-BEFAXECRSA-N 1 0 297.398 3.663 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CC[C@H]2CCCCO2)cc1 ZINC000248422048 1129417491 /nfs/dbraw/zinc/41/74/91/1129417491.db2.gz YLIAIHBCFGIBRZ-CRAIPNDOSA-N 1 0 290.451 3.753 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCC[C@@H](O)C1)c1ccc2ccccc2c1O ZINC000248487978 1129419374 /nfs/dbraw/zinc/41/93/74/1129419374.db2.gz GLQRBBFBPZODTN-SQWLQELKSA-N 1 0 299.414 3.747 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CCCO[C@H]2C(C)C)c1 ZINC000248484522 1129419909 /nfs/dbraw/zinc/41/99/09/1129419909.db2.gz DJJZFMUCDPPXBW-MPGHIAIKSA-N 1 0 291.435 3.802 20 10 CHCDRO COc1ccc2ccc(O)c(C[N@@H+]3C[C@@H](C)C[C@H]3C)c2c1 ZINC000740860579 1129420812 /nfs/dbraw/zinc/42/08/12/1129420812.db2.gz QWHCKEBXBPBETR-QWHCGFSZSA-N 1 0 285.387 3.784 20 10 CHCDRO Cc1ccc(O)c(C[N@H+]2CCCC[C@H]2c2cccn2C)c1 ZINC000093845513 1129428448 /nfs/dbraw/zinc/42/84/48/1129428448.db2.gz VGHDGPYBMCKZMK-KRWDZBQOSA-N 1 0 284.403 3.766 20 10 CHCDRO CCO[C@@H]1C[C@H]([NH2+][C@H](CC)c2ccccc2O)C12CCC2 ZINC000248894978 1129430639 /nfs/dbraw/zinc/43/06/39/1129430639.db2.gz UPNGIJQUSVSVEX-HYVNUMGLSA-N 1 0 289.419 3.781 20 10 CHCDRO Cc1noc(C)c1[C@@H](C)[NH2+][C@H](C)c1cc(F)ccc1O ZINC000094618498 1129448471 /nfs/dbraw/zinc/44/84/71/1129448471.db2.gz MXLRLZDTOUCPPL-RKDXNWHRSA-N 1 0 278.327 3.548 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCc2ccccc2C1)c1cc(F)ccc1O ZINC000094618069 1129448552 /nfs/dbraw/zinc/44/85/52/1129448552.db2.gz VUKXPMSTGKLXQJ-LRDDRELGSA-N 1 0 285.362 3.739 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CCn3cccc3[C@H]2C)cc1 ZINC000741752655 1129451116 /nfs/dbraw/zinc/45/11/16/1129451116.db2.gz DFIVDBGYZFHZFX-OAHLLOKOSA-N 1 0 283.419 3.521 20 10 CHCDRO COc1cc(Cl)cc(C[N@@H+]2CCC(C)=C(C)C2)c1O ZINC000796017643 1129463943 /nfs/dbraw/zinc/46/39/43/1129463943.db2.gz JBSCGRMFRISYHZ-UHFFFAOYSA-N 1 0 281.783 3.596 20 10 CHCDRO C[C@H]1CCC[C@H](C)[N@H+](Cc2c(O)ccc3ccncc32)C1 ZINC000742154175 1129468938 /nfs/dbraw/zinc/46/89/38/1129468938.db2.gz FBUNGRJJXAUDBA-KBPBESRZSA-N 1 0 284.403 3.951 20 10 CHCDRO Cc1csc([C@@H](C)[NH2+]Cc2cc(C)c(C)cc2O)n1 ZINC000742369878 1129471687 /nfs/dbraw/zinc/47/16/87/1129471687.db2.gz ZHGSHZGKVNIXRW-GFCCVEGCSA-N 1 0 276.405 3.625 20 10 CHCDRO Cc1cc(O)c(C[NH2+]Cc2ccc(Cl)o2)cc1C ZINC000742366299 1129472043 /nfs/dbraw/zinc/47/20/43/1129472043.db2.gz SVTPEWQMAUSSPX-UHFFFAOYSA-N 1 0 265.740 3.545 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C2(c3ccc(F)cc3)CC2)cc1C ZINC000742370017 1129472337 /nfs/dbraw/zinc/47/23/37/1129472337.db2.gz BYROKQGHVSMSOB-UHFFFAOYSA-N 1 0 285.362 3.927 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2C[C@@H]2Cc2ccccc2)cc1F ZINC000742375692 1129475489 /nfs/dbraw/zinc/47/54/89/1129475489.db2.gz VRGTVGBAIYLAGI-FUHWJXTLSA-N 1 0 298.405 3.613 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+][C@@H]2CC[C@@H]3CCC[C@@H]3C2)c1 ZINC000742378957 1129476108 /nfs/dbraw/zinc/47/61/08/1129476108.db2.gz PFOZZWDNKLKVOR-SQWLQELKSA-N 1 0 289.419 3.849 20 10 CHCDRO COc1ccc(C[NH2+]C[C@@H](C)Oc2ccccc2C)cc1C ZINC000742379556 1129476292 /nfs/dbraw/zinc/47/62/92/1129476292.db2.gz WMHCXYOEHYKASY-MRXNPFEDSA-N 1 0 299.414 3.869 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+][C@@H]2CC[C@@H]3CCC[C@H]3C2)c1 ZINC000742378956 1129476315 /nfs/dbraw/zinc/47/63/15/1129476315.db2.gz PFOZZWDNKLKVOR-OFQRWUPVSA-N 1 0 289.419 3.849 20 10 CHCDRO CC[C@H]([NH2+]CCc1ncc(C)cc1C)c1ccccc1O ZINC000828156126 1131378909 /nfs/dbraw/zinc/37/89/09/1131378909.db2.gz WPVASPCUXGWXAQ-INIZCTEOSA-N 1 0 284.403 3.687 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC3(CCCC3)C2)cc1C ZINC000743391190 1129521563 /nfs/dbraw/zinc/52/15/63/1129521563.db2.gz ZHEVBEHOOOSFCV-UHFFFAOYSA-N 1 0 259.393 3.775 20 10 CHCDRO Oc1cc2c(cc1C[N@@H+]1CC[C@@H]1c1cccc(F)c1)CCC2 ZINC000743391699 1129522262 /nfs/dbraw/zinc/52/22/62/1129522262.db2.gz WSXIVBUIFPWIGV-GOSISDBHSA-N 1 0 297.373 3.967 20 10 CHCDRO CCC[N@H+](Cc1cccc(C)n1)Cc1ccccc1O ZINC000743870676 1129542669 /nfs/dbraw/zinc/54/26/69/1129542669.db2.gz ZODXQPSDIVKUGG-UHFFFAOYSA-N 1 0 270.376 3.508 20 10 CHCDRO C[C@@H]1CCC[C@@H]([NH2+]Cc2ccc3c(c2)CCO3)[C@H]1C ZINC000252213444 1129558840 /nfs/dbraw/zinc/55/88/40/1129558840.db2.gz WZIZOVHYPNVVCX-DVOMOZLQSA-N 1 0 259.393 3.536 20 10 CHCDRO CC(C)C[C@@H]1CC[N@H+](Cc2cc3c(cc2O)CCC3)C1 ZINC000744437582 1129577695 /nfs/dbraw/zinc/57/76/95/1129577695.db2.gz WRGGANFVWCUDFI-AWEZNQCLSA-N 1 0 273.420 3.749 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2CC[C@@H](CC(C)C)C2)cc1C ZINC000744437384 1129578210 /nfs/dbraw/zinc/57/82/10/1129578210.db2.gz RBQDRRULHBSSKV-HNNXBMFYSA-N 1 0 261.409 3.877 20 10 CHCDRO 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3.953 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2sccc2Cl)c1 ZINC000801937542 1129961472 /nfs/dbraw/zinc/96/14/72/1129961472.db2.gz PLMIQQFRRACTRF-VIFPVBQESA-N 1 0 297.807 3.967 20 10 CHCDRO CCCc1cccc(C[NH2+]Cc2ccccc2O)c1 ZINC000771841042 1129990251 /nfs/dbraw/zinc/99/02/51/1129990251.db2.gz RQVAQFBDKWKGAJ-UHFFFAOYSA-N 1 0 255.361 3.635 20 10 CHCDRO C[C@@H]([NH2+]CC[C@@H]1C[C@@H](C)O[C@@H](C)C1)c1cc(F)ccc1O ZINC000802309033 1129991456 /nfs/dbraw/zinc/99/14/56/1129991456.db2.gz MSTRTMKDKNWWCP-XJFOESAGSA-N 1 0 295.398 3.776 20 10 CHCDRO CCO[C@H]1CCC[N@H+](Cc2ccc(N(CC)CC)cc2)C1 ZINC000771934515 1129996430 /nfs/dbraw/zinc/99/64/30/1129996430.db2.gz ARMXMGWRFAFCLJ-SFHVURJKSA-N 1 0 290.451 3.534 20 10 CHCDRO C[C@@H](Nc1cc[nH+]c2ccccc12)c1ccc(N(C)C)cc1 ZINC000772294647 1130016194 /nfs/dbraw/zinc/01/61/94/1130016194.db2.gz COXXGWOUHOLLLS-CQSZACIVSA-N 1 0 291.398 3.896 20 10 CHCDRO CCCC[N@@H+](Cc1ccccc1O)C[C@H]1CCC=CO1 ZINC000802657751 1130028082 /nfs/dbraw/zinc/02/80/82/1130028082.db2.gz 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CC1(C)C[C@@H]([NH2+][C@H]2CCc3cccc(O)c32)CCS1 ZINC000903281822 1130145405 /nfs/dbraw/zinc/14/54/05/1130145405.db2.gz INEIOACEPDDKKQ-STQMWFEESA-N 1 0 277.433 3.643 20 10 CHCDRO COC(C)(C)[C@H](C)[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000903329673 1130157424 /nfs/dbraw/zinc/15/74/24/1130157424.db2.gz CPTUIMZLLHAOGY-ZJUUUORDSA-N 1 0 271.788 3.510 20 10 CHCDRO C[C@@H]([NH2+][C@H](c1ccccn1)C1CC1)c1ccc(N(C)C)cc1 ZINC000903341307 1130162880 /nfs/dbraw/zinc/16/28/80/1130162880.db2.gz XLAMYHDHSHAZRZ-KUHUBIRLSA-N 1 0 295.430 3.950 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCOC12CCCC2)c1ccc(C)cc1O ZINC000903387063 1130169499 /nfs/dbraw/zinc/16/94/99/1130169499.db2.gz FUBJOUGOWMTRLJ-RDJZCZTQSA-N 1 0 289.419 3.843 20 10 CHCDRO CC[C@@H]([NH2+]CCc1cccnc1C)c1ccc(C)cc1O ZINC000903419258 1130174322 /nfs/dbraw/zinc/17/43/22/1130174322.db2.gz UCGYAPHBIYVNDZ-QGZVFWFLSA-N 1 0 284.403 3.687 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](c2ccncc2)C2CC2)c1 ZINC000903426600 1130175009 /nfs/dbraw/zinc/17/50/09/1130175009.db2.gz BFGLPWIPXSUZPR-SCLBCKFNSA-N 1 0 282.387 3.898 20 10 CHCDRO C[C@@H]([NH2+][C@@H](c1ccncc1)C1CC1)c1cc(F)ccc1O ZINC000903428983 1130176078 /nfs/dbraw/zinc/17/60/78/1130176078.db2.gz RIUFIUOFIMFPSP-PIGZYNQJSA-N 1 0 286.350 3.728 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CCc2ccccc2)c(O)c1 ZINC000788497129 1130190204 /nfs/dbraw/zinc/19/02/04/1130190204.db2.gz DUJDYVLMAWFTEC-HNNXBMFYSA-N 1 0 269.388 3.902 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]Cc2ccccc2)c(O)c1 ZINC000788500233 1130191380 /nfs/dbraw/zinc/19/13/80/1130191380.db2.gz ZNHHLWILHLZPSW-AWEZNQCLSA-N 1 0 255.361 3.860 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CCSC(F)(F)F)c(O)c1 ZINC000788556962 1130194843 /nfs/dbraw/zinc/19/48/43/1130194843.db2.gz IIKWKZFAKYZYTN-JTQLQIEISA-N 1 0 293.354 3.913 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@H](CCO)CC(C)C)c(O)c1 ZINC000788611371 1130195345 /nfs/dbraw/zinc/19/53/45/1130195345.db2.gz NAPGUYPMMZKJDE-JKSUJKDBSA-N 1 0 293.451 3.704 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CCOC2CCCC2)c(O)c1 ZINC000788572188 1130195587 /nfs/dbraw/zinc/19/55/87/1130195587.db2.gz MUDOZLJCMFTDDE-AWEZNQCLSA-N 1 0 277.408 3.619 20 10 CHCDRO CSC(C)(C)C[NH2+][C@H](C)c1c(C)cc(C)cc1O ZINC000788615304 1130197887 /nfs/dbraw/zinc/19/78/87/1130197887.db2.gz YVOCGNUJOLZCBR-GFCCVEGCSA-N 1 0 267.438 3.801 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+][C@@H]2C[C@@H](C)O[C@@H](C)C2)c(O)c1 ZINC000788684203 1130200046 /nfs/dbraw/zinc/20/00/46/1130200046.db2.gz BMVNWZKJLFSSCH-XGUBFFRZSA-N 1 0 277.408 3.616 20 10 CHCDRO CCSCCC[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000788825219 1130213477 /nfs/dbraw/zinc/21/34/77/1130213477.db2.gz XCPFEVUSGLRBOH-ZDUSSCGKSA-N 1 0 267.438 3.803 20 10 CHCDRO C[C@@H]1CC[C@@H](C[N@H+](Cc2ccccc2O)C2CCCC2)O1 ZINC000789327830 1130243993 /nfs/dbraw/zinc/24/39/93/1130243993.db2.gz XAQJEBUMEVYVEH-PBHICJAKSA-N 1 0 289.419 3.704 20 10 CHCDRO CC(C)(C)N1CC[C@@H]([NH2+]Cc2ccc3ccccc3c2O)C1 ZINC000826868364 1130298908 /nfs/dbraw/zinc/29/89/08/1130298908.db2.gz RRZCWFPAYXRCGU-MRXNPFEDSA-N 1 0 298.430 3.508 20 10 CHCDRO CC[C@H]([NH2+]CCCC1CCOCC1)c1ccccc1O ZINC000790324641 1130306201 /nfs/dbraw/zinc/30/62/01/1130306201.db2.gz LOTRLNAXMNXKQC-INIZCTEOSA-N 1 0 277.408 3.640 20 10 CHCDRO COc1ccc(O)c(CNc2[nH+]ccc(C)c2C2CC2)c1 ZINC000827011776 1130337713 /nfs/dbraw/zinc/33/77/13/1130337713.db2.gz ORIBRSRWZAERST-UHFFFAOYSA-N 1 0 284.359 3.594 20 10 CHCDRO CC[C@]1([NH2+]Cc2cc(-c3ccccc3)ccc2O)CCOC1 ZINC000791002403 1130342821 /nfs/dbraw/zinc/34/28/21/1130342821.db2.gz HNUXUOBGAHEKEC-IBGZPJMESA-N 1 0 297.398 3.718 20 10 CHCDRO C[C@H]1C[C@@H]1C[NH2+]Cc1ccc(N(C)C)cc1C(F)(F)F ZINC000792917830 1130506895 /nfs/dbraw/zinc/50/68/95/1130506895.db2.gz LNYSNFDRCFFLKZ-CMPLNLGQSA-N 1 0 286.341 3.517 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2CC[C@H](C(F)(F)F)[C@@H]2C)cc1C ZINC000793231269 1130532563 /nfs/dbraw/zinc/53/25/63/1130532563.db2.gz LXVWIFMHYQCPIC-AAEUAGOBSA-N 1 0 287.325 3.782 20 10 CHCDRO Fc1ncccc1C[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000793284609 1130537915 /nfs/dbraw/zinc/53/79/15/1130537915.db2.gz JEXAJCPKTARTFK-UHFFFAOYSA-N 1 0 299.393 3.501 20 10 CHCDRO COC1(C[NH2+]Cc2cc(C)c(C)cc2O)CCC(C)CC1 ZINC000793290344 1130538775 /nfs/dbraw/zinc/53/87/75/1130538775.db2.gz FPFJICRZOYBDEM-UHFFFAOYSA-N 1 0 291.435 3.694 20 10 CHCDRO COc1cccc([C@]2(C)CC[N@H+](Cc3ccccc3O)C2)c1 ZINC000827283955 1130544907 /nfs/dbraw/zinc/54/49/07/1130544907.db2.gz RLNMMUAAYQFABX-LJQANCHMSA-N 1 0 297.398 3.564 20 10 CHCDRO CCOCc1cc(C[NH2+]C[C@@H]2CC[C@H](C)C2)ccc1OC ZINC000793346148 1130548600 /nfs/dbraw/zinc/54/86/00/1130548600.db2.gz DBGLREMFBFABSP-LSDHHAIUSA-N 1 0 291.435 3.758 20 10 CHCDRO CCOc1cccc(C[N@H+](CC2CC2)CC2CCC2)c1O ZINC000793388693 1130551325 /nfs/dbraw/zinc/55/13/25/1130551325.db2.gz IBGYITKGHIJHQR-UHFFFAOYSA-N 1 0 289.419 3.803 20 10 CHCDRO COc1ccc(C[NH2+]C[C@@H](C)CCc2ccccc2)c(O)c1 ZINC000793389035 1130552133 /nfs/dbraw/zinc/55/21/33/1130552133.db2.gz TWESBAIDBPDSDL-HNNXBMFYSA-N 1 0 299.414 3.759 20 10 CHCDRO CC1(C)[C@H](Oc2ccccc2)C[C@@H]1[NH2+]Cc1ccccc1O ZINC000793530164 1130572201 /nfs/dbraw/zinc/57/22/01/1130572201.db2.gz ZEXUNRJJHULZPE-ZWKOTPCHSA-N 1 0 297.398 3.728 20 10 CHCDRO CCC[C@@H]1C[N@H+](Cc2cc(C(C)C)c(C)cc2O)CCO1 ZINC000758389923 1130609419 /nfs/dbraw/zinc/60/94/19/1130609419.db2.gz LKNUBOFRLFDRCA-MRXNPFEDSA-N 1 0 291.435 3.825 20 10 CHCDRO CC1(C2CC2)CC[NH+](Cc2c(O)ccc3ccncc32)CC1 ZINC000811784970 1130647060 /nfs/dbraw/zinc/64/70/60/1130647060.db2.gz QEKLJBKPCICJMS-UHFFFAOYSA-N 1 0 296.414 3.953 20 10 CHCDRO CC[C@H](C)[C@H](C)Oc1ccc(N2CC[NH+](CC)CC2)cc1 ZINC001234658208 1130669601 /nfs/dbraw/zinc/66/96/01/1130669601.db2.gz XOQPXDNRAUHMBL-HOTGVXAUSA-N 1 0 290.451 3.642 20 10 CHCDRO Cc1cccc(C[N@H+]2C[C@H](C(F)(F)F)CC[C@H]2C)c1O ZINC000780793147 1130692983 /nfs/dbraw/zinc/69/29/83/1130692983.db2.gz KNCXXURSBXRSDP-DGCLKSJQSA-N 1 0 287.325 3.863 20 10 CHCDRO CC[NH+](CC)CCSc1ncc(C(C)(C)C)s1 ZINC000780814574 1130693034 /nfs/dbraw/zinc/69/30/34/1130693034.db2.gz SUVKERKAYAURFY-UHFFFAOYSA-N 1 0 272.483 3.875 20 10 CHCDRO CSc1ccccc1C[N@H+](C)Cc1ccccc1O ZINC000781337035 1130715670 /nfs/dbraw/zinc/71/56/70/1130715670.db2.gz TXCQDEPVHMSPBD-UHFFFAOYSA-N 1 0 273.401 3.746 20 10 CHCDRO Cc1cc(Br)c([O-])c(C[NH+]2[C@@H](C)CC[C@@H]2C)c1 ZINC000781910017 1130747010 /nfs/dbraw/zinc/74/70/10/1130747010.db2.gz SXBSFUKYNFDDNZ-QWRGUYRKSA-N 1 0 298.224 3.836 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1CCc2ccccc2C1)c1ccccc1O ZINC000782053105 1130753512 /nfs/dbraw/zinc/75/35/12/1130753512.db2.gz OSSRJPQJRWDACH-LSDHHAIUSA-N 1 0 281.399 3.848 20 10 CHCDRO Nc1ccc(C[NH+]2CCC(c3ccc(F)cc3)CC2)cc1 ZINC001235673178 1130764188 /nfs/dbraw/zinc/76/41/88/1130764188.db2.gz CSAHTGCPGSHVQN-UHFFFAOYSA-N 1 0 284.378 3.788 20 10 CHCDRO CCOCc1cc(C[NH2+][C@H](C)C2(C)CC2)ccc1OC ZINC000747853066 1130764597 /nfs/dbraw/zinc/76/45/97/1130764597.db2.gz XEDOMIARRWCQQV-CYBMUJFWSA-N 1 0 277.408 3.510 20 10 CHCDRO Nc1ccc(C[N@@H+]2CCC[C@@H](Cc3ccccc3)C2)cc1 ZINC001235672752 1130764972 /nfs/dbraw/zinc/76/49/72/1130764972.db2.gz GJABMJWCTLDQPK-SFHVURJKSA-N 1 0 280.415 3.724 20 10 CHCDRO CC(C)(C)c1ccc(C[N@@H+]2CC[C@@](C)(F)[C@H](F)C2)c(O)c1 ZINC001235673844 1130765226 /nfs/dbraw/zinc/76/52/26/1130765226.db2.gz AJIOQVFEGCBEHZ-NVXWUHKLSA-N 1 0 297.389 3.962 20 10 CHCDRO C[N@H+](CCc1ccccn1)Cc1ccc(C(C)(C)C)cc1O ZINC001235676054 1130765610 /nfs/dbraw/zinc/76/56/10/1130765610.db2.gz OWBGURIYZRTOJZ-UHFFFAOYSA-N 1 0 298.430 3.759 20 10 CHCDRO CC(C)(C)c1ccc(C[NH+]2C[C@@H]3CCC[C@H]3C2)c(O)c1 ZINC001235674873 1130766734 /nfs/dbraw/zinc/76/67/34/1130766734.db2.gz HKYPVEHVQNOLCD-KBPBESRZSA-N 1 0 273.420 3.922 20 10 CHCDRO COC[C@H]1CCCC[N@@H+]1Cc1ccc(C(C)(C)C)cc1O ZINC001235676964 1130766757 /nfs/dbraw/zinc/76/67/57/1130766757.db2.gz YTLGWJHJWRUFCD-MRXNPFEDSA-N 1 0 291.435 3.691 20 10 CHCDRO CC(C)(C)c1ccc(C[N@@H+]2CC[C@@]3(CC3(F)F)C2)c(O)c1 ZINC001235685568 1130768069 /nfs/dbraw/zinc/76/80/69/1130768069.db2.gz QUDXQQSDTVPNNR-MRXNPFEDSA-N 1 0 295.373 3.921 20 10 CHCDRO CC(C)(C)c1ccc(C[N@@H+]2CCc3ccncc3C2)c(O)c1 ZINC001235686200 1130768277 /nfs/dbraw/zinc/76/82/77/1130768277.db2.gz YHGJEBXMWIMHTR-UHFFFAOYSA-N 1 0 296.414 3.643 20 10 CHCDRO CCCO[C@H]1CC[N@H+](Cc2ccc(C(C)(C)C)cc2O)C1 ZINC001235683500 1130768688 /nfs/dbraw/zinc/76/86/88/1130768688.db2.gz GRKVDLPYXGTMHC-INIZCTEOSA-N 1 0 291.435 3.691 20 10 CHCDRO Cc1ccc(O[C@@H]2CCC[N@H+](Cc3ccc(N)cc3)C2)cc1 ZINC001235687988 1130769487 /nfs/dbraw/zinc/76/94/87/1130769487.db2.gz LHYVSQIGNDBXGD-LJQANCHMSA-N 1 0 296.414 3.621 20 10 CHCDRO CCc1ccccc1C[N@H+](C)Cc1ccccc1O ZINC000782512324 1130782088 /nfs/dbraw/zinc/78/20/88/1130782088.db2.gz FMKGLAANZUFIFP-UHFFFAOYSA-N 1 0 255.361 3.587 20 10 CHCDRO COCC(C)(C)C[NH2+][C@H](C)c1cc(Cl)cc(C)c1O ZINC000813883358 1130794649 /nfs/dbraw/zinc/79/46/49/1130794649.db2.gz UAIGBJXRWKQJFF-LLVKDONJSA-N 1 0 285.815 3.677 20 10 CHCDRO C[C@@H]1CC[C@H]1[NH2+]Cc1ccc(N2CCC(C)CC2)cc1 ZINC000783241733 1130804906 /nfs/dbraw/zinc/80/49/06/1130804906.db2.gz XCCDPYNMPYXGRP-CRAIPNDOSA-N 1 0 272.436 3.811 20 10 CHCDRO C[C@H]1CC[C@@H]1[NH2+]Cc1ccc(N2CCC(C)CC2)cc1 ZINC000783241736 1130805685 /nfs/dbraw/zinc/80/56/85/1130805685.db2.gz XCCDPYNMPYXGRP-YJBOKZPZSA-N 1 0 272.436 3.811 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H](C)c1cccc(F)c1)c1ccccc1O ZINC000783500443 1130831527 /nfs/dbraw/zinc/83/15/27/1130831527.db2.gz GQXDJWKGXBCCNN-CHWSQXEVSA-N 1 0 273.351 3.986 20 10 CHCDRO CCC(CC)[C@@H](CC[NH2+][C@H](C)c1ccccc1O)OC ZINC000783519319 1130833912 /nfs/dbraw/zinc/83/39/12/1130833912.db2.gz RLSZAXGZBUUYSB-CXAGYDPISA-N 1 0 279.424 3.884 20 10 CHCDRO CCOc1ccc(C[NH+](C2CCC2)C2CCC2)c(O)c1 ZINC000814177921 1130834644 /nfs/dbraw/zinc/83/46/44/1130834644.db2.gz VCVOWTFTAFNWOG-UHFFFAOYSA-N 1 0 275.392 3.698 20 10 CHCDRO CN(C)c1ccc(C[NH+](C2CCC2)C2CCC2)cc1F ZINC000814178032 1130834909 /nfs/dbraw/zinc/83/49/09/1130834909.db2.gz ZDENHOMFEJHFEM-UHFFFAOYSA-N 1 0 276.399 3.799 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2cc(F)ccc2O)[C@@H]2CCCC[C@@H]21 ZINC000783592153 1130842215 /nfs/dbraw/zinc/84/22/15/1130842215.db2.gz DGEMNQLAZUNGGF-KCPJHIHWSA-N 1 0 263.356 3.542 20 10 CHCDRO Cc1ccc(O)c(C[N@H+]2C[C@H](C)[C@@H]3CCCC[C@H]32)c1 ZINC000783593531 1130842472 /nfs/dbraw/zinc/84/24/72/1130842472.db2.gz VPXYHHVXVDHGJR-CWRNSKLLSA-N 1 0 259.393 3.711 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CC(C)(C)[C@@H]2c2ccncc2)cc1C ZINC000814229993 1130849917 /nfs/dbraw/zinc/84/99/17/1130849917.db2.gz IRYWBAYEDZKMJD-SFHVURJKSA-N 1 0 296.414 3.987 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C[C@H](c2ccccc2)C2CC2)c1 ZINC000814298653 1130862105 /nfs/dbraw/zinc/86/21/05/1130862105.db2.gz ZKCWRBFQHRZGLG-GOSISDBHSA-N 1 0 281.399 3.984 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+][C@H]2CC[C@H](CC)CC2)c1 ZINC000814299864 1130862383 /nfs/dbraw/zinc/86/23/83/1130862383.db2.gz DNCGKBLHPBKZKK-CTYIDZIISA-N 1 0 277.408 3.849 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)C[C@H]2CC=CCC2)cc1C ZINC000784012783 1130867435 /nfs/dbraw/zinc/86/74/35/1130867435.db2.gz FYIONJCZCQZSIQ-HNNXBMFYSA-N 1 0 259.393 3.797 20 10 CHCDRO COc1cc(C[N@@H+]2CC[C@H](C(C)(C)C)C2)c(O)cc1C ZINC000784030732 1130870133 /nfs/dbraw/zinc/87/01/33/1130870133.db2.gz HWLDZPARZMFYKY-AWEZNQCLSA-N 1 0 277.408 3.577 20 10 CHCDRO Nc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(F)cc2F)cc1 ZINC001236128242 1130871499 /nfs/dbraw/zinc/87/14/99/1130871499.db2.gz IWBUICAXINNDFE-KRWDZBQOSA-N 1 0 288.341 3.884 20 10 CHCDRO CCOc1ccc(O)c(C[NH2+]C[C@@H](SC)C(C)(C)C)c1 ZINC000784626684 1130913676 /nfs/dbraw/zinc/91/36/76/1130913676.db2.gz ZJZSLESSCVGDAT-OAHLLOKOSA-N 1 0 297.464 3.658 20 10 CHCDRO Cc1ccc(C[NH+]2CCC(c3ccc(N)cc3)CC2)c(O)c1 ZINC001236334174 1130915146 /nfs/dbraw/zinc/91/51/46/1130915146.db2.gz AAFRDXOQGQTCFY-UHFFFAOYSA-N 1 0 296.414 3.662 20 10 CHCDRO CC[N@H+](Cc1ccoc1)Cc1ccc(N(C)C)c(C)c1 ZINC000815034716 1130953681 /nfs/dbraw/zinc/95/36/81/1130953681.db2.gz ZNCIXWDPVGSOBD-UHFFFAOYSA-N 1 0 272.392 3.676 20 10 CHCDRO CCc1ccc([C@@H](O)C[NH2+][C@@H](C)c2ccc(C)cc2O)cc1 ZINC000797027766 1130954189 /nfs/dbraw/zinc/95/41/89/1130954189.db2.gz VHCLCYLZTCMZDE-LIRRHRJNSA-N 1 0 299.414 3.647 20 10 CHCDRO CCc1ccc([C@@H](O)C[NH2+][C@H](C)c2cc(C)ccc2O)cc1 ZINC000797027497 1130954410 /nfs/dbraw/zinc/95/44/10/1130954410.db2.gz UQAALQJVSDGIPB-KUHUBIRLSA-N 1 0 299.414 3.647 20 10 CHCDRO Cc1cc(C[N@@H+]2CCC[C@H]2c2ccccn2)ccc1N(C)C ZINC000815060788 1130955210 /nfs/dbraw/zinc/95/52/10/1130955210.db2.gz SMUVVXFNEHDHLG-IBGZPJMESA-N 1 0 295.430 3.793 20 10 CHCDRO CSCC[C@H](C)[N@H+](C)Cc1ccc(N(C)C)c(C)c1 ZINC000815070548 1130955766 /nfs/dbraw/zinc/95/57/66/1130955766.db2.gz YQJZCQCCQNKDJH-AWEZNQCLSA-N 1 0 280.481 3.634 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2C=CCCCCC2)c1 ZINC000815083432 1130957240 /nfs/dbraw/zinc/95/72/40/1130957240.db2.gz YDVPXOCFQZHVTN-UONOGXRCSA-N 1 0 275.392 3.940 20 10 CHCDRO Cc1cc(C[NH2+]C2(c3cccc(F)c3)CC2)ccc1N(C)C ZINC000815083490 1130957761 /nfs/dbraw/zinc/95/77/61/1130957761.db2.gz PHZMATFGGKWHOM-UHFFFAOYSA-N 1 0 298.405 3.979 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)[C@H](O)c1ccc(C)cc1)c1ccccc1O ZINC000797061394 1130957960 /nfs/dbraw/zinc/95/79/60/1130957960.db2.gz PXCASXXCQVZULN-LJHODMEESA-N 1 0 299.414 3.863 20 10 CHCDRO 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Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H]2COc3ccccc32)c(O)c1 ZINC000815626728 1131011710 /nfs/dbraw/zinc/01/17/10/1131011710.db2.gz KQPQXRXGVCQNCC-HUUCEWRRSA-N 1 0 297.398 3.836 20 10 CHCDRO Fc1cccc([C@H]2C[C@H]([NH2+]Cc3ccc4c(c3)CCO4)C2)c1 ZINC000797876617 1131011782 /nfs/dbraw/zinc/01/17/82/1131011782.db2.gz CSKMIPUAAWQRNQ-SAABIXHNSA-N 1 0 297.373 3.796 20 10 CHCDRO C[C@@H](F)CC[NH2+][C@H](C)c1cc2c(cc1O)CCCC2 ZINC000815645458 1131014849 /nfs/dbraw/zinc/01/48/49/1131014849.db2.gz GEVMIJDHMBMGMI-VXGBXAGGSA-N 1 0 265.372 3.670 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]C2CC(C(C)(C)C)C2)c1 ZINC000815642917 1131015204 /nfs/dbraw/zinc/01/52/04/1131015204.db2.gz OYBCSNKVWXBKAG-HIFPTAJRSA-N 1 0 277.408 3.876 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](C)c2cc[nH]c(=O)c2)cc1 ZINC000815643310 1131015707 /nfs/dbraw/zinc/01/57/07/1131015707.db2.gz ZGZMEEUYHZCXKN-KGLIPLIRSA-N 1 0 299.418 3.655 20 10 CHCDRO CC[C@H]([NH2+]C1(C(C)C)CC1)c1ccc(N(C)C)cc1 ZINC000815647477 1131016939 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ZINC001237049431 1131040537 /nfs/dbraw/zinc/04/05/37/1131040537.db2.gz OVNVOIGCQAWDAT-AWEZNQCLSA-N 1 0 295.423 3.545 20 10 CHCDRO COCC[C@H]1CCCC[N@@H+]1Cc1ccc(C(C)C)cc1O ZINC001237054435 1131044196 /nfs/dbraw/zinc/04/41/96/1131044196.db2.gz XYGPOBRAHPQGGU-QGZVFWFLSA-N 1 0 291.435 3.907 20 10 CHCDRO C[N@@H+](Cc1cc(C(F)(F)F)ccc1O)C[C@H]1CC1(C)C ZINC001237140984 1131057452 /nfs/dbraw/zinc/05/74/52/1131057452.db2.gz QCTZZQSNCOJWNB-GFCCVEGCSA-N 1 0 287.325 3.889 20 10 CHCDRO CCO[C@H]1CCC[N@H+](Cc2ccc3ccccc3c2O)C1 ZINC000816477700 1131096479 /nfs/dbraw/zinc/09/64/79/1131096479.db2.gz HOLUPVKZRXKXJB-INIZCTEOSA-N 1 0 285.387 3.546 20 10 CHCDRO C[C@H](C1CC1)[N@H+](C)Cc1ccc2ccccc2c1O ZINC000816488445 1131098974 /nfs/dbraw/zinc/09/89/74/1131098974.db2.gz UFWDKUBWQCNEIV-GFCCVEGCSA-N 1 0 255.361 3.776 20 10 CHCDRO COCC[N@H+](Cc1ccc2ccccc2c1O)C1CCCC1 ZINC000816489935 1131100808 /nfs/dbraw/zinc/10/08/08/1131100808.db2.gz HSKGCTRIZFMJPG-UHFFFAOYSA-N 1 0 299.414 3.936 20 10 CHCDRO CC(C)C[C@H]1COCC[N@@H+]1Cc1ccc2ccccc2c1O ZINC000816509204 1131104041 /nfs/dbraw/zinc/10/40/41/1131104041.db2.gz HLKXHVWANZJBCW-KRWDZBQOSA-N 1 0 299.414 3.792 20 10 CHCDRO COc1ccccc1[C@@H](C)[N@H+](C)Cc1c(C)cccc1O ZINC001237488156 1131104237 /nfs/dbraw/zinc/10/42/37/1131104237.db2.gz RVYSWLFJRRWBEA-CQSZACIVSA-N 1 0 285.387 3.902 20 10 CHCDRO Cc1ccccc1O[C@H]1CC[N@H+](Cc2c(C)cccc2O)C1 ZINC001237487242 1131104282 /nfs/dbraw/zinc/10/42/82/1131104282.db2.gz HEEBOOKVNRTEAF-INIZCTEOSA-N 1 0 297.398 3.662 20 10 CHCDRO CC(C)COCCC[NH2+]Cc1ccc2ccccc2c1O ZINC000816530606 1131105631 /nfs/dbraw/zinc/10/56/31/1131105631.db2.gz OAVRDWNNSRXFGF-UHFFFAOYSA-N 1 0 287.403 3.698 20 10 CHCDRO CC(C)[C@H]1CC[N@@H+]1Cc1ccc2ccccc2c1O ZINC000816527859 1131107818 /nfs/dbraw/zinc/10/78/18/1131107818.db2.gz BTSAFXDPLFWKFE-MRXNPFEDSA-N 1 0 255.361 3.776 20 10 CHCDRO CO[C@@]1(C)C[C@@H]([NH2+]Cc2ccc3ccccc3c2O)C1(C)C ZINC000816554068 1131109574 /nfs/dbraw/zinc/10/95/74/1131109574.db2.gz NWORGCSMAKPUFO-APWZRJJASA-N 1 0 299.414 3.839 20 10 CHCDRO C[C@]1(C[NH2+]Cc2ccc3ccccc3c2O)CCCC[C@H]1O ZINC000816555723 1131110946 /nfs/dbraw/zinc/11/09/46/1131110946.db2.gz OGKFACAKEMINFT-IEBWSBKVSA-N 1 0 299.414 3.576 20 10 CHCDRO C[C@]1(C[NH2+]Cc2ccc3ccccc3c2O)CCCC[C@@H]1O ZINC000816555725 1131111728 /nfs/dbraw/zinc/11/17/28/1131111728.db2.gz OGKFACAKEMINFT-PKOBYXMFSA-N 1 0 299.414 3.576 20 10 CHCDRO CC1(C)CC[C@H](C[NH2+]Cc2ccc3ccccc3c2O)O1 ZINC000816574679 1131112345 /nfs/dbraw/zinc/11/23/45/1131112345.db2.gz PGAQUMSJIJOGBP-OAHLLOKOSA-N 1 0 285.387 3.593 20 10 CHCDRO Oc1c(C[NH2+]CCC[C@H]2CCCCO2)ccc2ccccc21 ZINC000816569885 1131113170 /nfs/dbraw/zinc/11/31/70/1131113170.db2.gz ZQROIQRCYPSNLV-QGZVFWFLSA-N 1 0 299.414 3.984 20 10 CHCDRO CC[C@H]1C[N@H+](Cc2ccc3ccccc3c2O)CCCO1 ZINC000816599232 1131114097 /nfs/dbraw/zinc/11/40/97/1131114097.db2.gz GUXLHACVYUOXPE-INIZCTEOSA-N 1 0 285.387 3.546 20 10 CHCDRO CCCC[N@H+](Cc1conc1CC)Cc1ccccc1O ZINC000816601106 1131114965 /nfs/dbraw/zinc/11/49/65/1131114965.db2.gz RLRBAUMVPLRZCM-UHFFFAOYSA-N 1 0 288.391 3.745 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCC[C@H](c2ccccc2)C1 ZINC000816619356 1131115893 /nfs/dbraw/zinc/11/58/93/1131115893.db2.gz CDDGMSZZGDWBBH-INIZCTEOSA-N 1 0 267.372 3.772 20 10 CHCDRO CC(C)SCC[NH2+]Cc1ccc2ccccc2c1O ZINC000816609831 1131116132 /nfs/dbraw/zinc/11/61/32/1131116132.db2.gz NZRUNLVCUAZQHW-UHFFFAOYSA-N 1 0 275.417 3.777 20 10 CHCDRO Cc1cc(O)c(C[NH+]2CCC3(CCO3)CC2)cc1C(C)C ZINC000799955747 1131116849 /nfs/dbraw/zinc/11/68/49/1131116849.db2.gz PIUFVPROKUCIKQ-UHFFFAOYSA-N 1 0 289.419 3.579 20 10 CHCDRO CCCN(CCC)c1ccc(C[N@@H+]2CC[C@@H]2COC)cc1 ZINC000816636694 1131117574 /nfs/dbraw/zinc/11/75/74/1131117574.db2.gz FIWNGEHOMYDRRB-GOSISDBHSA-N 1 0 290.451 3.534 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2ccc(N3CCCCC3)cc2)[C@@H]1C ZINC000816648341 1131119081 /nfs/dbraw/zinc/11/90/81/1131119081.db2.gz IZCHZJKZDGFWOI-HUUCEWRRSA-N 1 0 258.409 3.517 20 10 CHCDRO C[N@H+](CCF)Cc1cc(-c2ccc(F)cc2)ccc1O ZINC001237648482 1131124039 /nfs/dbraw/zinc/12/40/39/1131124039.db2.gz CEOKANTZBUPJDA-UHFFFAOYSA-N 1 0 277.314 3.600 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2CC[C@H]3CCC[C@@H]3C2)c1O ZINC001237679725 1131127320 /nfs/dbraw/zinc/12/73/20/1131127320.db2.gz LGHYBRSJIKRUTR-CHWSQXEVSA-N 1 0 279.811 3.976 20 10 CHCDRO Cc1cc(Cl)cc(C[NH+]2CCC(F)(F)CC2)c1O ZINC001237680806 1131127510 /nfs/dbraw/zinc/12/75/10/1131127510.db2.gz HVJMGJIFTFJEMM-UHFFFAOYSA-N 1 0 275.726 3.585 20 10 CHCDRO C[N@H+](Cc1ccc(F)cc1)Cc1cc(F)cc(Cl)c1[O-] ZINC001237808050 1131142564 /nfs/dbraw/zinc/14/25/64/1131142564.db2.gz PICZUMWGKWTRRO-UHFFFAOYSA-N 1 0 297.732 3.956 20 10 CHCDRO CC[C@]1(C)CC[N@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001116444990 1131146876 /nfs/dbraw/zinc/14/68/76/1131146876.db2.gz KQPFNUKPTNVNRO-GOSISDBHSA-N 1 0 272.436 3.909 20 10 CHCDRO CCOc1ccc(C[NH2+][C@@H](C)c2cc(C)oc2C)c(O)c1 ZINC001116487244 1131150285 /nfs/dbraw/zinc/15/02/85/1131150285.db2.gz CSVJEOJYEKXHRS-LBPRGKRZSA-N 1 0 289.375 3.852 20 10 CHCDRO C[C@@H]([NH2+]C1(C)CC1)c1ccc(N2CCCCC2)cc1 ZINC001116494762 1131151151 /nfs/dbraw/zinc/15/11/51/1131151151.db2.gz JJMSXSJJYDNADM-CQSZACIVSA-N 1 0 258.409 3.880 20 10 CHCDRO CC[C@H]1C[C@H]([NH2+]Cc2ccc3ccccc3c2O)CCO1 ZINC000817415768 1131160360 /nfs/dbraw/zinc/16/03/60/1131160360.db2.gz YPTWIOPPXNGZQZ-CVEARBPZSA-N 1 0 285.387 3.593 20 10 CHCDRO Oc1cccc(Cl)c1C[NH2+]C[C@H]1CC12CCSCC2 ZINC000817410260 1131160854 /nfs/dbraw/zinc/16/08/54/1131160854.db2.gz KHPVTMAWYFUVHO-LLVKDONJSA-N 1 0 297.851 3.669 20 10 CHCDRO COc1ccc(O)c(C[NH2+]Cc2cccc(C(F)F)c2)c1 ZINC001116706851 1131161196 /nfs/dbraw/zinc/16/11/96/1131161196.db2.gz OFHIYLZIHFVBSP-UHFFFAOYSA-N 1 0 293.313 3.628 20 10 CHCDRO Cc1cccc(CC[N@@H+](C)Cc2cc(F)cc(C)c2O)c1 ZINC001238060413 1131166620 /nfs/dbraw/zinc/16/66/20/1131166620.db2.gz AOOKYTWBYFLYQP-UHFFFAOYSA-N 1 0 287.378 3.823 20 10 CHCDRO Cc1ccc(C[N@@H+](C)Cc2cc(F)cc(C)c2O)cc1 ZINC001238062073 1131166726 /nfs/dbraw/zinc/16/67/26/1131166726.db2.gz UAUGFMPSHUAPNL-UHFFFAOYSA-N 1 0 273.351 3.780 20 10 CHCDRO CC[C@@H]1CCCC[N@@H+]1Cc1cc(F)cc(C)c1O ZINC001238071111 1131168647 /nfs/dbraw/zinc/16/86/47/1131168647.db2.gz RSRCDWSNGHOAQX-CQSZACIVSA-N 1 0 251.345 3.604 20 10 CHCDRO CC[C@@H]1C[C@H]([NH2+][C@@H](C)c2ccc(N(C)CC)cc2)CCO1 ZINC000817586186 1131173697 /nfs/dbraw/zinc/17/36/97/1131173697.db2.gz LPFVIJKKALCZLQ-YXJHDRRASA-N 1 0 290.451 3.751 20 10 CHCDRO CC[C@@H]1C[C@H]([NH2+][C@H](C)c2ccc(C)c(C)c2O)CCO1 ZINC000817587630 1131173828 /nfs/dbraw/zinc/17/38/28/1131173828.db2.gz ZRKRSYBMMVGTEF-RBSFLKMASA-N 1 0 277.408 3.617 20 10 CHCDRO Cc1cc(C[NH2+][C@@H](C)c2cc(F)cc(F)c2[O-])cc(C)n1 ZINC000817588993 1131174150 /nfs/dbraw/zinc/17/41/50/1131174150.db2.gz KPNRLTVNIUDGPS-NSHDSACASA-N 1 0 292.329 3.533 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@H]2CC23CCSCC3)c1 ZINC000817590635 1131175331 /nfs/dbraw/zinc/17/53/31/1131175331.db2.gz ZHRRIORFUBPKSE-UONOGXRCSA-N 1 0 291.460 3.885 20 10 CHCDRO CC[C@H]([NH2+]CCc1ccc(N)cc1)c1cccs1 ZINC000817955885 1131190135 /nfs/dbraw/zinc/19/01/35/1131190135.db2.gz KEBFGKVWTOBSLF-AWEZNQCLSA-N 1 0 260.406 3.614 20 10 CHCDRO Cc1ccsc1[C@H](C)[NH2+]CCc1ccc(N)cc1 ZINC000817955763 1131190168 /nfs/dbraw/zinc/19/01/68/1131190168.db2.gz HEHUBRAZSOTDCY-LBPRGKRZSA-N 1 0 260.406 3.532 20 10 CHCDRO C[C@H]([NH2+]CCc1ccc(N)cc1)C(C)(C)c1ccccc1 ZINC000817955923 1131190351 /nfs/dbraw/zinc/19/03/51/1131190351.db2.gz LMDWRUSGQNDPEC-HNNXBMFYSA-N 1 0 282.431 3.767 20 10 CHCDRO CC(C)Oc1ccc([C@@H](C)[NH2+]CCc2ccc(N)cc2)cc1 ZINC000817955902 1131190357 /nfs/dbraw/zinc/19/03/57/1131190357.db2.gz KNNCVZUJOACSEF-OAHLLOKOSA-N 1 0 298.430 3.949 20 10 CHCDRO Nc1ccc(CC[NH2+][C@@H]2CCc3cc(Cl)ccc32)cc1 ZINC000817955826 1131190394 /nfs/dbraw/zinc/19/03/94/1131190394.db2.gz IQBZRAZMJZXQQO-QGZVFWFLSA-N 1 0 286.806 3.742 20 10 CHCDRO C[C@H]([NH2+]CCc1ccc(N)cc1)C1CCC(F)(F)CC1 ZINC000817958416 1131191100 /nfs/dbraw/zinc/19/11/00/1131191100.db2.gz VNBQONAALVARON-LBPRGKRZSA-N 1 0 282.378 3.615 20 10 CHCDRO CC[C@@H]1C[C@H](C)CC[C@H]1[NH2+]CCc1ccc(N)cc1 ZINC000817957129 1131191516 /nfs/dbraw/zinc/19/15/16/1131191516.db2.gz JJRCQWWRVABOCY-FRFSOERESA-N 1 0 260.425 3.616 20 10 CHCDRO CC(C)C[C@H](CN)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000817957539 1131191627 /nfs/dbraw/zinc/19/16/27/1131191627.db2.gz CRVAWRICIIVTHS-DZGCQCFKSA-N 1 0 286.419 3.569 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@H]1C[C@@]1(F)c1ccccc1)CC2 ZINC000818356849 1131211283 /nfs/dbraw/zinc/21/12/83/1131211283.db2.gz RMNOQENYWYGTRX-UWWQBHOKSA-N 1 0 283.346 3.606 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CC12CC2)c1ccc(N2CCCCC2)cc1 ZINC000818356694 1131211778 /nfs/dbraw/zinc/21/17/78/1131211778.db2.gz PWVPCOZRZYZBRK-RHSMWYFYSA-N 1 0 270.420 3.880 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CC[C@@H]3[C@H](C2)C3(F)F)c(O)c1 ZINC001118489355 1131228794 /nfs/dbraw/zinc/22/87/94/1131228794.db2.gz JYZUJZPELRTVLL-UNJBNNCHSA-N 1 0 281.346 3.785 20 10 CHCDRO CC1(C)C[N@H+](Cc2c([O-])cccc2F)Cc2ccccc21 ZINC001137840204 1131421582 /nfs/dbraw/zinc/42/15/82/1131421582.db2.gz SQXRELXKGIGRIZ-UHFFFAOYSA-N 1 0 285.362 3.825 20 10 CHCDRO COC[C@H]1CCC[N@@H+]1Cc1cc(C)n(-c2ccccc2)c1C ZINC001137853921 1131423861 /nfs/dbraw/zinc/42/38/61/1131423861.db2.gz ATOYNIPEQCDEFI-LJQANCHMSA-N 1 0 298.430 3.705 20 10 CHCDRO COCC1CCC([NH2+][C@H](C)c2ccc(N(C)C)cc2)CC1 ZINC000824196492 1131458951 /nfs/dbraw/zinc/45/89/51/1131458951.db2.gz SGTXRUSBCQHPEC-HPUBIQBYSA-N 1 0 290.451 3.608 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]C[C@@H]1CSc2ccccc21 ZINC000824483854 1131470833 /nfs/dbraw/zinc/47/08/33/1131470833.db2.gz VTDNRHOTIKTZPH-GFCCVEGCSA-N 1 0 289.375 3.510 20 10 CHCDRO COc1cccc(O)c1C[NH2+]CC[C@@H]1CCc2ccccc21 ZINC000824548272 1131475408 /nfs/dbraw/zinc/47/54/08/1131475408.db2.gz DFFGEIBARMMZQQ-HNNXBMFYSA-N 1 0 297.398 3.611 20 10 CHCDRO c1cc(N2CCCCC2)ccc1C[N@@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC001138213855 1131477970 /nfs/dbraw/zinc/47/79/70/1131477970.db2.gz CDTDXXKKCICNCO-HDICACEKSA-N 1 0 284.447 3.909 20 10 CHCDRO C[N@H+](Cc1ccc(N2CCCCC2)cc1)C(C)(C)C ZINC001138218918 1131479057 /nfs/dbraw/zinc/47/90/57/1131479057.db2.gz YFEIIFQMDDERFO-UHFFFAOYSA-N 1 0 260.425 3.907 20 10 CHCDRO CC(C)[C@H]1C[C@H](C[NH2+]Cc2c(O)cccc2Cl)CCO1 ZINC000824799623 1131485229 /nfs/dbraw/zinc/48/52/29/1131485229.db2.gz PEKNGWUQPGICPG-MLGOLLRUSA-N 1 0 297.826 3.586 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]C23CCC(CC2)CC3)c1O ZINC000824935841 1131489263 /nfs/dbraw/zinc/48/92/63/1131489263.db2.gz MAMHYMWDIPCWPY-UHFFFAOYSA-N 1 0 295.810 3.867 20 10 CHCDRO Cc1cccc(C[NH2+]CC[C@]2(C)CC2(Cl)Cl)c1O ZINC000824971727 1131492391 /nfs/dbraw/zinc/49/23/91/1131492391.db2.gz XPADIAFNZREOIR-CYBMUJFWSA-N 1 0 288.218 3.764 20 10 CHCDRO CC(C)[NH+](Cc1ccc2c(c1)CCCN2C)C(C)C ZINC001138354434 1131493513 /nfs/dbraw/zinc/49/35/13/1131493513.db2.gz JVFXVIMWGLNBRQ-UHFFFAOYSA-N 1 0 260.425 3.688 20 10 CHCDRO CN1CCCc2cc(C[N@@H+]3CCc4ccsc4C3)ccc21 ZINC001138358377 1131494279 /nfs/dbraw/zinc/49/42/79/1131494279.db2.gz QBUIFJVVYZYQNQ-UHFFFAOYSA-N 1 0 298.455 3.689 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H](C)c2ccccn2)cc1Cl ZINC000825051073 1131496199 /nfs/dbraw/zinc/49/61/99/1131496199.db2.gz WUFPXMAATNGLPU-NSHDSACASA-N 1 0 276.767 3.600 20 10 CHCDRO C[N@H+](Cc1c[nH]c2cccc(F)c12)Cc1ccccc1O ZINC001136985615 1131498254 /nfs/dbraw/zinc/49/82/54/1131498254.db2.gz NVSJYVAMXUAOAK-UHFFFAOYSA-N 1 0 284.334 3.645 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CCC[C@@]2(CCOC2)C1 ZINC000825134452 1131500257 /nfs/dbraw/zinc/50/02/57/1131500257.db2.gz ZJWDWWBCOHJXBM-LJQANCHMSA-N 1 0 297.398 3.548 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC[C@@]3(CCSC3)C2)cc1C ZINC000825215043 1131502404 /nfs/dbraw/zinc/50/24/04/1131502404.db2.gz DMIANLVVMVYFHQ-QGZVFWFLSA-N 1 0 291.460 3.728 20 10 CHCDRO COc1c(C)cc(C[N@@H+]2CCc3cccc(O)c3C2)cc1C ZINC001138428744 1131504201 /nfs/dbraw/zinc/50/42/01/1131504201.db2.gz QXCCXJLJCVIGEP-UHFFFAOYSA-N 1 0 297.398 3.576 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H](C)c2ccc[nH]2)cc1Cl ZINC000825390930 1131509313 /nfs/dbraw/zinc/50/93/13/1131509313.db2.gz NEWWHWPMNMXZCZ-SNVBAGLBSA-N 1 0 264.756 3.533 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](C)[C@H](C)c2ccccn2)cc1Cl ZINC000825450493 1131512356 /nfs/dbraw/zinc/51/23/56/1131512356.db2.gz HOFFDIQYYDMGKV-GFCCVEGCSA-N 1 0 290.794 3.942 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)Cc1cc(C)ccc1OC ZINC001138487436 1131512732 /nfs/dbraw/zinc/51/27/32/1131512732.db2.gz SBHLALYWZGDJLM-UHFFFAOYSA-N 1 0 285.387 3.731 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CCC[C@@H]2CCCCO2)cc1Cl ZINC000825514103 1131514047 /nfs/dbraw/zinc/51/40/47/1131514047.db2.gz LSRSQESKVVKCRY-AWEZNQCLSA-N 1 0 297.826 3.793 20 10 CHCDRO Oc1cc2c(cc1C[NH+]1CCC3(CC3(F)F)CC1)CCC2 ZINC000844726076 1131594967 /nfs/dbraw/zinc/59/49/67/1131594967.db2.gz WFQZYZJSAHCZNN-UHFFFAOYSA-N 1 0 293.357 3.502 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CNc2ccccc2C1)c1ccc(C)cc1O ZINC000844921625 1131608223 /nfs/dbraw/zinc/60/82/23/1131608223.db2.gz QQXSGPPSTGKUPS-NVXWUHKLSA-N 1 0 296.414 3.778 20 10 CHCDRO Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]CCc1ccco1 ZINC000035661582 1131608613 /nfs/dbraw/zinc/60/86/13/1131608613.db2.gz BJXVTXCKXGPNIA-JSGCOSHPSA-N 1 0 271.360 3.674 20 10 CHCDRO Cc1cc(C[N@H+]2CCC[C@@H](C)[C@H]2C)ccc1N(C)C ZINC001139672317 1131626692 /nfs/dbraw/zinc/62/66/92/1131626692.db2.gz VLUNCWMXBTYENT-UKRRQHHQSA-N 1 0 260.425 3.681 20 10 CHCDRO Cc1cc(C[N@H+](C)CCOc2ccccc2)ccc1N(C)C ZINC001139672522 1131626979 /nfs/dbraw/zinc/62/69/79/1131626979.db2.gz ZITOTCKPUQIIRJ-UHFFFAOYSA-N 1 0 298.430 3.572 20 10 CHCDRO Cc1cc(C[N@@H+]2CCC[C@@](C)(F)CC2)ccc1N(C)C ZINC001139669957 1131627025 /nfs/dbraw/zinc/62/70/25/1131627025.db2.gz RKUVTDWHRHMBQM-QGZVFWFLSA-N 1 0 278.415 3.775 20 10 CHCDRO COc1ccccc1[C@H](C)[N@H+](C)Cc1cc(F)ccc1O ZINC001140058455 1131660121 /nfs/dbraw/zinc/66/01/21/1131660121.db2.gz AGFSNIGZOLFVMB-LBPRGKRZSA-N 1 0 289.350 3.733 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1CCSc2ccccc2C1 ZINC001140060072 1131660329 /nfs/dbraw/zinc/66/03/29/1131660329.db2.gz JUMYJQSHBRZEFN-UHFFFAOYSA-N 1 0 289.375 3.639 20 10 CHCDRO CC[N@H+](Cc1cc(F)ccc1O)Cc1cccc(F)c1F ZINC001140060173 1131660414 /nfs/dbraw/zinc/66/04/14/1131660414.db2.gz NURLJWLOZJVHDM-UHFFFAOYSA-N 1 0 295.304 3.832 20 10 CHCDRO CCC[N@H+](Cc1ccccc1)Cc1cc(F)ccc1O ZINC001140055546 1131660422 /nfs/dbraw/zinc/66/04/22/1131660422.db2.gz KKQDALYGWQWAGO-UHFFFAOYSA-N 1 0 273.351 3.944 20 10 CHCDRO Cc1ccc(C)c(C[N@H+](C)CCC(=O)c2ccccc2)c1O ZINC001140182029 1131672805 /nfs/dbraw/zinc/67/28/05/1131672805.db2.gz GEZDKMJVOGXWAF-UHFFFAOYSA-N 1 0 297.398 3.714 20 10 CHCDRO Cc1ccc(C)c(C[N@H+](C)Cc2ccsc2)c1O ZINC001140182268 1131673332 /nfs/dbraw/zinc/67/33/32/1131673332.db2.gz NCRBBALBHMJRNS-UHFFFAOYSA-N 1 0 261.390 3.703 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cc(Cl)cs2)c1 ZINC000845970882 1131673558 /nfs/dbraw/zinc/67/35/58/1131673558.db2.gz FDLVTVLRAHDKBT-SECBINFHSA-N 1 0 297.807 3.967 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc2c(c1)ncn2C)c1ccccc1O ZINC000845991521 1131675734 /nfs/dbraw/zinc/67/57/34/1131675734.db2.gz BIMSGRNKMYNCRN-HNNXBMFYSA-N 1 0 295.386 3.520 20 10 CHCDRO C[C@]1(CC[NH2+]Cc2cc(Cl)ccc2O)C[C@]1(F)Cl ZINC000846036672 1131681567 /nfs/dbraw/zinc/68/15/67/1131681567.db2.gz NLYIBLYLXULRMR-QWHCGFSZSA-N 1 0 292.181 3.840 20 10 CHCDRO C[C@@]1(CC[NH2+]Cc2c(O)cccc2Cl)C[C@]1(F)Cl ZINC000846040647 1131683045 /nfs/dbraw/zinc/68/30/45/1131683045.db2.gz XPPWBKNUBHGGIK-CHWSQXEVSA-N 1 0 292.181 3.840 20 10 CHCDRO COc1ccc(C[NH2+]CC[C@]2(C)C[C@]2(F)Cl)cc1C ZINC000846039684 1131683245 /nfs/dbraw/zinc/68/32/45/1131683245.db2.gz VLBDPHCAMAAWGB-HUUCEWRRSA-N 1 0 285.790 3.798 20 10 CHCDRO COc1ccc(C[NH2+][C@H](C)CCCc2cccnc2)cc1C ZINC000834555207 1131683495 /nfs/dbraw/zinc/68/34/95/1131683495.db2.gz MTSOCFMQVNZUJR-MRXNPFEDSA-N 1 0 298.430 3.900 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C1CC1)C1CCOCC1)c1ccccc1O ZINC000846042825 1131683772 /nfs/dbraw/zinc/68/37/72/1131683772.db2.gz QHAVSDLFWPIOIY-SJLPKXTDSA-N 1 0 289.419 3.638 20 10 CHCDRO C[C@@H](C[NH2+][C@H]1CCc2cccc(O)c21)c1ccc(F)cc1 ZINC000834566410 1131684303 /nfs/dbraw/zinc/68/43/03/1131684303.db2.gz MOVKAHZKJXYPHX-LRDDRELGSA-N 1 0 285.362 3.912 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CC[C@@]3(CC3(F)F)C2)cc1 ZINC000846118636 1131688077 /nfs/dbraw/zinc/68/80/77/1131688077.db2.gz YHTMWVBALQMOAM-MRXNPFEDSA-N 1 0 294.389 3.764 20 10 CHCDRO CCOc1cccc(C[NH2+]Cc2cccc(CC)c2)c1O ZINC000846100481 1131689097 /nfs/dbraw/zinc/68/90/97/1131689097.db2.gz NEQLIUWUCNDFMX-UHFFFAOYSA-N 1 0 285.387 3.643 20 10 CHCDRO C[C@@H]1Cc2ccccc2[C@H]1[NH2+][C@H]1CCc2cccc(O)c21 ZINC000834645505 1131690113 /nfs/dbraw/zinc/69/01/13/1131690113.db2.gz FTRHKNCZKVAFKU-GFJSAUFNSA-N 1 0 279.383 3.903 20 10 CHCDRO CCO[C@H](CC[NH2+][C@@H](C)c1cccc(OC)c1O)C(C)C ZINC000846149189 1131691315 /nfs/dbraw/zinc/69/13/15/1131691315.db2.gz WXDQKIDUPITUKX-DZGCQCFKSA-N 1 0 295.423 3.503 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H]2CCC(C)(C)C2)c1O ZINC000846157243 1131692064 /nfs/dbraw/zinc/69/20/64/1131692064.db2.gz BSJKAMPNRQKWCM-RYUDHWBXSA-N 1 0 263.381 3.630 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@H]2C[C@H]2Cc2ccccc2)c1O ZINC000846155975 1131692119 /nfs/dbraw/zinc/69/21/19/1131692119.db2.gz RIUVCNGIYRAMAI-LXZKKBNFSA-N 1 0 297.398 3.683 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CCCC(C)(C)C)c1O ZINC000846153805 1131692261 /nfs/dbraw/zinc/69/22/61/1131692261.db2.gz IKNQSKACAJOEIB-GFCCVEGCSA-N 1 0 265.397 3.878 20 10 CHCDRO COc1cccc([C@H](C)[NH2+][C@@H]2c3ccccc3C[C@H]2C)c1O ZINC000846151275 1131692351 /nfs/dbraw/zinc/69/23/51/1131692351.db2.gz YSLBREMFFSHCQR-VBHSOAQHSA-N 1 0 297.398 3.985 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CCc2sccc2C)c1O ZINC000846160404 1131692906 /nfs/dbraw/zinc/69/29/06/1131692906.db2.gz VJGZCHJZXNNDAO-LBPRGKRZSA-N 1 0 291.416 3.664 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@@H]2CCc3ccccc32)c1O ZINC000846137582 1131693629 /nfs/dbraw/zinc/69/36/29/1131693629.db2.gz SLLQIYSJIBIBEE-MLGOLLRUSA-N 1 0 283.371 3.739 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@@H](C)c2ccccc2)c1O ZINC000846136539 1131693709 /nfs/dbraw/zinc/69/37/09/1131693709.db2.gz JVZXGRGCWSRFKB-QWHCGFSZSA-N 1 0 271.360 3.813 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]CCC2CCCC2)c1O ZINC000846135278 1131693963 /nfs/dbraw/zinc/69/39/63/1131693963.db2.gz BRTHIYYPVTYBLR-LBPRGKRZSA-N 1 0 263.381 3.632 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@H](C)CCC(C)C)c1O ZINC000846136178 1131694102 /nfs/dbraw/zinc/69/41/02/1131694102.db2.gz HGGOUBIUXKUPJC-CHWSQXEVSA-N 1 0 265.397 3.876 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CCc2cccc(O)c21)c1c(C)noc1C ZINC000834692675 1131694514 /nfs/dbraw/zinc/69/45/14/1131694514.db2.gz GWZIKLGAGXMQLJ-KGLIPLIRSA-N 1 0 286.375 3.725 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]C[C@H]2CCc3ccccc32)c1O ZINC000846144382 1131694751 /nfs/dbraw/zinc/69/47/51/1131694751.db2.gz IWSBZLPRCSQWQC-UKRRQHHQSA-N 1 0 297.398 3.781 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@@H](C)Cc2ccccc2C)c1O ZINC000846141326 1131694898 /nfs/dbraw/zinc/69/48/98/1131694898.db2.gz HSHSFUOFSJMNAQ-LSDHHAIUSA-N 1 0 299.414 3.991 20 10 CHCDRO CCc1cnccc1[C@H](C)[NH2+][C@H]1CCc2cccc(O)c21 ZINC000834698219 1131695616 /nfs/dbraw/zinc/69/56/16/1131695616.db2.gz WSQJRYYIHNFRAK-LRDDRELGSA-N 1 0 282.387 3.688 20 10 CHCDRO CC[C@@H]([NH2+]CCC1(CO)CCC1)c1cc(Cl)ccc1O ZINC000846209197 1131695704 /nfs/dbraw/zinc/69/57/04/1131695704.db2.gz BTFDMZAPKWCCRN-CQSZACIVSA-N 1 0 297.826 3.639 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@H](C)COCC2CC2)c1O ZINC000846205823 1131696091 /nfs/dbraw/zinc/69/60/91/1131696091.db2.gz UHRDEJMCPIAMKY-NEPJUHHUSA-N 1 0 297.826 3.820 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](C2CC2)C2CCOCC2)c1 ZINC000846187591 1131697655 /nfs/dbraw/zinc/69/76/55/1131697655.db2.gz LDWNUOCXJKMDMT-ACJLOTCBSA-N 1 0 289.419 3.556 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](C2CC2)C2CCOCC2)c(O)c1 ZINC000846185474 1131697763 /nfs/dbraw/zinc/69/77/63/1131697763.db2.gz AERNYZFWRFXFRN-UGSOOPFHSA-N 1 0 289.419 3.556 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)[C@@](C)(O)c2ccccc2)c1 ZINC000846188670 1131697974 /nfs/dbraw/zinc/69/79/74/1131697974.db2.gz OGDPAMVRULKMGR-QMTMVMCOSA-N 1 0 299.414 3.647 20 10 CHCDRO Cc1ccccc1[C@@H]1C[C@H]1[NH2+][C@H](C)c1ccccc1O ZINC000846192536 1131699047 /nfs/dbraw/zinc/69/90/47/1131699047.db2.gz YGTFTMALLNYEDX-XOKHGSTOSA-N 1 0 267.372 3.907 20 10 CHCDRO C[C@@H](COCC1CC1)[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000846204002 1131699408 /nfs/dbraw/zinc/69/94/08/1131699408.db2.gz JLQRXHLACZNORV-QWRGUYRKSA-N 1 0 283.799 3.511 20 10 CHCDRO C[C@@H]1CC(CC[NH2+][C@@H]2CCc3cccc(O)c32)C[C@@H](C)O1 ZINC000834794120 1131706510 /nfs/dbraw/zinc/70/65/10/1131706510.db2.gz ORLFOERHPUEFIF-XJKCOSOUSA-N 1 0 289.419 3.563 20 10 CHCDRO COC1(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)CCCC1 ZINC000834814518 1131707644 /nfs/dbraw/zinc/70/76/44/1131707644.db2.gz LIJDXVRGCWGNBQ-DGCLKSJQSA-N 1 0 293.382 3.628 20 10 CHCDRO CCC[C@H](C[NH2+][C@@H](CC)c1ccc(C)cc1O)OC ZINC000834841498 1131710993 /nfs/dbraw/zinc/71/09/93/1131710993.db2.gz VAJDUNGWAGYZDM-HIFRSBDPSA-N 1 0 265.397 3.556 20 10 CHCDRO CO[C@H](C[NH2+][C@H](C)c1cc(C)ccc1O)Cc1ccccc1 ZINC000834856074 1131713195 /nfs/dbraw/zinc/71/31/95/1131713195.db2.gz KJEWEDGCUVTYBQ-WBVHZDCISA-N 1 0 299.414 3.609 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+][C@@H](C)CC(C)(C)O)c1O ZINC000834877062 1131715630 /nfs/dbraw/zinc/71/56/30/1131715630.db2.gz SGEQJLZFJAMUST-QWRGUYRKSA-N 1 0 285.815 3.554 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)CCCCO)c1cc(Cl)ccc1O ZINC000834877170 1131716910 /nfs/dbraw/zinc/71/69/10/1131716910.db2.gz HCQUJFHAHJZINH-FZMZJTMJSA-N 1 0 285.815 3.637 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@](C)(CC)OC)c1ccc(N(C)C)cc1 ZINC000834881954 1131717482 /nfs/dbraw/zinc/71/74/82/1131717482.db2.gz GVQKYSZTDJMOFO-IAGOWNOFSA-N 1 0 278.440 3.608 20 10 CHCDRO CC[C@H]([NH2+]C[C@](C)(CC)OC)c1ccc(C)cc1O ZINC000834883178 1131717853 /nfs/dbraw/zinc/71/78/53/1131717853.db2.gz ZQWUEEBDEVZVNO-HOCLYGCPSA-N 1 0 265.397 3.556 20 10 CHCDRO CO[C@](C)(C[NH2+][C@@H](C)c1ccc(C)cc1O)c1ccccc1 ZINC000834885016 1131718430 /nfs/dbraw/zinc/71/84/30/1131718430.db2.gz RTOFEVAQZBBSCR-HNAYVOBHSA-N 1 0 299.414 3.913 20 10 CHCDRO CC[C@H]([NH2+]CCc1ncccc1C)c1ccc(N(C)C)cc1 ZINC000834885971 1131718609 /nfs/dbraw/zinc/71/86/09/1131718609.db2.gz ONKJOPOFXBOGFH-SFHVURJKSA-N 1 0 297.446 3.739 20 10 CHCDRO CC[C@H]([NH2+]Cc1cnccc1C)c1ccc(C)cc1O ZINC000834886106 1131718815 /nfs/dbraw/zinc/71/88/15/1131718815.db2.gz HVVUMYHZLLKZTF-INIZCTEOSA-N 1 0 270.376 3.645 20 10 CHCDRO C[C@H]([NH2+][C@H]1C[C@H](C)n2ccnc21)c1cc(Cl)ccc1O ZINC000834892697 1131719093 /nfs/dbraw/zinc/71/90/93/1131719093.db2.gz CSHULWRKEPQQRS-KWBADKCTSA-N 1 0 291.782 3.599 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2cnccc2C)c(O)c1C ZINC000834887754 1131719715 /nfs/dbraw/zinc/71/97/15/1131719715.db2.gz LVLWRRWMXXQWJE-AWEZNQCLSA-N 1 0 270.376 3.563 20 10 CHCDRO CCc1ncc(C[NH2+][C@@H](CC)c2cc(Cl)ccc2O)o1 ZINC000834898432 1131721900 /nfs/dbraw/zinc/72/19/00/1131721900.db2.gz CXOLHZFSHBXYFG-ZDUSSCGKSA-N 1 0 294.782 3.837 20 10 CHCDRO CCc1ncc(C[NH2+][C@@H](C)c2ccc3ccccc3c2O)o1 ZINC000834898502 1131723870 /nfs/dbraw/zinc/72/38/70/1131723870.db2.gz FHIGBOJDXYKFNP-LBPRGKRZSA-N 1 0 296.370 3.947 20 10 CHCDRO CC[C@@H]([NH2+]CCC[C@@H]1CCOC1)c1ccc(C)cc1O ZINC000834906431 1131729338 /nfs/dbraw/zinc/72/93/38/1131729338.db2.gz WTLASZNENKMOIV-GDBMZVCRSA-N 1 0 277.408 3.558 20 10 CHCDRO C[C@H]([NH2+]CCC1CC(F)(F)C1)c1ccc(N(C)C)cc1 ZINC000834910218 1131730906 /nfs/dbraw/zinc/73/09/06/1131730906.db2.gz WBZAALGURCEJTB-LBPRGKRZSA-N 1 0 282.378 3.839 20 10 CHCDRO CCC[N@H+](Cc1ccccc1O)CC1(Br)CC1 ZINC000846808852 1131742645 /nfs/dbraw/zinc/74/26/45/1131742645.db2.gz KKJROVZCQBHHEZ-UHFFFAOYSA-N 1 0 298.224 3.532 20 10 CHCDRO Oc1cc(Cl)ccc1C[NH+]1C[C@@H]2CCCC[C@H]2C1 ZINC001140463107 1131748701 /nfs/dbraw/zinc/74/87/01/1131748701.db2.gz SOMMIQVHWMQHPV-RYUDHWBXSA-N 1 0 265.784 3.668 20 10 CHCDRO COc1ccccc1C[N@H+](C)Cc1ccc(Cl)cc1O ZINC001140466039 1131750079 /nfs/dbraw/zinc/75/00/79/1131750079.db2.gz ZPAMQFKQUBHJCV-UHFFFAOYSA-N 1 0 291.778 3.686 20 10 CHCDRO C[C@H]([NH2+]C/C=C\c1ccc(N(C)C)cc1)c1cccc(O)c1 ZINC000835037366 1131760792 /nfs/dbraw/zinc/76/07/92/1131760792.db2.gz JOSLACMSESLQPK-YVACAVLKSA-N 1 0 296.414 3.822 20 10 CHCDRO CCC1([NH2+]C/C=C\c2ccc(N(C)C)cc2)CCC1 ZINC000835042114 1131762580 /nfs/dbraw/zinc/76/25/80/1131762580.db2.gz GXJCJGIOKYDQFG-ALCCZGGFSA-N 1 0 258.409 3.688 20 10 CHCDRO C[C@H]([NH2+]C/C=C/c1ccc(N(C)C)cc1)C1CCC1 ZINC000835042170 1131762598 /nfs/dbraw/zinc/76/25/98/1131762598.db2.gz RVSOKHDGFWDUST-GJBLVYBDSA-N 1 0 258.409 3.544 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]C[C@@]2(C)CCCS2)cc1 ZINC000835041445 1131762992 /nfs/dbraw/zinc/76/29/92/1131762992.db2.gz CHFLKWKKOKEPPH-XQDHMALISA-N 1 0 290.476 3.641 20 10 CHCDRO Cc1cc(C)c(C[NH2+]C/C=C/c2ccc(N(C)C)cc2)cn1 ZINC000835055121 1131766417 /nfs/dbraw/zinc/76/64/17/1131766417.db2.gz RLEMAJWYLHNQDE-AATRIKPKSA-N 1 0 295.430 3.567 20 10 CHCDRO C[C@H]([NH2+]C1CCC1)c1ccc(N2CCCCC2)cc1 ZINC000772959718 1131775907 /nfs/dbraw/zinc/77/59/07/1131775907.db2.gz MKWKCZYHRCHOLO-AWEZNQCLSA-N 1 0 258.409 3.880 20 10 CHCDRO Cc1ccc(O)c(C[N@H+]2CC[C@H](C)C(F)(F)CC2)c1 ZINC001140617482 1131829337 /nfs/dbraw/zinc/82/93/37/1131829337.db2.gz QTOSULVHHTXPKN-LBPRGKRZSA-N 1 0 269.335 3.568 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(NC[C@@H]2CCCC[NH2+]2)cc1 ZINC001171335585 1131867135 /nfs/dbraw/zinc/86/71/35/1131867135.db2.gz YUWBBMJQFXBORM-KRWDZBQOSA-N 1 0 283.419 3.648 20 10 CHCDRO Cc1c(O)ccc(C[N@@H+]2CCC[C@@H]2c2cccs2)c1O ZINC001140745379 1131905893 /nfs/dbraw/zinc/90/58/93/1131905893.db2.gz HSILNNVLWPAXCM-CYBMUJFWSA-N 1 0 289.400 3.805 20 10 CHCDRO Cc1c(O)ccc(C[N@H+]2CC=C(c3ccccc3)CC2)c1O ZINC001140749237 1131906412 /nfs/dbraw/zinc/90/64/12/1131906412.db2.gz SKNIVBCQCMXNFZ-UHFFFAOYSA-N 1 0 295.382 3.696 20 10 CHCDRO CCC[N@@H+](Cc1ccc(N(CC)CC)cc1O)CC1CC1 ZINC001140852020 1131947134 /nfs/dbraw/zinc/94/71/34/1131947134.db2.gz YQMBWGVSRYNSDY-UHFFFAOYSA-N 1 0 290.451 3.860 20 10 CHCDRO CCN(CC)c1ccc(C[NH+](C(C)C)C(C)C)c(O)c1 ZINC001140851673 1131947525 /nfs/dbraw/zinc/94/75/25/1131947525.db2.gz NPCDPYJTTAXYHG-UHFFFAOYSA-N 1 0 278.440 3.857 20 10 CHCDRO CCN(CC)c1ccc(C[NH+]2CCC(C)(F)CC2)c(O)c1 ZINC001140850691 1131947745 /nfs/dbraw/zinc/94/77/45/1131947745.db2.gz QZUYMXBQHRZMTQ-UHFFFAOYSA-N 1 0 294.414 3.562 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CC(CC)(CC)CO)cc1 ZINC000773106691 1131947949 /nfs/dbraw/zinc/94/79/49/1131947949.db2.gz YPDOKOQKBTYAOT-HNNXBMFYSA-N 1 0 292.467 3.592 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2C[C@H](C)CC23CC3)c(O)c1 ZINC001140857580 1131948375 /nfs/dbraw/zinc/94/83/75/1131948375.db2.gz ROZZWFHLXMSDKV-CQSZACIVSA-N 1 0 288.435 3.613 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc[nH]2)cc1 ZINC000773118330 1131950662 /nfs/dbraw/zinc/95/06/62/1131950662.db2.gz OBJVLKUDMMBYEO-KGLIPLIRSA-N 1 0 271.408 3.883 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC3(CCC3)C2)c(Cl)c1 ZINC001140924687 1131965316 /nfs/dbraw/zinc/96/53/16/1131965316.db2.gz MLQJTHOUZVWWHD-UHFFFAOYSA-N 1 0 278.827 3.782 20 10 CHCDRO Cc1ccc(C[N@@H+]2Cc3ccccc3[C@H](C)C2)c(O)c1 ZINC001140948174 1131969979 /nfs/dbraw/zinc/96/99/79/1131969979.db2.gz WOKYUZPDNXAFNG-CQSZACIVSA-N 1 0 267.372 3.820 20 10 CHCDRO Cc1ccc(C[N@@H+]2CCc3c(Cl)cccc3C2)c(O)c1 ZINC001140950776 1131970296 /nfs/dbraw/zinc/97/02/96/1131970296.db2.gz IAVGXWDLACTKND-UHFFFAOYSA-N 1 0 287.790 3.912 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CC12CC2)c1cc(Br)ccc1O ZINC000715222385 1131981372 /nfs/dbraw/zinc/98/13/72/1131981372.db2.gz IZYBXJQYLPJJEH-DGCLKSJQSA-N 1 0 296.208 3.748 20 10 CHCDRO C[C@H](Cc1ccccc1Cl)[NH2+]Cc1ccccc1O ZINC000036936257 1131984798 /nfs/dbraw/zinc/98/47/98/1131984798.db2.gz FWSKCSPFIJBNQP-GFCCVEGCSA-N 1 0 275.779 3.766 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC[C@H]2CCCS2)c(O)c1 ZINC000715698579 1131990012 /nfs/dbraw/zinc/99/00/12/1131990012.db2.gz SIZAHPNTWVGVAP-CHWSQXEVSA-N 1 0 265.422 3.637 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC[C@@H]2CCCS2)c(O)c1 ZINC000715698580 1131990402 /nfs/dbraw/zinc/99/04/02/1131990402.db2.gz SIZAHPNTWVGVAP-OLZOCXBDSA-N 1 0 265.422 3.637 20 10 CHCDRO c1c(C[N@@H+]2C[C@@H]3CCC[C@@H]3C2)cc2c3c1CCCN3CCC2 ZINC001141074552 1132005295 /nfs/dbraw/zinc/00/52/95/1132005295.db2.gz LXQBBLCVTIKGDU-KDURUIRLSA-N 1 0 296.458 3.617 20 10 CHCDRO C[C@@H]1CCC[N@H+](Cc2cc3c4c(c2)CCCN4CCC3)C1 ZINC001141074603 1132005473 /nfs/dbraw/zinc/00/54/73/1132005473.db2.gz NTTWSKNANUYUTQ-OAHLLOKOSA-N 1 0 284.447 3.617 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2cc3c4c(c2)CCCN4CCC3)C2(CC2)C1 ZINC001141078248 1132007696 /nfs/dbraw/zinc/00/76/96/1132007696.db2.gz QKYIJJDUPRAWOY-HNNXBMFYSA-N 1 0 296.458 3.760 20 10 CHCDRO C[NH+](C)Cc1ccc(NCc2cc(Cl)ccc2O)cc1 ZINC000037141430 1132008624 /nfs/dbraw/zinc/00/86/24/1132008624.db2.gz GSWBWOJDMWZVAT-UHFFFAOYSA-N 1 0 290.794 3.719 20 10 CHCDRO C[C@H]([NH2+]CCc1ccccc1F)c1ccc(N(C)C)cc1 ZINC000037200093 1132008645 /nfs/dbraw/zinc/00/86/45/1132008645.db2.gz LTXJBQZJXJRDBY-AWEZNQCLSA-N 1 0 286.394 3.785 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)c1 ZINC000037230779 1132023400 /nfs/dbraw/zinc/02/34/00/1132023400.db2.gz DNAJWEVGSYWDMF-HNNXBMFYSA-N 1 0 268.404 3.912 20 10 CHCDRO CC[N@H+](Cc1ccccc1)Cc1ccc2c(c1)OCCN2C ZINC001141139609 1132026681 /nfs/dbraw/zinc/02/66/81/1132026681.db2.gz YVYAVQHVKFXGOR-UHFFFAOYSA-N 1 0 296.414 3.537 20 10 CHCDRO C[C@@H]1CCC[C@H]([NH2+]Cc2ccc3c(c2)CCO3)[C@@H]1C ZINC000037362695 1132030745 /nfs/dbraw/zinc/03/07/45/1132030745.db2.gz WZIZOVHYPNVVCX-IOASZLSFSA-N 1 0 259.393 3.536 20 10 CHCDRO Cc1cccc2c1CC[C@H]([NH2+][C@@H](C)c1ccccc1O)C2 ZINC001171552991 1132052998 /nfs/dbraw/zinc/05/29/98/1132052998.db2.gz JRGUDOADQHCPOP-HOCLYGCPSA-N 1 0 281.399 3.909 20 10 CHCDRO Cc1cccc2c1CC[C@@H]([NH2+][C@H](C)c1ccccc1O)C2 ZINC001171552989 1132053423 /nfs/dbraw/zinc/05/34/23/1132053423.db2.gz JRGUDOADQHCPOP-GDBMZVCRSA-N 1 0 281.399 3.909 20 10 CHCDRO COc1ccc(C[NH2+][C@H]2CCc3c(C)cccc3C2)cc1C ZINC001171560626 1132055830 /nfs/dbraw/zinc/05/58/30/1132055830.db2.gz UTDDLHCFZXDUFX-SFHVURJKSA-N 1 0 295.426 3.959 20 10 CHCDRO Cc1csc(C[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3C)n1 ZINC000038090558 1132112780 /nfs/dbraw/zinc/11/27/80/1132112780.db2.gz OAFMBJHKTPYCLL-CMPLNLGQSA-N 1 0 288.416 3.804 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CSc3ccccc3C2)cc1C ZINC001172201147 1132148337 /nfs/dbraw/zinc/14/83/37/1132148337.db2.gz MOFLVYICLBOZCD-INIZCTEOSA-N 1 0 299.439 3.810 20 10 CHCDRO C[C@@H]1CC[C@H]([N@@H+]2CCCc3cc(O)c(O)cc3C2)C[C@H]1C ZINC001172379413 1132171636 /nfs/dbraw/zinc/17/16/36/1132171636.db2.gz OGJDVXGEPJBOSU-IOASZLSFSA-N 1 0 289.419 3.671 20 10 CHCDRO Cc1cc(O)c(C[NH+]2CC(C)(CC(F)(F)F)C2)cc1C ZINC000839145620 1132184852 /nfs/dbraw/zinc/18/48/52/1132184852.db2.gz QVFGTIJNRGGGSJ-UHFFFAOYSA-N 1 0 287.325 3.783 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)cc1 ZINC000839190602 1132190282 /nfs/dbraw/zinc/19/02/82/1132190282.db2.gz INGQBXQFWBVIHN-DUAOJKPGSA-N 1 0 270.420 3.544 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2C[C@@H]3C[C@H]2CS3)cc1C(C)C ZINC000840170181 1132248595 /nfs/dbraw/zinc/24/85/95/1132248595.db2.gz QIOZZAFSHFWYLD-KBPBESRZSA-N 1 0 277.433 3.514 20 10 CHCDRO Cc1cccc(C[NH2+]C2CC(C)(C)OC(C)(C)C2)c1O ZINC001172652390 1132287836 /nfs/dbraw/zinc/28/78/36/1132287836.db2.gz QYJXXYQINWMFAE-UHFFFAOYSA-N 1 0 277.408 3.526 20 10 CHCDRO C[C@@H]([NH2+]C1(C2CCC2)CCC1)c1cc(F)ccc1O ZINC000840812289 1132291123 /nfs/dbraw/zinc/29/11/23/1132291123.db2.gz XYUAQQFVNLERQW-LLVKDONJSA-N 1 0 263.356 3.905 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CS[C@@H](C)C1)c1ccc(N(C)C)cc1 ZINC000840857243 1132295383 /nfs/dbraw/zinc/29/53/83/1132295383.db2.gz WMUVALSSYNRJNQ-BJJXKVORSA-N 1 0 278.465 3.687 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)[C@](C)(OC)C1CC1)c1ccc(C)cc1O ZINC000840858841 1132296177 /nfs/dbraw/zinc/29/61/77/1132296177.db2.gz GZHIPPALFDWLBD-SKDZVZGDSA-N 1 0 291.435 3.945 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1C[C@H](C)O[C@@H]1C)c1cc(Cl)ccc1O ZINC000840873079 1132298535 /nfs/dbraw/zinc/29/85/35/1132298535.db2.gz QQEMLXISZUKMSK-OXIQGZBJSA-N 1 0 297.826 3.900 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CC(C)(C)OCC2CC2)c(O)c1 ZINC000840876407 1132299586 /nfs/dbraw/zinc/29/95/86/1132299586.db2.gz MIYBBPHXABEKJZ-CYBMUJFWSA-N 1 0 277.408 3.556 20 10 CHCDRO COC1([C@H](C)[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3F)CCC1 ZINC000840882722 1132301718 /nfs/dbraw/zinc/30/17/18/1132301718.db2.gz ACNGYGJQJAAFHN-NTZNESFSSA-N 1 0 293.382 3.627 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)C1(OC)CCC1)c1ccc(N(C)C)cc1 ZINC000840883704 1132302269 /nfs/dbraw/zinc/30/22/69/1132302269.db2.gz HOMBKQOIZSHWLT-PBHICJAKSA-N 1 0 290.451 3.751 20 10 CHCDRO C[C@@H]([NH2+]CC(C)(C)c1cccnc1)c1cc(F)ccc1O ZINC000840890640 1132304891 /nfs/dbraw/zinc/30/48/91/1132304891.db2.gz CCRPLPUSWRSIJO-GFCCVEGCSA-N 1 0 288.366 3.555 20 10 CHCDRO CCN(CC)c1ccc(CNc2[nH+]ccn2C2CC2)cc1 ZINC000840887066 1132305047 /nfs/dbraw/zinc/30/50/47/1132305047.db2.gz GUMIHZOIYDFVBT-UHFFFAOYSA-N 1 0 284.407 3.676 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[C@@H](C)[NH2+][C@H](C)c1ccncc1 ZINC000840893350 1132305498 /nfs/dbraw/zinc/30/54/98/1132305498.db2.gz IUPYFOIHOQZYLD-HZPDHXFCSA-N 1 0 297.446 3.738 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+](C)[C@@H](C)c1ccco1 ZINC000840910476 1132307889 /nfs/dbraw/zinc/30/78/89/1132307889.db2.gz NNVKXJULWWUDIL-AWEZNQCLSA-N 1 0 272.392 3.847 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCC(F)(F)[C@@H](C)C1 ZINC000840946169 1132311194 /nfs/dbraw/zinc/31/11/94/1132311194.db2.gz HJRNLQKYPYKCJV-ZDUSSCGKSA-N 1 0 282.378 3.538 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]CC(C)(C)C(F)(F)F ZINC000840942840 1132311724 /nfs/dbraw/zinc/31/17/24/1132311724.db2.gz HMQBUJGEZMZAQZ-UHFFFAOYSA-N 1 0 288.357 3.739 20 10 CHCDRO COCC1CCC([NH2+]Cc2cc(Cl)cc(C)c2O)CC1 ZINC000840962505 1132313463 /nfs/dbraw/zinc/31/34/63/1132313463.db2.gz KWLQSZZWCPGJGU-UHFFFAOYSA-N 1 0 297.826 3.649 20 10 CHCDRO C[C@H](C[NH2+]Cc1ccc(N(C)C)c(F)c1)CC(F)(F)F ZINC000840962392 1132314189 /nfs/dbraw/zinc/31/41/89/1132314189.db2.gz AJDGAWMRKJZDMA-JTQLQIEISA-N 1 0 292.320 3.570 20 10 CHCDRO Cc1cccc(CNc2ccc(C[NH+](C)C)cc2F)c1O ZINC000840958283 1132314280 /nfs/dbraw/zinc/31/42/80/1132314280.db2.gz PVFPCDHKOWLQBW-UHFFFAOYSA-N 1 0 288.366 3.513 20 10 CHCDRO CC(C)OCC(C)(C)[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC000840973196 1132315308 /nfs/dbraw/zinc/31/53/08/1132315308.db2.gz FNJBCFLTQWRJIR-FPLPWBNLSA-N 1 0 290.451 3.559 20 10 CHCDRO CCC[N@H+](Cc1c(O)ccc2ccccc21)C1CCOCC1 ZINC001231590635 1132317434 /nfs/dbraw/zinc/31/74/34/1132317434.db2.gz JNPVFJGMFXVAIU-UHFFFAOYSA-N 1 0 299.414 3.936 20 10 CHCDRO C[C@]1(F)CC[N@H+](Cc2c(O)ccc3ccccc32)C[C@H]1F ZINC001231587629 1132319283 /nfs/dbraw/zinc/31/92/83/1132319283.db2.gz WSISTPCOUCEPBE-SJORKVTESA-N 1 0 291.341 3.817 20 10 CHCDRO Cc1cccc(C[N@H+](C)Cc2cccc(F)c2F)c1O ZINC001231594559 1132320058 /nfs/dbraw/zinc/32/00/58/1132320058.db2.gz LIAOLTGSHZYSLT-UHFFFAOYSA-N 1 0 277.314 3.611 20 10 CHCDRO Nc1ccc(CC[NH2+][C@@H]2CCC[C@@H]2c2ccccc2)cc1 ZINC000841034071 1132320974 /nfs/dbraw/zinc/32/09/74/1132320974.db2.gz GEQDQDVKPBXLNI-RTBURBONSA-N 1 0 280.415 3.737 20 10 CHCDRO C[C@@H](CCc1ccc(F)cc1)[NH2+]CCc1ccc(N)cc1 ZINC000841033765 1132321381 /nfs/dbraw/zinc/32/13/81/1132321381.db2.gz AMWIHDQNSYCZFX-AWEZNQCLSA-N 1 0 286.394 3.561 20 10 CHCDRO Cc1cccc(C[N@H+](C)C/C=C/c2ccccc2)c1O ZINC001231593735 1132322038 /nfs/dbraw/zinc/32/20/38/1132322038.db2.gz LPOSXLJIGAFENH-YRNVUSSQSA-N 1 0 267.372 3.846 20 10 CHCDRO C[C@H]([NH3+])c1ccc(NC/C=C\c2ccc(N(C)C)cc2)cc1 ZINC000841031036 1132322079 /nfs/dbraw/zinc/32/20/79/1132322079.db2.gz OAJDXRJAYUJXLY-XVWMLYKFSA-N 1 0 295.430 3.898 20 10 CHCDRO CC[N@H+](Cc1cccc(OC)c1)Cc1cccc(C)c1O ZINC001231592206 1132322210 /nfs/dbraw/zinc/32/22/10/1132322210.db2.gz GDVGXTOFZBTAGC-UHFFFAOYSA-N 1 0 285.387 3.731 20 10 CHCDRO COc1ccc(C[NH2+][C@H]2CCCc3cc(N)ccc32)cc1C ZINC000841057142 1132324169 /nfs/dbraw/zinc/32/41/69/1132324169.db2.gz BYJDRQUUSWMGMQ-SFHVURJKSA-N 1 0 296.414 3.753 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)cc1)[C@@H]1CCC[C@H](OC)C1 ZINC001172950290 1132374634 /nfs/dbraw/zinc/37/46/34/1132374634.db2.gz MGPWCMBGCOZFRU-MSOLQXFVSA-N 1 0 290.451 3.532 20 10 CHCDRO CCC[C@H]1CCCC[N@@H+]1Cc1ccc(N(C)C)cc1OC ZINC001231854134 1132377742 /nfs/dbraw/zinc/37/77/42/1132377742.db2.gz ZTQUOAVQMHYGJW-INIZCTEOSA-N 1 0 290.451 3.916 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCO[C@@H](c3ccccc3)C2)c(O)c1 ZINC001231846862 1132378283 /nfs/dbraw/zinc/37/82/83/1132378283.db2.gz RHJITDDVCYEMOU-LJQANCHMSA-N 1 0 297.398 3.583 20 10 CHCDRO COc1cc(N(C)C)ccc1C[N@H+](C)[C@H]1CC[C@H](C)CC1 ZINC001231854425 1132378974 /nfs/dbraw/zinc/37/89/74/1132378974.db2.gz ALDJVEIEHPYGCF-KOMQPUFPSA-N 1 0 290.451 3.772 20 10 CHCDRO CC[C@@H]1CCCC[N@@H+]1Cc1ccc(N(C)C)cc1OC ZINC001231855434 1132380058 /nfs/dbraw/zinc/38/00/58/1132380058.db2.gz UGXSXPRYLCRBDJ-OAHLLOKOSA-N 1 0 276.424 3.526 20 10 CHCDRO Cc1cc(O)c(C[NH+]2C[C@@H](C)C[C@H](C)C2)cc1Cl ZINC001231870714 1132383267 /nfs/dbraw/zinc/38/32/67/1132383267.db2.gz PKTZHBOMZVUJQF-QWRGUYRKSA-N 1 0 267.800 3.832 20 10 CHCDRO C[C@H]1CC[N@H+](Cc2ccc3ccccc3c2O)CC[C@]1(C)O ZINC001231879356 1132389394 /nfs/dbraw/zinc/38/93/94/1132389394.db2.gz CJPHJIUJKVJYNF-LIRRHRJNSA-N 1 0 299.414 3.528 20 10 CHCDRO C[C@@]1(F)CC[N@H+](Cc2ccc3ccccc3c2O)C[C@H]1F ZINC001231879903 1132389978 /nfs/dbraw/zinc/38/99/78/1132389978.db2.gz VLDMJLURPAWOLT-NVXWUHKLSA-N 1 0 291.341 3.817 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)[C@H]1CCCO1 ZINC000841751117 1132390569 /nfs/dbraw/zinc/39/05/69/1132390569.db2.gz KSSUWMXDEQKTJG-VZJVUDMVSA-N 1 0 283.799 3.654 20 10 CHCDRO Oc1c(C[N@@H+]2CC3CCC2CC3)ccc2ccccc21 ZINC001231881098 1132392107 /nfs/dbraw/zinc/39/21/07/1132392107.db2.gz QXEMPGLZKQZGAA-UHFFFAOYSA-N 1 0 267.372 3.920 20 10 CHCDRO C[N@H+](Cc1cncs1)Cc1ccc2ccccc2c1O ZINC001231882721 1132392159 /nfs/dbraw/zinc/39/21/59/1132392159.db2.gz LDOLUORUUVHGIO-UHFFFAOYSA-N 1 0 284.384 3.634 20 10 CHCDRO C[C@H]([NH2+]CC(C)(C)OCC1CC1)c1ccc(Cl)cc1O ZINC000841755360 1132392204 /nfs/dbraw/zinc/39/22/04/1132392204.db2.gz JNCGDGMDWJJQIU-NSHDSACASA-N 1 0 297.826 3.901 20 10 CHCDRO CC[C@](C)(C[NH2+][C@@H](C)c1ccc(Cl)cc1O)OC ZINC000841759013 1132394440 /nfs/dbraw/zinc/39/44/40/1132394440.db2.gz WXEKQMWKJXHUQM-IINYFYTJSA-N 1 0 271.788 3.511 20 10 CHCDRO Cc1cc(C[NH2+][C@H](C)c2ccc(Cl)cc2O)ccn1 ZINC000841757640 1132394747 /nfs/dbraw/zinc/39/47/47/1132394747.db2.gz ODCVDTGQVQYOSQ-LLVKDONJSA-N 1 0 276.767 3.600 20 10 CHCDRO COC1(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)CCCC1 ZINC000841758052 1132395308 /nfs/dbraw/zinc/39/53/08/1132395308.db2.gz RNPGBWZELBAAAU-NSHDSACASA-N 1 0 283.799 3.655 20 10 CHCDRO CC[C@@H](C[N@H+](C)Cc1ccc(N2CCCCC2)cc1)OC ZINC000842147766 1132410955 /nfs/dbraw/zinc/41/09/55/1132410955.db2.gz NARFILLVBRYHMQ-SFHVURJKSA-N 1 0 290.451 3.534 20 10 CHCDRO CCCC[C@H](CC(C)C)[NH2+]Cc1ccc(O)c(O)c1 ZINC001173253092 1132422886 /nfs/dbraw/zinc/42/28/86/1132422886.db2.gz MMEXBHKMVPSUFU-CQSZACIVSA-N 1 0 265.397 3.792 20 10 CHCDRO C[N@@H+](Cc1cc(Cl)c(O)cc1O)CC1CCCCC1 ZINC001232262223 1132445422 /nfs/dbraw/zinc/44/54/22/1132445422.db2.gz CAPNPOUHVVVWBO-UHFFFAOYSA-N 1 0 283.799 3.763 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CCC23CCCC3)cc1Cl ZINC001232266368 1132447668 /nfs/dbraw/zinc/44/76/68/1132447668.db2.gz MDSGAQOYHVOXPH-UHFFFAOYSA-N 1 0 281.783 3.573 20 10 CHCDRO CC[N@H+](CCSC)Cc1cc(C(C)(C)C)cc(O)c1O ZINC000842644649 1132448041 /nfs/dbraw/zinc/44/80/41/1132448041.db2.gz QGAPBEFBIMSHGI-UHFFFAOYSA-N 1 0 297.464 3.580 20 10 CHCDRO CC(C)(C)c1cccc(CN2C[C@@H](F)C[C@H]2CF)c1O ZINC001143104014 1132501705 /nfs/dbraw/zinc/50/17/05/1132501705.db2.gz OBQCXVDKCCPOAW-STQMWFEESA-N 1 0 283.362 3.572 20 10 CHCDRO CC(C)(C)c1cccc(C[N@@H+]2CCC[C@@H]2CF)c1O ZINC001143116488 1132503876 /nfs/dbraw/zinc/50/38/76/1132503876.db2.gz DUQXBYAHUIKOJR-CYBMUJFWSA-N 1 0 265.372 3.624 20 10 CHCDRO C[N@@H+](Cc1cccc(C(C)(C)C)c1O)C[C@H]1CCCCO1 ZINC001143110512 1132504337 /nfs/dbraw/zinc/50/43/37/1132504337.db2.gz HNJKQACTDZLQHA-OAHLLOKOSA-N 1 0 291.435 3.691 20 10 CHCDRO C[C@H]1SCC[C@H]1[NH2+]Cc1ccc2ccccc2c1O ZINC000843435485 1132534434 /nfs/dbraw/zinc/53/44/34/1132534434.db2.gz UXBBJGZVDCYRQV-IAQYHMDHSA-N 1 0 273.401 3.529 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)Cc2ccc3ncoc3c2)cc1 ZINC001232944488 1132548341 /nfs/dbraw/zinc/54/83/41/1132548341.db2.gz TZPLJOYCXFYSSJ-UHFFFAOYSA-N 1 0 295.386 3.526 20 10 CHCDRO CCOC1CC[NH+](Cc2cc(C(C)(C)C)ccc2O)CC1 ZINC001233286525 1132595029 /nfs/dbraw/zinc/59/50/29/1132595029.db2.gz XNFMVBYIPRFGQK-UHFFFAOYSA-N 1 0 291.435 3.691 20 10 CHCDRO COc1cc(Cl)cc(C[NH+]2CC3(C2)CCCCC3)c1O ZINC001233290063 1132596269 /nfs/dbraw/zinc/59/62/69/1132596269.db2.gz GJHFGWZGKKWONO-UHFFFAOYSA-N 1 0 295.810 3.820 20 10 CHCDRO Oc1cc(C(F)(F)F)ccc1C[NH+]1CCC(CF)CC1 ZINC001233454426 1132624748 /nfs/dbraw/zinc/62/47/48/1132624748.db2.gz USONWMZTIMJOGK-UHFFFAOYSA-N 1 0 291.288 3.593 20 10 CHCDRO C[C@H]1C[C@@H](CF)[N@H+](Cc2ccc(C(F)(F)F)cc2O)C1 ZINC001233452450 1132624904 /nfs/dbraw/zinc/62/49/04/1132624904.db2.gz XFJGMCUCDHGRAR-CABZTGNLSA-N 1 0 291.288 3.591 20 10 CHCDRO C[C@H]1C[C@H](C)C[NH+](Cc2ccc(C(F)(F)F)cc2O)C1 ZINC001233455143 1132625590 /nfs/dbraw/zinc/62/55/90/1132625590.db2.gz XYEANVNDKVJNFA-QWRGUYRKSA-N 1 0 287.325 3.889 20 10 CHCDRO CCN(Cc1ccccc1O)c1cc(OC(C)C)cc[nH+]1 ZINC001154888645 1132629589 /nfs/dbraw/zinc/62/95/89/1132629589.db2.gz GBAWLVOJOZOCRD-UHFFFAOYSA-N 1 0 286.375 3.601 20 10 CHCDRO CCC[NH+](CCC)Cc1cccc(OC(F)(F)F)c1O ZINC001233728641 1132671500 /nfs/dbraw/zinc/67/15/00/1132671500.db2.gz XXRZGJGWQOEATF-UHFFFAOYSA-N 1 0 291.313 3.913 20 10 CHCDRO C[N@H+](CCC1CC1)Cc1cccc(OC(F)(F)F)c1O ZINC001233767472 1132677674 /nfs/dbraw/zinc/67/76/74/1132677674.db2.gz CSHKKEAUHDAXNL-UHFFFAOYSA-N 1 0 289.297 3.523 20 10 CHCDRO COc1ccc2c(cc[nH+]c2NCc2cccc(C)c2O)c1 ZINC001160769063 1132981223 /nfs/dbraw/zinc/98/12/23/1132981223.db2.gz JFVDKZURHQDXOC-UHFFFAOYSA-N 1 0 294.354 3.870 20 10 CHCDRO Cc1ccc(/C=C/c2ccc(N3CC[C@@H]([NH3+])C3)cc2)cc1 ZINC001164286151 1133211834 /nfs/dbraw/zinc/21/18/34/1133211834.db2.gz HDAZBPJLWHROTM-IPLHWJFFSA-N 1 0 278.399 3.703 20 10 CHCDRO CCc1ccc(C[N@@H+](CC)Cc2ccc(N(C)C)cc2)o1 ZINC001204394828 1133228106 /nfs/dbraw/zinc/22/81/06/1133228106.db2.gz TXIRWHHLYIHAAI-UHFFFAOYSA-N 1 0 286.419 3.930 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH2+]CCC2CCC2)cc1 ZINC001203553517 1133338483 /nfs/dbraw/zinc/33/84/83/1133338483.db2.gz HCGSKBYLLXCGNN-QPJJXVBHSA-N 1 0 258.409 3.546 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(OC)c(C)c1)[C@@H](O)c1ccccc1 ZINC001203582593 1133342306 /nfs/dbraw/zinc/34/23/06/1133342306.db2.gz HGNDKJZEXZBWCX-HKUYNNGSSA-N 1 0 299.414 3.605 20 10 CHCDRO COc1ccc(C[N@@H+]2CCC[C@H]2C2CCCCC2)c(O)c1 ZINC001203629253 1133345941 /nfs/dbraw/zinc/34/59/41/1133345941.db2.gz UMJUGSUOBZYNAQ-KRWDZBQOSA-N 1 0 289.419 3.946 20 10 CHCDRO COc1cc(C)c(C[N@@H+]2CCc3cccc(O)c3C2)cc1C ZINC001203759136 1133366887 /nfs/dbraw/zinc/36/68/87/1133366887.db2.gz XUWNNEYQTPJKER-UHFFFAOYSA-N 1 0 297.398 3.576 20 10 CHCDRO CCCC1CC[NH+](Cc2ccc(N(C)C)cc2)CC1 ZINC001203934402 1133386071 /nfs/dbraw/zinc/38/60/71/1133386071.db2.gz UYRRHRXPNHXIFK-UHFFFAOYSA-N 1 0 260.425 3.765 20 10 CHCDRO C[C@@H]1CCC[N@H+](Cc2ccc(N(C)C)cc2)C[C@@H]1C ZINC001203929408 1133386223 /nfs/dbraw/zinc/38/62/23/1133386223.db2.gz CGZAIGICKOIPPL-CABCVRRESA-N 1 0 260.425 3.621 20 10 CHCDRO CCN(CC)c1ccc(CN2CC[C@](C)(F)[C@@H](F)C2)cc1 ZINC001203939953 1133386274 /nfs/dbraw/zinc/38/62/74/1133386274.db2.gz GUSXOEQCQBWSMQ-IRXDYDNUSA-N 1 0 296.405 3.805 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@H](CF)C2)cc1 ZINC001203939843 1133386479 /nfs/dbraw/zinc/38/64/79/1133386479.db2.gz WSJUEKWYRJGLLP-MRXNPFEDSA-N 1 0 278.415 3.714 20 10 CHCDRO Cc1ccc2c(c1)CC[N@@H+](Cc1ccc(N(C)C)cc1)C2 ZINC001203937101 1133386794 /nfs/dbraw/zinc/38/67/94/1133386794.db2.gz KQEKMOAOTQMTSC-UHFFFAOYSA-N 1 0 280.415 3.619 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCCC2(C)C)cc1 ZINC001203936763 1133387018 /nfs/dbraw/zinc/38/70/18/1133387018.db2.gz MXXZONPCVWFDGT-UHFFFAOYSA-N 1 0 260.425 3.907 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CCC[C@@H]3C[C@@H]32)cc1 ZINC001203943920 1133388730 /nfs/dbraw/zinc/38/87/30/1133388730.db2.gz INLQUTHQQSLJNO-WBVHZDCISA-N 1 0 258.409 3.517 20 10 CHCDRO CCN(CC)c1ccc(C[N@@H+]2CC3CCC2CC3)cc1 ZINC001203942848 1133388860 /nfs/dbraw/zinc/38/88/60/1133388860.db2.gz UTLDXGRITPKGTA-UHFFFAOYSA-N 1 0 272.436 3.907 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)CCOC(C)(C)C)cc1Cl ZINC001204211530 1133419527 /nfs/dbraw/zinc/41/95/27/1133419527.db2.gz BVXJOADMEUSNLM-UHFFFAOYSA-N 1 0 285.815 3.601 20 10 CHCDRO CC(C)[NH+](Cc1ccc(N2CCCC2)cc1)C(C)C ZINC001204320242 1133436583 /nfs/dbraw/zinc/43/65/83/1133436583.db2.gz PPHVIMHUTNLRDZ-UHFFFAOYSA-N 1 0 260.425 3.906 20 10 CHCDRO CC(C)[C@H]1CCC[N@@H+]1Cc1ccc(N2CCCC2)cc1 ZINC001204328619 1133438292 /nfs/dbraw/zinc/43/82/92/1133438292.db2.gz KSTFGVRKGSDIAX-GOSISDBHSA-N 1 0 272.436 3.907 20 10 CHCDRO CC(C)[C@@H]1CCC[N@@H+]1Cc1ccc(N2CCCC2)cc1 ZINC001204328620 1133438762 /nfs/dbraw/zinc/43/87/62/1133438762.db2.gz KSTFGVRKGSDIAX-SFHVURJKSA-N 1 0 272.436 3.907 20 10 CHCDRO CN(C)c1ccc(/C=C/C[NH+]2CCC(C)(C)CC2)cc1 ZINC001204533340 1133459626 /nfs/dbraw/zinc/45/96/26/1133459626.db2.gz FBNAGDYQHOSVCN-AATRIKPKSA-N 1 0 272.436 3.888 20 10 CHCDRO CCc1cccc(C[N@H+](C)CCCOc2ccccc2)c1O ZINC001204881744 1133495066 /nfs/dbraw/zinc/49/50/66/1133495066.db2.gz SVJBQIJWLYGUBD-UHFFFAOYSA-N 1 0 299.414 3.856 20 10 CHCDRO Cc1ccc(C[NH2+]C/C=C\c2ccccc2)c(O)c1 ZINC001204983949 1133512792 /nfs/dbraw/zinc/51/27/92/1133512792.db2.gz DVPHVCWTEBYGEM-YVMONPNESA-N 1 0 253.345 3.504 20 10 CHCDRO COc1cc(C)cc(C[NH2+]C[C@H](SC)C(C)(C)C)c1O ZINC001205394541 1133573002 /nfs/dbraw/zinc/57/30/02/1133573002.db2.gz RYGXOGYRNLBVAX-AWEZNQCLSA-N 1 0 297.464 3.577 20 10 CHCDRO CC(C)c1ccc(O)c(C[NH2+][C@@H]2C[C@H]2C2CCC2)c1 ZINC001206377212 1133695329 /nfs/dbraw/zinc/69/53/29/1133695329.db2.gz QCKBAJSZJXRFRG-JKSUJKDBSA-N 1 0 259.393 3.794 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CCc3ccccc3C2(C)C)c1 ZINC001206385527 1133697126 /nfs/dbraw/zinc/69/71/26/1133697126.db2.gz WEGOWEICNLZYHC-UHFFFAOYSA-N 1 0 297.398 3.694 20 10 CHCDRO Cc1cc(O)c(C[NH+]2CCC(CCF)CC2)c(Cl)c1 ZINC001207076581 1133766340 /nfs/dbraw/zinc/76/63/40/1133766340.db2.gz SZYPWWSPNBNRQW-UHFFFAOYSA-N 1 0 285.790 3.926 20 10 CHCDRO CC[N@H+](CCc1cccc(C)c1)Cc1ccccc1O ZINC001207537268 1133818441 /nfs/dbraw/zinc/81/84/41/1133818441.db2.gz ZPMATOUYPNXKBZ-UHFFFAOYSA-N 1 0 269.388 3.765 20 10 CHCDRO CS[C@H](C)CC[N@H+](C)Cc1ccc(N2CCCC2)cc1 ZINC001208141355 1133884256 /nfs/dbraw/zinc/88/42/56/1133884256.db2.gz KCVSXUPLJFUUQO-OAHLLOKOSA-N 1 0 292.492 3.860 20 10 CHCDRO CC[N@@H+](Cc1ccccc1O)C[C@H](C)OCc1ccccc1 ZINC001208703148 1133930236 /nfs/dbraw/zinc/93/02/36/1133930236.db2.gz WERCTZPFBOKQOL-INIZCTEOSA-N 1 0 299.414 3.819 20 10 CHCDRO Cc1ccc2[nH]cc(C[N@@H+]3CCc4cccc(O)c4C3)c2c1 ZINC001209493478 1134030742 /nfs/dbraw/zinc/03/07/42/1134030742.db2.gz HRUOEYUGYMEGEA-UHFFFAOYSA-N 1 0 292.382 3.740 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(C[N@H+]2CCOC[C@H](C)C2)cc1 ZINC001209518978 1134034875 /nfs/dbraw/zinc/03/48/75/1134034875.db2.gz OTZKYTUCSATTKK-OAHLLOKOSA-N 1 0 298.430 3.562 20 10 CHCDRO c1cc(Nc2ccc3c(c2)OCCN3)cc(C2CC2)[nH+]1 ZINC001209723059 1134055108 /nfs/dbraw/zinc/05/51/08/1134055108.db2.gz URGDVSMGAYIYDA-UHFFFAOYSA-N 1 0 267.332 3.507 20 10 CHCDRO CN(c1ccc(N)cc1)c1cc[nH+]c(C(C)(C)C)c1 ZINC001213168639 1134434276 /nfs/dbraw/zinc/43/42/76/1134434276.db2.gz NRLCIHPJTLIZFG-UHFFFAOYSA-N 1 0 255.365 3.729 20 10 CHCDRO CC[C@@H]1C[N@H+](Cc2c(O)ccc3ccccc32)[C@@H](C)CO1 ZINC000403825813 1134877782 /nfs/dbraw/zinc/87/77/82/1134877782.db2.gz MLRPVNSDAAPNMU-DZGCQCFKSA-N 1 0 285.387 3.545 20 10 CHCDRO C[NH2+][C@H]1C[C@H](Oc2ccc(NN=C3C=CC(=O)C=C3)cc2)C1 ZINC001217955114 1135030212 /nfs/dbraw/zinc/03/02/12/1135030212.db2.gz NCDHNUMNMKFBIH-CZIWCDLHSA-N 1 0 297.358 3.937 20 10 CHCDRO COc1cc(C)ccc1[C@@H](C)[NH2+]Cc1ccc(N(C)C)cc1 ZINC000315908461 1135162423 /nfs/dbraw/zinc/16/24/23/1135162423.db2.gz RREHMLFDADDINZ-OAHLLOKOSA-N 1 0 298.430 3.920 20 10 CHCDRO Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+][C@@H](CO)c1ccccc1 ZINC000318946861 1135180933 /nfs/dbraw/zinc/18/09/33/1135180933.db2.gz HXPGPUQQEXMJIB-BMFZPTHFSA-N 1 0 297.398 3.572 20 10 CHCDRO CC(=O)c1cc(F)cc(C[NH+]2CCCCCCCC2)c1[O-] ZINC000321795569 1135507890 /nfs/dbraw/zinc/50/78/90/1135507890.db2.gz WHNUDTJCGNMOOK-UHFFFAOYSA-N 1 0 293.382 3.890 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccc(Cl)cc1)c1ccccc1O ZINC000020122553 171002994 /nfs/dbraw/zinc/00/29/94/171002994.db2.gz HHEZQRQMYNGXGE-GFCCVEGCSA-N 1 0 275.779 3.939 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccccn2)c(O)c1 ZINC000020123899 171005317 /nfs/dbraw/zinc/00/53/17/171005317.db2.gz YMEWWNOZLMKLFL-CHWSQXEVSA-N 1 0 256.349 3.507 20 10 CHCDRO C[C@H]([NH2+]Cc1ccccc1OC(F)F)c1ccccc1O ZINC000020131626 171020264 /nfs/dbraw/zinc/02/02/64/171020264.db2.gz DGPQFDXCPQVYCY-NSHDSACASA-N 1 0 293.313 3.844 20 10 CHCDRO Cc1cccc(C[NH2+]Cc2cc(Cl)ccc2O)c1 ZINC000020134188 171021949 /nfs/dbraw/zinc/02/19/49/171021949.db2.gz YIJMNTPDJHKOIK-UHFFFAOYSA-N 1 0 261.752 3.644 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H]2CCCc3occc32)cc1 ZINC000020203834 171068405 /nfs/dbraw/zinc/06/84/05/171068405.db2.gz RKJNMSPELJCSSY-INIZCTEOSA-N 1 0 270.376 3.513 20 10 CHCDRO C[C@H]1CCC[C@H](C)C1[NH2+]Cc1ccc(N(C)C)cc1 ZINC000021011769 171287130 /nfs/dbraw/zinc/28/71/30/171287130.db2.gz WWPXUFKHIJCUJJ-KBPBESRZSA-N 1 0 260.425 3.667 20 10 CHCDRO FC(F)(F)C1CCC([NH2+]Cc2ccc3c(c2)CCO3)CC1 ZINC000037363437 260094811 /nfs/dbraw/zinc/09/48/11/260094811.db2.gz SNUDPBQZDDQTOD-UHFFFAOYSA-N 1 0 299.336 3.832 20 10 CHCDRO C[C@@H](NCc1ccc2c(c1)CCO2)c1c(F)cccc1F ZINC000037771883 260116384 /nfs/dbraw/zinc/11/63/84/260116384.db2.gz HRNPFIKKDYEKPB-LLVKDONJSA-N 1 0 289.325 3.751 20 10 CHCDRO COc1ccc([C@@H](C)[NH2+]Cc2cc(C)ccc2O)cc1 ZINC000078638558 260168309 /nfs/dbraw/zinc/16/83/09/260168309.db2.gz NLRNWEPITSOWEI-CYBMUJFWSA-N 1 0 271.360 3.560 20 10 CHCDRO Fc1cccc(C2([NH2+]Cc3ccc4c(c3)CCO4)CC2)c1 ZINC000152867954 261070616 /nfs/dbraw/zinc/07/06/16/261070616.db2.gz JWJBXLRILQDNDS-UHFFFAOYSA-N 1 0 283.346 3.540 20 10 CHCDRO CC[C@H]([NH2+]Cc1c(C)noc1C)c1ccc(N(C)C)cc1 ZINC000153942078 261085637 /nfs/dbraw/zinc/08/56/37/261085637.db2.gz YSAJVCJFWVEUKL-KRWDZBQOSA-N 1 0 287.407 3.598 20 10 CHCDRO CC[C@@H]([NH2+]CCCOC1CCCC1)c1ccccc1O ZINC000155492012 261102421 /nfs/dbraw/zinc/10/24/21/261102421.db2.gz XNEKHMOSQWQZTL-MRXNPFEDSA-N 1 0 277.408 3.782 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)Cc1c(C)noc1C)c1ccccc1O ZINC000155925567 261110120 /nfs/dbraw/zinc/11/01/20/261110120.db2.gz JXTCIJJXXFZRPV-BDJLRTHQSA-N 1 0 288.391 3.669 20 10 CHCDRO CC[C@@H]([NH2+][C@H](COC)c1ccc(C)o1)c1ccccc1O ZINC000156179963 261115985 /nfs/dbraw/zinc/11/59/85/261115985.db2.gz VMVLJNJKIDYHSP-HUUCEWRRSA-N 1 0 289.375 3.722 20 10 CHCDRO CCOCCC1(C[NH2+][C@H](CC)c2ccccc2O)CC1 ZINC000156860817 261134173 /nfs/dbraw/zinc/13/41/73/261134173.db2.gz HUEHWDYXOZMNRD-OAHLLOKOSA-N 1 0 277.408 3.640 20 10 CHCDRO CC[C@@H]([NH2+]CCC[C@@H]1CCCCO1)c1ccccc1O ZINC000158115053 261158753 /nfs/dbraw/zinc/15/87/53/261158753.db2.gz AWYNCXORBDEHBF-GOEBONIOSA-N 1 0 277.408 3.782 20 10 CHCDRO CCC[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cccnc1 ZINC000184894661 262032374 /nfs/dbraw/zinc/03/23/74/262032374.db2.gz PGGYPGRCGOSHTE-SFHVURJKSA-N 1 0 283.419 3.779 20 10 CHCDRO C[C@H]([NH2+]CCCOCC1CC1)c1cc(Cl)ccc1O ZINC000184900854 262033351 /nfs/dbraw/zinc/03/33/51/262033351.db2.gz RUGOUYJEHWFTEW-NSHDSACASA-N 1 0 283.799 3.513 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(C)cc2C)c1 ZINC000185066709 262039183 /nfs/dbraw/zinc/03/91/83/262039183.db2.gz VXPOWOUCHXSBRM-AWEZNQCLSA-N 1 0 285.387 3.868 20 10 CHCDRO CCOc1ccccc1C[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000185103613 262040928 /nfs/dbraw/zinc/04/09/28/262040928.db2.gz PAHOPAYQEOSXKO-AWEZNQCLSA-N 1 0 285.387 3.950 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H](CCCO)c2ccccc2)c1 ZINC000185532105 262058471 /nfs/dbraw/zinc/05/84/71/262058471.db2.gz KIUFWTGEGCQBMI-YJBOKZPZSA-N 1 0 299.414 3.865 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](CCO)c2ccccc2)c(O)c1 ZINC000185525966 262059057 /nfs/dbraw/zinc/05/90/57/262059057.db2.gz OBQWECCVXJAJCL-WBVHZDCISA-N 1 0 299.414 3.517 20 10 CHCDRO CCc1cnc(C[NH2+][C@H](C)c2cc(Cl)ccc2O)s1 ZINC000185584133 262061140 /nfs/dbraw/zinc/06/11/40/262061140.db2.gz CBDZFPITLRPYIF-SECBINFHSA-N 1 0 296.823 3.915 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCC[C@H]2OCC[C@@H]21)c1cc(Cl)ccc1O ZINC000185771798 262069667 /nfs/dbraw/zinc/06/96/67/262069667.db2.gz AASAGWINFRAWIS-NYDIPFLSSA-N 1 0 295.810 3.654 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCC[C@H]2OCC[C@@H]21)c1cc(Cl)ccc1O ZINC000185771819 262069732 /nfs/dbraw/zinc/06/97/32/262069732.db2.gz AASAGWINFRAWIS-UUFMSHNVSA-N 1 0 295.810 3.654 20 10 CHCDRO COC[C@H]([NH2+][C@@H](C)c1cc(C)ccc1O)c1ccccc1 ZINC000186034361 262076247 /nfs/dbraw/zinc/07/62/47/262076247.db2.gz SMMQCZZMVQXTAN-YOEHRIQHSA-N 1 0 285.387 3.739 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCOC3(CCCC3)C2)c(O)c1 ZINC000186129741 262080708 /nfs/dbraw/zinc/08/07/08/262080708.db2.gz YJIVNXFTHZRFDI-CABCVRRESA-N 1 0 289.419 3.843 20 10 CHCDRO C[C@H]([NH2+]CCCc1ccccn1)c1cc(Cl)ccc1O ZINC000186140568 262081076 /nfs/dbraw/zinc/08/10/76/262081076.db2.gz HSEPBPUFEPTIFA-LBPRGKRZSA-N 1 0 290.794 3.724 20 10 CHCDRO Cc1noc(C)c1[C@H](C)C[NH2+][C@H](C)c1ccc(C)cc1O ZINC000186158007 262082648 /nfs/dbraw/zinc/08/26/48/262082648.db2.gz PESAFQVXBDRGKM-VXGBXAGGSA-N 1 0 288.391 3.760 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)[C@@H](c1ccccc1)N(C)C)c1ccccc1O ZINC000186319881 262088533 /nfs/dbraw/zinc/08/85/33/262088533.db2.gz AKYNZHLOOOEVAO-DOXZYTNZSA-N 1 0 298.430 3.734 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1O)[C@@H](c1ccccc1)N(C)C ZINC000186319922 262088957 /nfs/dbraw/zinc/08/89/57/262088957.db2.gz AKYNZHLOOOEVAO-KHYOSLBOSA-N 1 0 298.430 3.734 20 10 CHCDRO CCc1cnc(C[NH2+][C@H](C)c2cc(C)ccc2O)s1 ZINC000185584175 262306029 /nfs/dbraw/zinc/30/60/29/262306029.db2.gz GUSNJNFJWSFNHA-LLVKDONJSA-N 1 0 276.405 3.570 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](C)c2nccs2)c(O)c1 ZINC000186743639 262322941 /nfs/dbraw/zinc/32/29/41/262322941.db2.gz ASYWDNLUZGAPPW-VXGBXAGGSA-N 1 0 276.405 3.611 20 10 CHCDRO C[C@H]([NH2+]CCc1cccc(F)c1F)c1ccccc1O ZINC000272837247 263009276 /nfs/dbraw/zinc/00/92/76/263009276.db2.gz IWDQFDOWJSKGJD-NSHDSACASA-N 1 0 277.314 3.564 20 10 CHCDRO Oc1ccccc1C[N@H+](CCCCCF)C[C@@H]1CCCO1 ZINC000284050825 263085590 /nfs/dbraw/zinc/08/55/90/263085590.db2.gz JPNZILVBUKICCR-INIZCTEOSA-N 1 0 295.398 3.513 20 10 CHCDRO CCc1ccc([C@@H](COC)[NH2+][C@H](C)c2ccccc2O)o1 ZINC000183530164 327820274 /nfs/dbraw/zinc/82/02/74/327820274.db2.gz FCNMNCRQAMFMOX-IUODEOHRSA-N 1 0 289.375 3.586 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H](C)Cc2ccc(O)cc2)c(O)c1 ZINC000185351815 327838237 /nfs/dbraw/zinc/83/82/37/327838237.db2.gz PHGRNITXQXJBFA-KGLIPLIRSA-N 1 0 285.387 3.688 20 10 CHCDRO COCCC1(C[NH2+][C@H](C)c2cc(C)ccc2O)CCC1 ZINC000185752575 327844271 /nfs/dbraw/zinc/84/42/71/327844271.db2.gz PXASRQCCVLOCMX-CQSZACIVSA-N 1 0 277.408 3.558 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]Cc2sccc2C)c1O ZINC000228672604 329058906 /nfs/dbraw/zinc/05/89/06/329058906.db2.gz YXEOIZJMNMAPRV-UHFFFAOYSA-N 1 0 297.807 3.714 20 10 CHCDRO Cc1ccc(O)c(C[NH2+]C[C@H]2CC[C@H](c3ccccc3)O2)c1 ZINC000377403528 329014387 /nfs/dbraw/zinc/01/43/87/329014387.db2.gz XBIFOOXTUOLQGX-IEBWSBKVSA-N 1 0 297.398 3.711 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CC[C@@H](c2ccccc2)O1)c1ccccc1O ZINC000377796156 329029861 /nfs/dbraw/zinc/02/98/61/329029861.db2.gz LQAOJSDYFQZANJ-OGWOLHLISA-N 1 0 297.398 3.963 20 10 CHCDRO COc1cccc2c1OCC[C@@H]2[NH2+][C@H](C)c1ccccc1O ZINC000378630014 329057122 /nfs/dbraw/zinc/05/71/22/329057122.db2.gz GDCKPYDHAMOMDM-DOMZBBRYSA-N 1 0 299.370 3.575 20 10 CHCDRO Cc1cccc(C[NH2+][C@@H]2CCOc3c(C)cccc32)c1O ZINC000188011899 329363511 /nfs/dbraw/zinc/36/35/11/329363511.db2.gz PSHGJMPWUARCTI-MRXNPFEDSA-N 1 0 283.371 3.622 20 10 CHCDRO Oc1ccccc1C[NH2+][C@@H]1CCc2cc(F)c(Cl)cc21 ZINC000527858088 330289025 /nfs/dbraw/zinc/28/90/25/330289025.db2.gz ORACIJHKYPBFBL-OAHLLOKOSA-N 1 0 291.753 3.962 20 10 CHCDRO CC[C@H](c1ccc(C)cc1O)[NH+]1CCC(CCOC)CC1 ZINC000527937298 330293666 /nfs/dbraw/zinc/29/36/66/330293666.db2.gz SDILSGYPSOVFIZ-QGZVFWFLSA-N 1 0 291.435 3.900 20 10 CHCDRO C[C@@H]([NH2+]CC1CC=CC1)c1ccc(Br)cc1O ZINC000527951693 330294472 /nfs/dbraw/zinc/29/44/72/330294472.db2.gz ROGVNADGDGSTNU-SNVBAGLBSA-N 1 0 296.208 3.772 20 10 CHCDRO COCCC1CC[NH+]([C@@H](C)c2cc(Cl)ccc2O)CC1 ZINC000527930921 330297401 /nfs/dbraw/zinc/29/74/01/330297401.db2.gz ACLIKQIIXBGNRD-LBPRGKRZSA-N 1 0 297.826 3.855 20 10 CHCDRO CC(C)[C@@H](CCO)[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000230664221 333320078 /nfs/dbraw/zinc/32/00/78/333320078.db2.gz SVLDXMFOWJHGCX-CXAGYDPISA-N 1 0 287.403 3.603 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCO[C@H](C)C1)c1ccc2ccccc2c1O ZINC000273534648 334766843 /nfs/dbraw/zinc/76/68/43/334766843.db2.gz XECQLVUGNYPRIW-UMVBOHGHSA-N 1 0 285.387 3.764 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1C[C@@H](C)[C@H]1C ZINC000385713273 336154911 /nfs/dbraw/zinc/15/49/11/336154911.db2.gz VSDSWFYGIPVPCC-LALPHHSUSA-N 1 0 256.393 3.621 20 10 CHCDRO CC(C)(CCO)C[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000266318632 519221452 /nfs/dbraw/zinc/22/14/52/519221452.db2.gz RIWJPFNTUWOZKX-UHFFFAOYSA-N 1 0 299.414 3.557 20 10 CHCDRO CC(C)=CCC[NH2+][C@@H](C)c1ccc(N2CCOCC2)cc1 ZINC000276602674 519416148 /nfs/dbraw/zinc/41/61/48/519416148.db2.gz BLIQBUUKXSKOEB-INIZCTEOSA-N 1 0 288.435 3.530 20 10 CHCDRO CCOCc1cc(C[NH2+]C2(C(C)C)CC2)ccc1OC ZINC000293177177 520185148 /nfs/dbraw/zinc/18/51/48/520185148.db2.gz WMBILWFDWSULEU-UHFFFAOYSA-N 1 0 277.408 3.510 20 10 CHCDRO CC[NH+](CC)CCC[C@H](C)[NH2+][C@H](C)c1ccc(F)cc1[O-] ZINC000062744835 520637879 /nfs/dbraw/zinc/63/78/79/520637879.db2.gz OWVWYCONVYSTEM-UONOGXRCSA-N 1 0 296.430 3.692 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CCC[C@@H]2c2ccncc2)c1 ZINC000289694706 521142336 /nfs/dbraw/zinc/14/23/36/521142336.db2.gz FTOKPHXVXONZEV-QGZVFWFLSA-N 1 0 298.386 3.523 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CCC[C@H]2c2ccncc2)c1 ZINC000289694704 521144902 /nfs/dbraw/zinc/14/49/02/521144902.db2.gz FTOKPHXVXONZEV-KRWDZBQOSA-N 1 0 298.386 3.523 20 10 CHCDRO CCOc1cccc(C[NH2+]Cc2ccccc2CC)c1O ZINC000084200752 521367923 /nfs/dbraw/zinc/36/79/23/521367923.db2.gz WZAIVCRPFIEGFS-UHFFFAOYSA-N 1 0 285.387 3.643 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@@H]2CCCc3sccc32)cc1 ZINC000061325282 522212500 /nfs/dbraw/zinc/21/25/00/522212500.db2.gz WKBSFMUCRIYNQR-MRXNPFEDSA-N 1 0 286.444 3.981 20 10 CHCDRO CC[C@@H](CCO)C[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000094936314 522509797 /nfs/dbraw/zinc/50/97/97/522509797.db2.gz BAEKVJVUDXQGJY-KBPBESRZSA-N 1 0 287.403 3.605 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(C)nc1)c1ccc(C)cc1O ZINC000280138260 522644708 /nfs/dbraw/zinc/64/47/08/522644708.db2.gz PNEXOTLMVOHJOR-INIZCTEOSA-N 1 0 270.376 3.645 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(Cl)cn1)c1ccc(C)cc1O ZINC000279947656 522646896 /nfs/dbraw/zinc/64/68/96/522646896.db2.gz BNVWSZSYGXVISV-HNNXBMFYSA-N 1 0 290.794 3.990 20 10 CHCDRO CC[C@H]([NH2+]Cc1cccc(O)c1)c1ccc(C)cc1O ZINC000280092284 522656952 /nfs/dbraw/zinc/65/69/52/522656952.db2.gz MOGJZXKEMYQZOT-INIZCTEOSA-N 1 0 271.360 3.647 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)[C@H]1CCCCO1)c1ccc(C)cc1O ZINC000280276147 522695358 /nfs/dbraw/zinc/69/53/58/522695358.db2.gz YFHPSYOGWGQRQU-JLJPHGGASA-N 1 0 277.408 3.699 20 10 CHCDRO CC[C@H]([NH2+][C@@H](CO)c1ccccc1)c1ccc(N(C)C)cc1 ZINC000268977263 522704546 /nfs/dbraw/zinc/70/45/46/522704546.db2.gz BHVFMBYLWQAFMS-OALUTQOASA-N 1 0 298.430 3.527 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1cn(C)nc1C)c1ccc(C)cc1O ZINC000280270950 522741240 /nfs/dbraw/zinc/74/12/40/522741240.db2.gz XWYAPMVQVFOAPL-WBMJQRKESA-N 1 0 287.407 3.544 20 10 CHCDRO CC[C@@H]([NH2+]C1CCN(C(C)C)CC1)c1ccc(C)cc1O ZINC000280297689 522809342 /nfs/dbraw/zinc/80/93/42/522809342.db2.gz ZPISAYRVNIESCR-QGZVFWFLSA-N 1 0 290.451 3.614 20 10 CHCDRO CC[C@@H]([NH2+]CC1(CCOC)CCC1)c1ccc(C)cc1O ZINC000280186823 522820961 /nfs/dbraw/zinc/82/09/61/522820961.db2.gz RYKOQAHCZORFAE-MRXNPFEDSA-N 1 0 291.435 3.948 20 10 CHCDRO CC[C@@H]([NH2+]CCCCOC(C)C)c1ccccc1O ZINC000157957723 522827419 /nfs/dbraw/zinc/82/74/19/522827419.db2.gz DBKNCZAIXKNLFL-OAHLLOKOSA-N 1 0 265.397 3.638 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cn2ccccc2n1)c1ccc(C)cc1O ZINC000279971905 522890443 /nfs/dbraw/zinc/89/04/43/522890443.db2.gz CZBVYXVVGXAZRY-MRXNPFEDSA-N 1 0 295.386 3.589 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C(C)C)C(C)(C)O)c1ccc(C)cc1O ZINC000280161355 522906250 /nfs/dbraw/zinc/90/62/50/522906250.db2.gz QSJNJYGQZHNYGP-ZBFHGGJFSA-N 1 0 279.424 3.537 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)c1cn(C)nc1C)c1ccc(C)cc1O ZINC000280270944 522913733 /nfs/dbraw/zinc/91/37/33/522913733.db2.gz XWYAPMVQVFOAPL-BLLLJJGKSA-N 1 0 287.407 3.544 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)C1CCOCC1)c1ccc(C)cc1O ZINC000280282074 522932178 /nfs/dbraw/zinc/93/21/78/522932178.db2.gz YOJYHPGKPFGZJH-CZUORRHYSA-N 1 0 277.408 3.556 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1ccccn1)c1ccc(C)cc1O ZINC000280119785 522937554 /nfs/dbraw/zinc/93/75/54/522937554.db2.gz OGQHVEPLVUHBEE-UKRRQHHQSA-N 1 0 270.376 3.898 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CCCc2nccs2)c(O)c1 ZINC000294650282 524333241 /nfs/dbraw/zinc/33/32/41/524333241.db2.gz GRTSVGFWLQANFO-ZDUSSCGKSA-N 1 0 290.432 3.749 20 10 CHCDRO C[C@@H]([NH2+]CCCC(F)(F)F)c1ccc(N(C)C)cc1 ZINC000211108086 525432691 /nfs/dbraw/zinc/43/26/91/525432691.db2.gz VHUKWZGLTPXUNS-LLVKDONJSA-N 1 0 274.330 3.746 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cc(F)cc(F)c1 ZINC000094826286 525526710 /nfs/dbraw/zinc/52/67/10/525526710.db2.gz VNMJSNGUPPZAMI-GFCCVEGCSA-N 1 0 290.357 3.882 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)[C@H](O)c1ccccc1)c1ccc(N(C)C)cc1 ZINC000290197942 525527062 /nfs/dbraw/zinc/52/70/62/525527062.db2.gz GKXJMBPFWYRXPI-DOXZYTNZSA-N 1 0 298.430 3.525 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCOC2(CCC2)C1)c1ccc(N(C)C)cc1 ZINC000271565878 525621117 /nfs/dbraw/zinc/62/11/17/525621117.db2.gz XWUVBCYBIGFRPS-HOCLYGCPSA-N 1 0 288.435 3.505 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCc2ncccc2C)c(O)c1C ZINC000296514410 525729533 /nfs/dbraw/zinc/72/95/33/525729533.db2.gz PPZIRCARODJRRA-OAHLLOKOSA-N 1 0 284.403 3.606 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@H](O)c2ccccc2)c(O)c1C ZINC000290176766 525935621 /nfs/dbraw/zinc/93/56/21/525935621.db2.gz FCTKBWJZTWBLCW-DOXZYTNZSA-N 1 0 299.414 3.782 20 10 CHCDRO C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(N(C)C)cc2)C[C@H]1C ZINC000251611028 1125472505 /nfs/dbraw/zinc/47/25/05/1125472505.db2.gz CZWPGJGUZXFQSP-IIAWOOMASA-N 1 0 260.425 3.667 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC[C@@H](c3ccccc3)C2)c1 ZINC000133692311 1125484819 /nfs/dbraw/zinc/48/48/19/1125484819.db2.gz VDACMDCKHBIRGO-MRXNPFEDSA-N 1 0 267.372 3.690 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC2CCC(F)CC2)c(O)c1 ZINC000842928298 1118170099 /nfs/dbraw/zinc/17/00/99/1118170099.db2.gz JBDYRZAJMPYNOG-HSBZDZAISA-N 1 0 265.372 3.880 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CCC2(CSC)CC2)c1O ZINC000850507985 1123276964 /nfs/dbraw/zinc/27/69/64/1123276964.db2.gz QOHOKGQFGDNHQO-GFCCVEGCSA-N 1 0 295.448 3.585 20 10 CHCDRO CC[C@@H](C[NH2+][C@H](C)c1cc(OC)ccc1O)CC(F)F ZINC000851900113 1123387793 /nfs/dbraw/zinc/38/77/93/1123387793.db2.gz PIQBJLYXZYCOLF-GHMZBOCLSA-N 1 0 287.350 3.733 20 10 CHCDRO CCc1cccc(C[NH2+]CC[C@H]2CC2(Cl)Cl)c1O ZINC000857061823 1123583321 /nfs/dbraw/zinc/58/33/21/1123583321.db2.gz DQQGUQXPWBENED-LBPRGKRZSA-N 1 0 288.218 3.628 20 10 CHCDRO Oc1cccc(Br)c1C[N@@H+]1CCC2(CCC2)C1 ZINC000862245929 1123793926 /nfs/dbraw/zinc/79/39/26/1123793926.db2.gz BUNLUSWSJKGYKY-UHFFFAOYSA-N 1 0 296.208 3.531 20 10 CHCDRO C[C@@H]1C[NH+](Cc2c(O)cccc2Cl)C[C@@H](C)C1(F)F ZINC000862444308 1123811376 /nfs/dbraw/zinc/81/13/76/1123811376.db2.gz VEGBPWOMORMMNN-NXEZZACHSA-N 1 0 289.753 3.769 20 10 CHCDRO COCC(C)(C)CC[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000872105003 1124683619 /nfs/dbraw/zinc/68/36/19/1124683619.db2.gz XONAVMZLEMQINY-NSHDSACASA-N 1 0 285.815 3.759 20 10 CHCDRO C[C@@H]([NH2+]CCCSc1nccs1)C(C)(C)C ZINC000132279335 1125417082 /nfs/dbraw/zinc/41/70/82/1125417082.db2.gz JRTSVFRUZOOEKQ-SNVBAGLBSA-N 1 0 258.456 3.650 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]CCC2CC(F)(F)C2)c(O)c1 ZINC000834910321 1131730360 /nfs/dbraw/zinc/73/03/60/1131730360.db2.gz WJSUWDHQGYSIBR-LLVKDONJSA-N 1 0 269.335 3.787 20 10 CHCDRO C[C@H]([NH2+]CCC1CC(F)(F)C1)c1cc(F)ccc1O ZINC000834908974 1131730876 /nfs/dbraw/zinc/73/08/76/1131730876.db2.gz NVUDOIHXNDFIFA-VIFPVBQESA-N 1 0 273.298 3.617 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)C1CCC1)c1ccc(N(C)C)cc1 ZINC000773102064 1131946215 /nfs/dbraw/zinc/94/62/15/1131946215.db2.gz FLGJCKREUJYDOY-CXAGYDPISA-N 1 0 260.425 3.982 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCC[C@](C)(F)CC2)c(O)c1 ZINC001231842435 1132377488 /nfs/dbraw/zinc/37/74/88/1132377488.db2.gz LXMJKHPRTGZYBT-INIZCTEOSA-N 1 0 265.372 3.723 20 10 CHCDRO CCC[C@@H]1CCCC[N@@H+]1Cc1cc(Cl)c(O)cc1O ZINC001232268838 1132447125 /nfs/dbraw/zinc/44/71/25/1132447125.db2.gz TXBNHWANTZDGIE-GFCCVEGCSA-N 1 0 283.799 3.906 20 10 CHCDRO C[C@@H]1CC[C@H]([NH2+]Cc2ccc3c(c2)CCO3)C[C@H]1C ZINC000251897366 1125518901 /nfs/dbraw/zinc/51/89/01/1125518901.db2.gz SGSUOSCKQZCNRU-IOASZLSFSA-N 1 0 259.393 3.536 20 10 CHCDRO C[C@@H]1CC[C@@H]([NH2+]Cc2ccc3c(c2)CCO3)C[C@H]1C ZINC000251897367 1125519076 /nfs/dbraw/zinc/51/90/76/1125519076.db2.gz SGSUOSCKQZCNRU-XJKCOSOUSA-N 1 0 259.393 3.536 20 10 CHCDRO C[C@@H]1CC[C@@H]([NH2+]Cc2ccc3c(c2)CCCN3C)C[C@H]1C ZINC000251950492 1125527231 /nfs/dbraw/zinc/52/72/31/1125527231.db2.gz WTHPTFSTBZQOCU-IIDMSEBBSA-N 1 0 286.463 3.983 20 10 CHCDRO COc1c(Cl)cccc1C[NH2+]Cc1cc(C)ccc1O ZINC000897483879 1125538860 /nfs/dbraw/zinc/53/88/60/1125538860.db2.gz XDIOKULFAURCPI-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(N3CCCCC3)cc2)C1 ZINC000135166566 1125579748 /nfs/dbraw/zinc/57/97/48/1125579748.db2.gz GASYKDIUNRZAPU-NVXWUHKLSA-N 1 0 272.436 3.955 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H]2CC[C@H](C)C2)cc1 ZINC000135152332 1125579985 /nfs/dbraw/zinc/57/99/85/1125579985.db2.gz WTGAYCIZQXMNFF-HOCLYGCPSA-N 1 0 260.425 3.811 20 10 CHCDRO CCC[C@H](C[NH2+][C@H](C)c1ccc(Cl)cc1O)OC ZINC000841758089 1125597533 /nfs/dbraw/zinc/59/75/33/1125597533.db2.gz RZMFTUYVUZGEIY-ZYHUDNBSSA-N 1 0 271.788 3.511 20 10 CHCDRO CCO[C@@H]1C[C@@H]([NH2+]Cc2ccccc2O)C12CCCCC2 ZINC000135805542 1125600304 /nfs/dbraw/zinc/60/03/04/1125600304.db2.gz MJSANSGXYCEOTD-IAGOWNOFSA-N 1 0 289.419 3.610 20 10 CHCDRO CCO[C@H]1C[C@@H]([NH2+]Cc2ccccc2O)C12CCCCC2 ZINC000135805576 1125601043 /nfs/dbraw/zinc/60/10/43/1125601043.db2.gz MJSANSGXYCEOTD-SJORKVTESA-N 1 0 289.419 3.610 20 10 CHCDRO CC(C)Cc1ncc(C[N@H+](C)Cc2ccccc2O)s1 ZINC000091974758 1125756360 /nfs/dbraw/zinc/75/63/60/1125756360.db2.gz YFZBAQIDCSZJBS-UHFFFAOYSA-N 1 0 290.432 3.679 20 10 CHCDRO C[N@@H+](Cc1ccc(N2CCCC2)cc1)CC1CCC1 ZINC001202740127 1125781650 /nfs/dbraw/zinc/78/16/50/1125781650.db2.gz SPHMPBVCAJJFQJ-UHFFFAOYSA-N 1 0 258.409 3.519 20 10 CHCDRO CC[C@H]([NH2+]Cc1cccc(C)c1O)c1ccc(OC)cc1 ZINC000158067032 1126745479 /nfs/dbraw/zinc/74/54/79/1126745479.db2.gz UYOADIHXTYVTQW-KRWDZBQOSA-N 1 0 285.387 3.950 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](c2ccccn2)C2CC2)c1 ZINC000903334462 1126801455 /nfs/dbraw/zinc/80/14/55/1126801455.db2.gz AEWHNEGFDZSWAR-KPZWWZAWSA-N 1 0 298.386 3.598 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N(C)C)c(F)c1)c1ccsc1 ZINC000178188130 1126810028 /nfs/dbraw/zinc/81/00/28/1126810028.db2.gz GRAJQDNTKZTBMP-NSHDSACASA-N 1 0 278.396 3.804 20 10 CHCDRO Oc1ccccc1C[N@@H+]1CCC[C@@H]1c1cccs1 ZINC000179553503 1126829317 /nfs/dbraw/zinc/82/93/17/1126829317.db2.gz ZDPAQWOQQCQYLZ-CYBMUJFWSA-N 1 0 259.374 3.791 20 10 CHCDRO COc1ccc([C@H](C)[N@H+](C)Cc2ccccc2O)cc1 ZINC000179555690 1126829801 /nfs/dbraw/zinc/82/98/01/1126829801.db2.gz JLJUHTMMBGRRIW-ZDUSSCGKSA-N 1 0 271.360 3.594 20 10 CHCDRO Cc1cccc(C[N@@H+](C)[C@H](C)c2cccs2)c1O ZINC000179713899 1126832831 /nfs/dbraw/zinc/83/28/31/1126832831.db2.gz LQIBHOVVIBBJKQ-GFCCVEGCSA-N 1 0 261.390 3.955 20 10 CHCDRO Cc1cccc(C[N@H+](CCC(F)(F)F)CC2CC2)c1O ZINC000180703249 1126847458 /nfs/dbraw/zinc/84/74/58/1126847458.db2.gz VGCNRLDZEHAEKY-UHFFFAOYSA-N 1 0 287.325 3.865 20 10 CHCDRO Cc1cccc(CNc2ccc(C(C)(C)[NH3+])cc2)c1O ZINC000904470762 1126853140 /nfs/dbraw/zinc/85/31/40/1126853140.db2.gz POQDRVZGGPHRKT-UHFFFAOYSA-N 1 0 270.376 3.507 20 10 CHCDRO CC(C)c1csc(C[NH2+][C@H](C)c2ccccc2O)n1 ZINC000183567486 1126888872 /nfs/dbraw/zinc/88/88/72/1126888872.db2.gz RXBBBAOHURNVMO-LLVKDONJSA-N 1 0 276.405 3.823 20 10 CHCDRO C[C@@H](C[C@@H](O)c1cccs1)[NH2+][C@@H](C)c1ccccc1O ZINC000183587996 1126889639 /nfs/dbraw/zinc/88/96/39/1126889639.db2.gz AVXPUUSSKMEEBU-SLEUVZQESA-N 1 0 291.416 3.617 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCOc2ccc(F)cc21)c1ccccc1O ZINC000183599258 1126889953 /nfs/dbraw/zinc/88/99/53/1126889953.db2.gz LBRLDGFOJGJWAR-ABAIWWIYSA-N 1 0 287.334 3.706 20 10 CHCDRO Cc1ccc(C[NH+](C)C)cc1N[C@H](C)c1ccccc1O ZINC000183702687 1126890498 /nfs/dbraw/zinc/89/04/98/1126890498.db2.gz MKLYCYGBCXPMLF-CQSZACIVSA-N 1 0 284.403 3.935 20 10 CHCDRO CC[C@H]([NH2+]C[C@@](C)(OC)C1CC1)c1cc(Cl)ccc1O ZINC000812735273 1130710110 /nfs/dbraw/zinc/71/01/10/1130710110.db2.gz ZFVPAQLPJGDAQP-GOEBONIOSA-N 1 0 297.826 3.901 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)c1cc(OC)ccc1O)c1ccncc1 ZINC000185541195 1126900694 /nfs/dbraw/zinc/90/06/94/1126900694.db2.gz FAMWYAVPJXPNRK-MLGOLLRUSA-N 1 0 286.375 3.598 20 10 CHCDRO CCOC1CC(CC[NH2+][C@@H](C)c2cc(C)ccc2O)C1 ZINC000189259666 1126929819 /nfs/dbraw/zinc/92/98/19/1126929819.db2.gz CJSIPGPUGBPIMV-NFOMZHRRSA-N 1 0 277.408 3.556 20 10 CHCDRO CCO[C@@H](C[NH2+][C@H](C)c1ccccc1O)c1ccccc1 ZINC000193434404 1126969111 /nfs/dbraw/zinc/96/91/11/1126969111.db2.gz NEJCPWXKBJRSHE-KDOFPFPSSA-N 1 0 285.387 3.821 20 10 CHCDRO CSC[C@@H]1CCC[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC000814178882 1130834888 /nfs/dbraw/zinc/83/48/88/1130834888.db2.gz HJSVNAUOPBITJK-LLVKDONJSA-N 1 0 285.840 3.621 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@H](C)c1ccccn1 ZINC000194980738 1126977531 /nfs/dbraw/zinc/97/75/31/1126977531.db2.gz UQLDQBXZSKRXMZ-CQSZACIVSA-N 1 0 269.392 3.518 20 10 CHCDRO CC(=O)c1cc(F)cc(C[NH2+]C2(c3ccccc3)CC2)c1O ZINC000267454019 1127000752 /nfs/dbraw/zinc/00/07/52/1127000752.db2.gz OIIYMVPTPNXUQM-UHFFFAOYSA-N 1 0 299.345 3.513 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccccc1N(C)C)c1ccc(N(C)C)cc1 ZINC000271555443 1127092363 /nfs/dbraw/zinc/09/23/63/1127092363.db2.gz WPURALJRQRZSDY-OAHLLOKOSA-N 1 0 297.446 3.669 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)CSC)c1ccc(N(C)C)cc1 ZINC000151002686 1127117461 /nfs/dbraw/zinc/11/74/61/1127117461.db2.gz FEZHVYWQFLTJBU-IUODEOHRSA-N 1 0 266.454 3.545 20 10 CHCDRO CCCC[N@H+](C)Cc1c(O)ccc2ccc(OC)cc21 ZINC000913064192 1127120719 /nfs/dbraw/zinc/12/07/19/1127120719.db2.gz GQCZUQDYTJIVTN-UHFFFAOYSA-N 1 0 273.376 3.786 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CCC(C)(C)C1)c1ccc(N(C)C)cc1 ZINC000163632973 1127126617 /nfs/dbraw/zinc/12/66/17/1127126617.db2.gz HSJCDVAXXVIWIX-UKRRQHHQSA-N 1 0 260.425 3.982 20 10 CHCDRO C[C@]1(F)CCC[N@H+](Cc2c(O)ccc(F)c2Cl)CC1 ZINC001237121161 1131056087 /nfs/dbraw/zinc/05/60/87/1131056087.db2.gz KLIURFUTRFTBBC-AWEZNQCLSA-N 1 0 289.753 3.899 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CC[C@H](C(C)(C)C)C2)c1O ZINC000163860846 1127145367 /nfs/dbraw/zinc/14/53/67/1127145367.db2.gz DHPONHLPQVYZJZ-AWEZNQCLSA-N 1 0 277.408 3.659 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CCc2ccc(O)cc2)c(O)c1 ZINC000285192482 1127219063 /nfs/dbraw/zinc/21/90/63/1127219063.db2.gz NSNAVKSHTFWSHG-CQSZACIVSA-N 1 0 285.387 3.608 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CC=CCC1)c1ccc(N(C)C)cc1 ZINC000045629131 1127260800 /nfs/dbraw/zinc/26/08/00/1127260800.db2.gz SUFXUJIXKODHGF-CABCVRRESA-N 1 0 258.409 3.760 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1CCCSC1)c1cc(Cl)ccc1O ZINC000287045588 1127284307 /nfs/dbraw/zinc/28/43/07/1127284307.db2.gz MOIVBBDHGDMGQQ-MNOVXSKESA-N 1 0 285.840 3.839 20 10 CHCDRO C[N@H+](CCCCC(F)(F)F)Cc1ccccc1O ZINC000157252322 1127293564 /nfs/dbraw/zinc/29/35/64/1127293564.db2.gz VKHKWDSTTJFWRY-UHFFFAOYSA-N 1 0 261.287 3.557 20 10 CHCDRO COCCC(C)(C)C[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000760894217 1127319499 /nfs/dbraw/zinc/31/94/99/1127319499.db2.gz KCVBADBSHFOUQG-DGCLKSJQSA-N 1 0 295.398 3.732 20 10 CHCDRO CC[C@H](CC(F)(F)F)[NH2+][C@H](C)c1ccccc1O ZINC000760903763 1127325571 /nfs/dbraw/zinc/32/55/71/1127325571.db2.gz YRGTXWGIIAEOBV-NXEZZACHSA-N 1 0 261.287 3.774 20 10 CHCDRO Clc1ccc(CC[NH2+]Cc2ccc3c(c2)CCO3)s1 ZINC000226181517 1127380651 /nfs/dbraw/zinc/38/06/51/1127380651.db2.gz CTUGLQKNRQGOAS-UHFFFAOYSA-N 1 0 293.819 3.669 20 10 CHCDRO CCCC[C@@H](CCC)[NH2+]Cc1cc2c(cc1O)OCO2 ZINC000226269752 1127389306 /nfs/dbraw/zinc/38/93/06/1127389306.db2.gz NKUOUCYPBOAJTH-CYBMUJFWSA-N 1 0 279.380 3.569 20 10 CHCDRO CCC1(CC)CC[N@H+](Cc2cc(F)ccc2O)C1 ZINC000226565084 1127410943 /nfs/dbraw/zinc/41/09/43/1127410943.db2.gz UDZBMLQIDGRIAI-UHFFFAOYSA-N 1 0 251.345 3.543 20 10 CHCDRO C[C@@H](CC[NH2+]Cc1cc(F)ccc1O)c1ccccc1 ZINC000226589515 1127412198 /nfs/dbraw/zinc/41/21/98/1127412198.db2.gz CDLXQCDKXMUMAR-ZDUSSCGKSA-N 1 0 273.351 3.815 20 10 CHCDRO CCN(C)c1ccc(C[N@H+](C)C[C@@H]2CC=CCC2)cc1 ZINC001168405349 1127427858 /nfs/dbraw/zinc/42/78/58/1127427858.db2.gz XJTRPQLFRSDJBL-MRXNPFEDSA-N 1 0 272.436 3.931 20 10 CHCDRO Cc1cccc(C[NH2+]CC[C@H](C)c2ccccc2)c1O ZINC000158125344 1127451764 /nfs/dbraw/zinc/45/17/64/1127451764.db2.gz RFVFVBBVXJOALL-AWEZNQCLSA-N 1 0 269.388 3.984 20 10 CHCDRO CCCCOCCC[NH2+][C@H](C)c1ccc(C)cc1O ZINC000168733370 1127464332 /nfs/dbraw/zinc/46/43/32/1127464332.db2.gz DSCJKVDMJGSRAQ-CQSZACIVSA-N 1 0 265.397 3.558 20 10 CHCDRO COc1cc(C[N@@H+]2C[C@@H](C)[C@H]2C)c(O)c(C(C)(C)C)c1 ZINC001308790387 1127477653 /nfs/dbraw/zinc/47/76/53/1127477653.db2.gz RRDXICHIXGHUPY-VXGBXAGGSA-N 1 0 277.408 3.539 20 10 CHCDRO C[N@H+](Cc1cc(Cl)ccc1O)C1CCCCC1 ZINC000060201713 1127508031 /nfs/dbraw/zinc/50/80/31/1127508031.db2.gz MMDFOWQVGSYRTD-UHFFFAOYSA-N 1 0 253.773 3.810 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CC2(SC)CCC2)cc1 ZINC000227946609 1127516557 /nfs/dbraw/zinc/51/65/57/1127516557.db2.gz PDXXUMPUIQJQGB-UHFFFAOYSA-N 1 0 292.492 3.908 20 10 CHCDRO CC[C@@H](CC(F)(F)F)[NH2+]Cc1cccc(C)c1O ZINC000761229924 1127553332 /nfs/dbraw/zinc/55/33/32/1127553332.db2.gz VRSJXTFNCBCRPE-NSHDSACASA-N 1 0 261.287 3.521 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+][C@@H]2CCC[C@H](C)C2)c1O ZINC000228670576 1127583000 /nfs/dbraw/zinc/58/30/00/1127583000.db2.gz LOAQSJXTHRIJCL-GXFFZTMASA-N 1 0 283.799 3.723 20 10 CHCDRO C[C@@H](CCO)CC[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000295200571 1127627050 /nfs/dbraw/zinc/62/70/50/1127627050.db2.gz YQIIWMLDRZIMDW-OAHLLOKOSA-N 1 0 299.414 3.557 20 10 CHCDRO C[N@H+](Cc1cc2c(cc1O)CCC2)C(C1CC1)C1CC1 ZINC000170727853 1127641515 /nfs/dbraw/zinc/64/15/15/1127641515.db2.gz XTBKXELBLJCSOJ-UHFFFAOYSA-N 1 0 271.404 3.501 20 10 CHCDRO CCOCc1ccc(C[NH2+][C@@H]2CCc3cccc(O)c32)cc1 ZINC000295814291 1127653547 /nfs/dbraw/zinc/65/35/47/1127653547.db2.gz CWQZTHJKNISWRV-QGZVFWFLSA-N 1 0 297.398 3.706 20 10 CHCDRO CCn1cc([C@@H](C)[NH2+][C@@H](C)c2ccc(C)c(C)c2O)cn1 ZINC000295990673 1127659870 /nfs/dbraw/zinc/65/98/70/1127659870.db2.gz PMRJKAIDOGCRMI-KGLIPLIRSA-N 1 0 287.407 3.637 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(N2CCCCC2)cc1)C1CC1 ZINC000323916412 1127661200 /nfs/dbraw/zinc/66/12/00/1127661200.db2.gz TXZFLUIVTUHZLB-GOSISDBHSA-N 1 0 272.436 3.955 20 10 CHCDRO CCOc1ccc(C[NH2+][C@H]2CCc3cccc(O)c32)cc1 ZINC000296039875 1127661206 /nfs/dbraw/zinc/66/12/06/1127661206.db2.gz QOQUPIQMOIZPRW-INIZCTEOSA-N 1 0 283.371 3.568 20 10 CHCDRO Cc1cccnc1CC[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000296244408 1127666362 /nfs/dbraw/zinc/66/63/62/1127666362.db2.gz CQVZCWIOIUHDCS-GFCCVEGCSA-N 1 0 290.794 3.642 20 10 CHCDRO Cc1cc(C)c(C[NH2+][C@H]2CCc3cc(F)ccc3C2)c(O)c1 ZINC001168415884 1127681233 /nfs/dbraw/zinc/68/12/33/1127681233.db2.gz SCRBAFJKZUMOJW-KRWDZBQOSA-N 1 0 299.389 3.795 20 10 CHCDRO CCOCCC1(C[NH2+][C@H]2CCc3cccc(O)c32)CCC1 ZINC000296906770 1127686003 /nfs/dbraw/zinc/68/60/03/1127686003.db2.gz PELHRYLLFQQSHC-HNNXBMFYSA-N 1 0 289.419 3.566 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCc2cccc(O)c21)c1ccccc1[N+](=O)[O-] ZINC000296920019 1127686059 /nfs/dbraw/zinc/68/60/59/1127686059.db2.gz PPSSNAVVXYVWCS-RISCZKNCSA-N 1 0 298.342 3.639 20 10 CHCDRO CCN(CC)c1ccc(CNC(=[NH2+])Nc2ccccc2)cc1 ZINC000171144679 1127690380 /nfs/dbraw/zinc/69/03/80/1127690380.db2.gz CXBQDRXGQTVBDC-UHFFFAOYSA-N 1 0 296.418 3.669 20 10 CHCDRO C[C@H]([NH2+]CC(C)(C)c1ccccn1)c1cc(F)ccc1O ZINC000297397455 1127695593 /nfs/dbraw/zinc/69/55/93/1127695593.db2.gz SGIOGEVEGWKLAQ-LBPRGKRZSA-N 1 0 288.366 3.555 20 10 CHCDRO Oc1cccc2c1[C@@H]([NH2+][C@H]1CCc3cc(F)ccc31)CC2 ZINC000297619723 1127701712 /nfs/dbraw/zinc/70/17/12/1127701712.db2.gz IWTMLCBPFSNJGZ-HOTGVXAUSA-N 1 0 283.346 3.796 20 10 CHCDRO C[C@H]([NH2+][C@@H](C)c1ccc2ccccc2c1O)c1cn[nH]c1 ZINC000230669586 1127771171 /nfs/dbraw/zinc/77/11/71/1127771171.db2.gz DCYVUZTYZJFNJR-RYUDHWBXSA-N 1 0 281.359 3.680 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]C[C@@H]2CCC[C@H]2C)c1O ZINC000230659106 1127771964 /nfs/dbraw/zinc/77/19/64/1127771964.db2.gz KPIBWMDBRLKETC-MNOVXSKESA-N 1 0 283.799 3.580 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CCC[C@H]2c2ccsc2)c1 ZINC000373223214 1127828900 /nfs/dbraw/zinc/82/89/00/1127828900.db2.gz HFDOXKRDGIHTHR-HNNXBMFYSA-N 1 0 289.400 3.799 20 10 CHCDRO C[C@H]1C[C@@H](CF)[N@H+](Cc2cccc(C(F)(F)F)c2[O-])C1 ZINC001233415846 1127959869 /nfs/dbraw/zinc/95/98/69/1127959869.db2.gz KIHUQGGIRSISCP-ONGXEEELSA-N 1 0 291.288 3.591 20 10 CHCDRO CC[C@@H]([NH2+]CCSCC(F)(F)F)c1ccccc1O ZINC000698952793 1128069668 /nfs/dbraw/zinc/06/96/68/1128069668.db2.gz LUAIRKKSKXXEEO-LLVKDONJSA-N 1 0 293.354 3.728 20 10 CHCDRO COCCC[NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1 ZINC000151681483 1128071764 /nfs/dbraw/zinc/07/17/64/1128071764.db2.gz ULGXNADLLNTDKD-INIZCTEOSA-N 1 0 290.451 3.754 20 10 CHCDRO C[C@@H]([NH2+]C1CCCC1)c1ccc(Br)cc1O ZINC000134903282 1128078814 /nfs/dbraw/zinc/07/88/14/1128078814.db2.gz LRTDMASPZVKLQG-SECBINFHSA-N 1 0 284.197 3.748 20 10 CHCDRO CCOc1cccc(C[NH2+]CC(C)(C)C(C)(C)C)c1O ZINC000312898240 1128096952 /nfs/dbraw/zinc/09/69/52/1128096952.db2.gz YABFJPBPQCLXFP-UHFFFAOYSA-N 1 0 279.424 3.953 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)c1cc2ccccc2[nH]1 ZINC000924899455 1128115935 /nfs/dbraw/zinc/11/59/35/1128115935.db2.gz FXTQYUWRBOVJTC-ZDUSSCGKSA-N 1 0 292.382 3.954 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)Cc1cccc(F)c1)c1ccccc1O ZINC001168459213 1128142204 /nfs/dbraw/zinc/14/22/04/1128142204.db2.gz KUPXSGFSYWBVGU-QWHCGFSZSA-N 1 0 273.351 3.813 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)C[C@@H](C)O2)c1ccccc1O ZINC000926922537 1128203174 /nfs/dbraw/zinc/20/31/74/1128203174.db2.gz ZTMDGEGCEZGORM-CXAGYDPISA-N 1 0 297.398 3.957 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCCc3cccnc32)c1 ZINC000927063261 1128213314 /nfs/dbraw/zinc/21/33/14/1128213314.db2.gz BHNSGIAKJTWARP-WBMJQRKESA-N 1 0 298.386 3.524 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCCc3cccnc32)c1 ZINC000927063245 1128213567 /nfs/dbraw/zinc/21/35/67/1128213567.db2.gz ASPFPMVBLCABBQ-CJNGLKHVSA-N 1 0 282.387 3.824 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCCc3cccnc32)c(O)c1 ZINC000927061483 1128213668 /nfs/dbraw/zinc/21/36/68/1128213668.db2.gz PQLPBKYHQOSFQS-CZUORRHYSA-N 1 0 282.387 3.824 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2cccc3c2OCC3)c(O)c1C ZINC000927090484 1128216781 /nfs/dbraw/zinc/21/67/81/1128216781.db2.gz MLKGEPPPEPFNEY-CQSZACIVSA-N 1 0 297.398 3.795 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CC(C)(C)OC1(C)C)c1cc(F)ccc1O ZINC000927099676 1128217628 /nfs/dbraw/zinc/21/76/28/1128217628.db2.gz DDOQSRDEQDSCCL-NWDGAFQWSA-N 1 0 295.398 3.776 20 10 CHCDRO CC[C@H](c1cccc(OC)c1)[N@H+](C)Cc1ccccc1O ZINC000777824987 1128288494 /nfs/dbraw/zinc/28/84/94/1128288494.db2.gz MPCLTEFAULIFBH-QGZVFWFLSA-N 1 0 285.387 3.984 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]C2Cc3ccccc3C2)cc1 ZINC000762777605 1128316802 /nfs/dbraw/zinc/31/68/02/1128316802.db2.gz GZGORINUFWBCRD-OAHLLOKOSA-N 1 0 294.442 3.961 20 10 CHCDRO CC1([NH2+]Cc2ccc(Br)cc2O)CCCC1 ZINC000691427615 1128387315 /nfs/dbraw/zinc/38/73/15/1128387315.db2.gz OTHXCKUQSUINKD-UHFFFAOYSA-N 1 0 284.197 3.577 20 10 CHCDRO CCC[C@@H](C)CC[C@@H](C)[NH2+]CCc1ccc(O)c(O)c1 ZINC001257466694 1128454073 /nfs/dbraw/zinc/45/40/73/1128454073.db2.gz FEVAIQICHYQQEU-ZIAGYGMSSA-N 1 0 279.424 3.835 20 10 CHCDRO CCN(C)c1ccc(C[NH2+][C@@H](c2ccncc2)C2CC2)cc1 ZINC000934698832 1128467243 /nfs/dbraw/zinc/46/72/43/1128467243.db2.gz PTGVMXBFJXEVMP-LJQANCHMSA-N 1 0 295.430 3.779 20 10 CHCDRO Cc1ccc(O)c(C[N@H+]2C[C@@H](C(F)(F)F)CC[C@H]2C)c1 ZINC000780793938 1128476434 /nfs/dbraw/zinc/47/64/34/1128476434.db2.gz YXIMDSQOQOJZMW-YPMHNXCESA-N 1 0 287.325 3.863 20 10 CHCDRO Cc1ccc(SCC[NH2+]Cc2ccc3c(c2)CCO3)cc1 ZINC000917392842 1128497048 /nfs/dbraw/zinc/49/70/48/1128497048.db2.gz QBTIVFFWTOSXBO-UHFFFAOYSA-N 1 0 299.439 3.812 20 10 CHCDRO CCCC(O)(CCC)C[NH2+][C@H](CC)c1ccccc1O ZINC000155923273 1128619062 /nfs/dbraw/zinc/61/90/62/1128619062.db2.gz FAQMOUOZAOWWAS-OAHLLOKOSA-N 1 0 279.424 3.764 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](C)COc2cccc(C)c2)cc1C ZINC000920180103 1128669482 /nfs/dbraw/zinc/66/94/82/1128669482.db2.gz JQDQGSXLZOROND-INIZCTEOSA-N 1 0 299.414 3.869 20 10 CHCDRO C[N@H+](Cc1cccc(Cl)c1)Cc1cc(F)ccc1O ZINC000778995839 1128675263 /nfs/dbraw/zinc/67/52/63/1128675263.db2.gz TTZUTNKYYNAJIH-UHFFFAOYSA-N 1 0 279.742 3.817 20 10 CHCDRO COc1ccc(C[NH2+]C[C@@H]2CCO[C@@H](C(C)C)C2)cc1C ZINC000779063918 1128716441 /nfs/dbraw/zinc/71/64/41/1128716441.db2.gz CTOJHLWECDCXCX-SJLPKXTDSA-N 1 0 291.435 3.544 20 10 CHCDRO CCC[N@@H+](Cc1ccccc1O)C[C@@H](O)c1ccccc1C ZINC000160160437 1117747109 /nfs/dbraw/zinc/74/71/09/1117747109.db2.gz OZZQUVVRVFTPPS-LJQANCHMSA-N 1 0 299.414 3.646 20 10 CHCDRO C[C@@H](Cc1ccccc1)C[N@H+](C)Cc1ccccc1O ZINC000753958312 1117898514 /nfs/dbraw/zinc/89/85/14/1117898514.db2.gz BPPMJVZEFSTUAW-HNNXBMFYSA-N 1 0 269.388 3.703 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)Cc2cccs2)c1 ZINC000036992892 1117956470 /nfs/dbraw/zinc/95/64/70/1117956470.db2.gz REXXBAJHFPVKSL-RYUDHWBXSA-N 1 0 291.416 3.744 20 10 CHCDRO C[C@H]1c2ccccc2CC[N@H+]1Cc1ccccc1O ZINC000179581754 1128748720 /nfs/dbraw/zinc/74/87/20/1128748720.db2.gz JSVGXGLRVLKIJL-ZDUSSCGKSA-N 1 0 253.345 3.512 20 10 CHCDRO Cc1cc(Cl)cc(C[NH2+][C@@H]2CC(C)(C)OC2(C)C)c1O ZINC000779151376 1128752965 /nfs/dbraw/zinc/75/29/65/1128752965.db2.gz XNAAGNDQUNLYDI-CYBMUJFWSA-N 1 0 297.826 3.790 20 10 CHCDRO C[C@H]1CC[C@H](C)[N@H+](Cc2cc(Cl)ccc2O)C1 ZINC000211564696 1118074231 /nfs/dbraw/zinc/07/42/31/1118074231.db2.gz DIVBQGAHOYJBMM-QWRGUYRKSA-N 1 0 253.773 3.666 20 10 CHCDRO COc1cccc(C[NH2+][C@@H](C)[C@H]2CC3CCC2CC3)c1O ZINC000382126141 1118096917 /nfs/dbraw/zinc/09/69/17/1118096917.db2.gz MFADNZJWMDQRGP-WLIAPVHPSA-N 1 0 289.419 3.705 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)c(C)c1)[C@H](C)C(C)C ZINC001167241051 1118115179 /nfs/dbraw/zinc/11/51/79/1118115179.db2.gz OQZMSTRJLBEVPT-OAHLLOKOSA-N 1 0 262.441 3.927 20 10 CHCDRO CC[C@H](C)[C@H](C)[NH2+]Cc1ccc(N2CCSCC2)cc1 ZINC000765080167 1118134191 /nfs/dbraw/zinc/13/41/91/1118134191.db2.gz LMGXPORZTGLHCT-GJZGRUSLSA-N 1 0 292.492 3.764 20 10 CHCDRO COc1ccc([C@@H](C)C[N@H+](C)Cc2ccccc2O)cc1 ZINC000179770459 1128758246 /nfs/dbraw/zinc/75/82/46/1128758246.db2.gz HWDBFWQDGIXADM-AWEZNQCLSA-N 1 0 285.387 3.636 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H]1CCc2c1cccc2O ZINC000765387875 1118148264 /nfs/dbraw/zinc/14/82/64/1118148264.db2.gz FTWFTBRFTUHUGE-GOSISDBHSA-N 1 0 296.414 3.544 20 10 CHCDRO Cc1cc(C[NH2+]Cc2ccncc2)c(C)n1-c1ccccc1 ZINC000387073049 1118190103 /nfs/dbraw/zinc/19/01/03/1118190103.db2.gz QZRKGIAQHPEDOA-UHFFFAOYSA-N 1 0 291.398 3.779 20 10 CHCDRO CC(C)CSCCC[NH2+][C@@H](C)c1ccccc1O ZINC000179901964 1128765382 /nfs/dbraw/zinc/76/53/82/1128765382.db2.gz HZCSUKUWWNRCDX-ZDUSSCGKSA-N 1 0 267.438 3.822 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]CC(C)(C)C(C)C)c1 ZINC000188714143 1128764088 /nfs/dbraw/zinc/76/40/88/1128764088.db2.gz KWKJFTAEOVCDRW-GFCCVEGCSA-N 1 0 265.397 3.734 20 10 CHCDRO CCC[C@@H](C)[NH2+]Cc1ccc(OC)c(COCC)c1 ZINC001648824827 1118234951 /nfs/dbraw/zinc/23/49/51/1118234951.db2.gz QDSSJDLNJQOROG-CYBMUJFWSA-N 1 0 265.397 3.510 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccccc1Cl)c1ccccc1O ZINC000179891330 1128764318 /nfs/dbraw/zinc/76/43/18/1128764318.db2.gz LYIWYJVSERZDHE-GFCCVEGCSA-N 1 0 275.779 3.939 20 10 CHCDRO C[C@H]([NH2+]CCO[C@@H]1CCCC[C@@H]1C)c1ccccc1O ZINC000179899080 1128764929 /nfs/dbraw/zinc/76/49/29/1128764929.db2.gz NOAFLZSUMYVRFM-GRDNDAEWSA-N 1 0 277.408 3.638 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2Cc3cccc(F)c3C2)c1O ZINC001140182504 1118250387 /nfs/dbraw/zinc/25/03/87/1118250387.db2.gz STSZRJMISIPJCW-UHFFFAOYSA-N 1 0 271.335 3.664 20 10 CHCDRO COc1cnccc1[C@@H](C)[NH2+][C@H](C)c1ccc(N(C)C)cc1 ZINC000188784457 1128765505 /nfs/dbraw/zinc/76/55/05/1128765505.db2.gz FZOPBZKCVNAPFZ-ZIAGYGMSSA-N 1 0 299.418 3.568 20 10 CHCDRO C[N@H+](Cc1cc(F)ccc1O)[C@@H]1CCc2ccccc21 ZINC000179905777 1128765888 /nfs/dbraw/zinc/76/58/88/1128765888.db2.gz DTJXNQPEYWITBK-MRXNPFEDSA-N 1 0 271.335 3.651 20 10 CHCDRO CCCCCC[C@@H](C)[NH2+]Cc1ccc(O)cc1O ZINC000037138834 1118271262 /nfs/dbraw/zinc/27/12/62/1118271262.db2.gz OPAQJMIUHPUHRE-GFCCVEGCSA-N 1 0 251.370 3.546 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]Cc2cccc(OC)c2)cc1 ZINC000072670090 1118280553 /nfs/dbraw/zinc/28/05/53/1118280553.db2.gz LIPZOTWFVMKLPV-UHFFFAOYSA-N 1 0 298.430 3.831 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCOc2ccccc21)c1ccccc1O ZINC000186184018 1118287574 /nfs/dbraw/zinc/28/75/74/1118287574.db2.gz KNHPEAHHUPSMFG-YOEHRIQHSA-N 1 0 297.398 3.999 20 10 CHCDRO c1csc(SCCC[NH2+][C@@H]2CCC23CCCC3)n1 ZINC000189128616 1128767725 /nfs/dbraw/zinc/76/77/25/1128767725.db2.gz DTTGXPMMPUWHMO-GFCCVEGCSA-N 1 0 282.478 3.938 20 10 CHCDRO Cc1ccccc1CC[NH2+]Cc1c(O)cccc1Cl ZINC000083551446 1118356383 /nfs/dbraw/zinc/35/63/83/1118356383.db2.gz FEQUXPFZBOHWOP-UHFFFAOYSA-N 1 0 275.779 3.686 20 10 CHCDRO CC(C)(C[NH2+]Cc1ccc2c(c1)CCO2)c1cccs1 ZINC000083601882 1118357654 /nfs/dbraw/zinc/35/76/54/1118357654.db2.gz BICZVSSVYFPTHW-UHFFFAOYSA-N 1 0 287.428 3.750 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CCc3ccccc3[C@H]2C)c1 ZINC000180076162 1128773963 /nfs/dbraw/zinc/77/39/63/1128773963.db2.gz LIYBTEGWUUCAAZ-CYBMUJFWSA-N 1 0 283.371 3.520 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CCc3ccccc3[C@@H]2C)c1 ZINC000180076175 1128774121 /nfs/dbraw/zinc/77/41/21/1128774121.db2.gz LIYBTEGWUUCAAZ-ZDUSSCGKSA-N 1 0 283.371 3.520 20 10 CHCDRO Cn1c[nH+]cc1Nc1ccc(CCc2ccc(N)cc2)cc1 ZINC001211250207 1118487290 /nfs/dbraw/zinc/48/72/90/1118487290.db2.gz IQXWSPYAANBQML-UHFFFAOYSA-N 1 0 292.386 3.531 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]CC1CCC(F)(F)CC1 ZINC000693360874 1118561532 /nfs/dbraw/zinc/56/15/32/1118561532.db2.gz CNYNLCSWHPNOKQ-UHFFFAOYSA-N 1 0 289.753 3.961 20 10 CHCDRO CSCCCCC[NH2+][C@H]1CCc2cccc(O)c21 ZINC000296490580 1118587251 /nfs/dbraw/zinc/58/72/51/1118587251.db2.gz POELFVOAYMAXII-ZDUSSCGKSA-N 1 0 265.422 3.502 20 10 CHCDRO CC[C@@H]1CCCCC[N@@H+]1Cc1cc(OC)c(OC)cc1O ZINC000180330589 1128787987 /nfs/dbraw/zinc/78/79/87/1128787987.db2.gz QOTAWQBBRRIBGD-CQSZACIVSA-N 1 0 293.407 3.564 20 10 CHCDRO Cc1ccc(OC[C@H](C)[NH2+][C@H](C)c2ccccc2O)cc1 ZINC000040499383 1118614201 /nfs/dbraw/zinc/61/42/01/1118614201.db2.gz OLIAQGPRKMBCML-LSDHHAIUSA-N 1 0 285.387 3.819 20 10 CHCDRO CCC(C)(C)C[NH2+]Cc1cc(Cl)cc(OC)c1O ZINC000189991349 1128790133 /nfs/dbraw/zinc/79/01/33/1128790133.db2.gz DLVKPHLXUGRWPO-UHFFFAOYSA-N 1 0 271.788 3.580 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2c(O)cccc2Br)[C@@H](C)C1 ZINC000707145796 1118648265 /nfs/dbraw/zinc/64/82/65/1118648265.db2.gz HJJZHDSLWDVUJY-MNOVXSKESA-N 1 0 298.224 3.775 20 10 CHCDRO CC[C@@H]([NH2+]CCCCOC(C)C)c1ccc(N(C)C)cc1 ZINC000180457486 1128792196 /nfs/dbraw/zinc/79/21/96/1128792196.db2.gz OUIJVQWLZJCCOT-GOSISDBHSA-N 1 0 292.467 3.999 20 10 CHCDRO Cc1cc(C[N@H+]2CCC[C@@H]2C)ccc1N1CCCCC1 ZINC001167487152 1118717425 /nfs/dbraw/zinc/71/74/25/1118717425.db2.gz GNHUZSKWQJHJOW-INIZCTEOSA-N 1 0 272.436 3.970 20 10 CHCDRO Oc1cc(Cl)ccc1CN1CCc2cc(F)ccc2C1 ZINC001140465628 1118743004 /nfs/dbraw/zinc/74/30/04/1118743004.db2.gz OQBZERLYBRTLNN-UHFFFAOYSA-N 1 0 291.753 3.743 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1ccc(C)cc1O)[C@@H]1CCCOC1 ZINC000723990760 1118797345 /nfs/dbraw/zinc/79/73/45/1118797345.db2.gz TYMHFOXNBRNMEA-FMKPAKJESA-N 1 0 277.408 3.556 20 10 CHCDRO C[C@@H](C[NH2+]Cc1cc(-c2ccccc2)ccc1O)C[C@H](C)O ZINC000077428692 1128808816 /nfs/dbraw/zinc/80/88/16/1128808816.db2.gz UGNCYYJWUPFHHA-CABCVRRESA-N 1 0 299.414 3.556 20 10 CHCDRO COc1cccc(C[N@H+](C)Cc2cccc(Cl)c2)c1O ZINC000161132169 1119006388 /nfs/dbraw/zinc/00/63/88/1119006388.db2.gz QDAURMRLBLKUHL-UHFFFAOYSA-N 1 0 291.778 3.686 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2C[C@@H]2c2ccccc2)c1 ZINC000044674241 1119059245 /nfs/dbraw/zinc/05/92/45/1119059245.db2.gz PMHZEHZHTHLWTC-JCURWCKSSA-N 1 0 283.371 3.608 20 10 CHCDRO CC[C@@]1(C)C[N@H+](Cc2c(O)ccc3ccccc32)CCO1 ZINC000190348377 1128819481 /nfs/dbraw/zinc/81/94/81/1128819481.db2.gz LKAFLFXWPJPDOC-SFHVURJKSA-N 1 0 285.387 3.546 20 10 CHCDRO CSC1(C[NH2+][C@@H]2C[C@@H](C)c3c2c(O)ccc3C)CC1 ZINC000228024563 1119388325 /nfs/dbraw/zinc/38/83/25/1119388325.db2.gz ZGHPVUDLJPGZMS-VXGBXAGGSA-N 1 0 277.433 3.734 20 10 CHCDRO CC[C@@H]([NH2+]CCc1cccc(C)n1)c1ccc(C)cc1O ZINC000280028781 1119631414 /nfs/dbraw/zinc/63/14/14/1119631414.db2.gz HYZYCUHWCJVMFZ-QGZVFWFLSA-N 1 0 284.403 3.687 20 10 CHCDRO Cc1cccc(CC[NH2+][C@H](C)c2cc(Cl)ccc2O)n1 ZINC000279928405 1119632325 /nfs/dbraw/zinc/63/23/25/1119632325.db2.gz APDJPRNQVNDZFE-GFCCVEGCSA-N 1 0 290.794 3.642 20 10 CHCDRO CCCCC[C@@H](CC)[NH2+]Cc1ccc(O)cc1O ZINC000083385387 1119636405 /nfs/dbraw/zinc/63/64/05/1119636405.db2.gz YVBDKHTXJVXJCQ-CYBMUJFWSA-N 1 0 251.370 3.546 20 10 CHCDRO Oc1ccccc1C[N@H+](Cc1ccccc1)C1CC1 ZINC000179555607 1119751350 /nfs/dbraw/zinc/75/13/50/1119751350.db2.gz XLJPCZZMMHAVML-UHFFFAOYSA-N 1 0 253.345 3.557 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](C)c1nccs1)c1ccccc1O ZINC000158099034 1119777686 /nfs/dbraw/zinc/77/76/86/1119777686.db2.gz XRCIKVZWVASLAY-WCQYABFASA-N 1 0 276.405 3.693 20 10 CHCDRO Cc1c(O)ccc(C[N@@H+]2CCC[C@H]2c2cccs2)c1O ZINC001140745380 1119793791 /nfs/dbraw/zinc/79/37/91/1119793791.db2.gz HSILNNVLWPAXCM-ZDUSSCGKSA-N 1 0 289.400 3.805 20 10 CHCDRO CCOc1cccc(C[NH2+]C[C@H]2CCCCC2(F)F)c1O ZINC000295175049 1119870266 /nfs/dbraw/zinc/87/02/66/1119870266.db2.gz UXFFKPXXLAXPOB-CYBMUJFWSA-N 1 0 299.361 3.706 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCO2)[C@]12C[C@H]1CCCC2 ZINC000708837099 1119916564 /nfs/dbraw/zinc/91/65/64/1119916564.db2.gz MCZJJXOHDUDNCZ-XCRHUMRWSA-N 1 0 271.404 3.680 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)CCOCC2CC2)cc1C(C)C ZINC000755945619 1119943505 /nfs/dbraw/zinc/94/35/05/1119943505.db2.gz CMEPFQLSNLPADZ-UHFFFAOYSA-N 1 0 291.435 3.682 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc2c(c1)CCCN2C)c1ccoc1 ZINC000178192022 1119944244 /nfs/dbraw/zinc/94/42/44/1119944244.db2.gz NGCHYDZXMLZQRI-ZDUSSCGKSA-N 1 0 270.376 3.513 20 10 CHCDRO Cc1nc2c(s1)[C@@H]([NH2+][C@@H](C)c1ccccc1O)CCC2 ZINC000376351215 1119951968 /nfs/dbraw/zinc/95/19/68/1119951968.db2.gz JXXNQBQJUFMWSV-GWCFXTLKSA-N 1 0 288.416 3.885 20 10 CHCDRO CC(C)(C)OCc1cccc(C[NH2+]Cc2ccccc2O)c1 ZINC000236575332 1119965970 /nfs/dbraw/zinc/96/59/70/1119965970.db2.gz BLPJHNDGVIRCKU-UHFFFAOYSA-N 1 0 299.414 3.997 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]CCOCC2CCC2)cc1 ZINC000765809428 1120044089 /nfs/dbraw/zinc/04/40/89/1120044089.db2.gz NYTNBSFVDSXKPT-OAHLLOKOSA-N 1 0 290.451 3.610 20 10 CHCDRO CC[C@H]([NH2+]CCOCC1CCC1)c1ccc(N(C)C)cc1 ZINC000765811881 1120050405 /nfs/dbraw/zinc/05/04/05/1120050405.db2.gz VVRLAVZBEKWMNF-SFHVURJKSA-N 1 0 290.451 3.610 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2cc(F)ccc2F)c1 ZINC000107929079 1120062913 /nfs/dbraw/zinc/06/29/13/1120062913.db2.gz LZPKBXHJVOVVEJ-NSHDSACASA-N 1 0 277.314 3.830 20 10 CHCDRO CCOc1cccc(C[NH2+]C(C)(C)C(C)(C)C)c1O ZINC000311550673 1120089006 /nfs/dbraw/zinc/08/90/06/1120089006.db2.gz POKCKUSEQNSHKE-UHFFFAOYSA-N 1 0 265.397 3.705 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]CCC(C)(C)C)c1O ZINC000169085013 1120102486 /nfs/dbraw/zinc/10/24/86/1120102486.db2.gz CFSPQGVGFWREKS-UHFFFAOYSA-N 1 0 271.788 3.580 20 10 CHCDRO CCCN(CCC)c1ccc(C[NH2+][C@@H](C)C[C@H](C)O)cc1 ZINC000782977984 1120103762 /nfs/dbraw/zinc/10/37/62/1120103762.db2.gz HUOUWKJEPQIVFM-HOTGVXAUSA-N 1 0 292.467 3.562 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CCCC(F)(F)C2)cc1C ZINC000695126343 1120112289 /nfs/dbraw/zinc/11/22/89/1120112289.db2.gz MLSBTXFEJHSTOL-CYBMUJFWSA-N 1 0 269.335 3.671 20 10 CHCDRO CC[C@H]([NH2+]CCCOC(C)(C)C)c1ccccc1O ZINC000695278303 1120182908 /nfs/dbraw/zinc/18/29/08/1120182908.db2.gz CXLDRARZEZVUSV-AWEZNQCLSA-N 1 0 265.397 3.638 20 10 CHCDRO CCCCOCCC[NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000756340473 1120212489 /nfs/dbraw/zinc/21/24/89/1120212489.db2.gz IPHMIDSTKGFPSK-TZMCWYRMSA-N 1 0 295.398 3.876 20 10 CHCDRO CCC[N@H+](CCCC1CCOCC1)Cc1ccccc1O ZINC000765932640 1120217330 /nfs/dbraw/zinc/21/73/30/1120217330.db2.gz NGBHOEDQMRHFFF-UHFFFAOYSA-N 1 0 291.435 3.811 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CCSC1)c1cccc(Cl)c1[O-] ZINC000287776945 1120219207 /nfs/dbraw/zinc/21/92/07/1120219207.db2.gz RXBQKKCQZLHQNI-JOYOIKCWSA-N 1 0 271.813 3.592 20 10 CHCDRO CC[C@H](C)[C@](C)(O)C[NH2+][C@H](C)c1ccc(N(C)CC)cc1 ZINC000765945623 1120239454 /nfs/dbraw/zinc/23/94/54/1120239454.db2.gz LBCATBONRZWXET-HDMKZQKVSA-N 1 0 292.467 3.590 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CC(C)(C)OC1(C)C)c1cc(F)ccc1O ZINC000186500113 1120241773 /nfs/dbraw/zinc/24/17/73/1120241773.db2.gz OSBFLTMPTTVRQG-QMTHXVAHSA-N 1 0 281.371 3.528 20 10 CHCDRO CCS[C@H]1CCCC[N@H+](Cc2cc(OC)ccc2O)C1 ZINC000180221382 1120269653 /nfs/dbraw/zinc/26/96/53/1120269653.db2.gz GMCNZQDWTOXVIH-HNNXBMFYSA-N 1 0 295.448 3.508 20 10 CHCDRO CCC[C@@H](C)C[NH2+]Cc1cc(Br)ccc1O ZINC000309875880 1120273250 /nfs/dbraw/zinc/27/32/50/1120273250.db2.gz SPZJFENVXTXVDM-SNVBAGLBSA-N 1 0 286.213 3.681 20 10 CHCDRO C[C@@H]1C[C@H]([NH2+]Cc2cccs2)c2c1c(F)ccc2O ZINC000756373100 1120276883 /nfs/dbraw/zinc/27/68/83/1120276883.db2.gz SRXWGBNFJASRPH-SKDRFNHKSA-N 1 0 277.364 3.931 20 10 CHCDRO Cc1ccc(C(C)(C)[NH2+]Cc2ccc3c(c2)CCCO3)cn1 ZINC000921995061 1120325134 /nfs/dbraw/zinc/32/51/34/1120325134.db2.gz CXYJIGJKMMHPAU-UHFFFAOYSA-N 1 0 296.414 3.740 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2[C@@H]3CCCO[C@H]3C2(C)C)c1 ZINC000363849325 1120337753 /nfs/dbraw/zinc/33/77/53/1120337753.db2.gz GOQFMZOESMMNEM-WRFANHODSA-N 1 0 289.419 3.555 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CCC[C@H](CCF)C1 ZINC000689880404 1120352087 /nfs/dbraw/zinc/35/20/87/1120352087.db2.gz GNYACUJBCDKFAZ-LLVKDONJSA-N 1 0 271.763 3.617 20 10 CHCDRO CC(C)(C)c1cc(O)c(O)c(C[N@@H+]2CCCC3(CC3)C2)c1 ZINC000184864652 1120364544 /nfs/dbraw/zinc/36/45/44/1120364544.db2.gz MHMXJRJQDUGLIP-UHFFFAOYSA-N 1 0 289.419 3.771 20 10 CHCDRO CCCC[C@H](COC)[NH2+][C@@H](C)c1cc(C)ccc1O ZINC000185494413 1120378066 /nfs/dbraw/zinc/37/80/66/1120378066.db2.gz WGILMHJTFTWSBC-UONOGXRCSA-N 1 0 265.397 3.556 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]CCc2cc(F)ccc2F)c1 ZINC000185633672 1120380593 /nfs/dbraw/zinc/38/05/93/1120380593.db2.gz KFDRPNGDJIIYRS-LBPRGKRZSA-N 1 0 291.341 3.872 20 10 CHCDRO C[C@H]1CC[C@@H](C[NH2+]Cc2c(O)cccc2Cl)C1 ZINC000230413685 1120506153 /nfs/dbraw/zinc/50/61/53/1120506153.db2.gz LQWVOCHDNKXHDO-WDEREUQCSA-N 1 0 253.773 3.571 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H](c2ccccn2)C2CC2)cc1F ZINC000922587005 1120558829 /nfs/dbraw/zinc/55/88/29/1120558829.db2.gz VGWROYYXIROZOS-SFHVURJKSA-N 1 0 299.393 3.528 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)c2ccc(C)cc2O)cc1 ZINC000020092187 1120583395 /nfs/dbraw/zinc/58/33/95/1120583395.db2.gz FOWNIFNSHZENLO-AWEZNQCLSA-N 1 0 255.361 3.860 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccccc2F)c(O)c1 ZINC000020091205 1120583506 /nfs/dbraw/zinc/58/35/06/1120583506.db2.gz ZUXSYYBGGDUNOV-LBPRGKRZSA-N 1 0 259.324 3.691 20 10 CHCDRO CCCN(Cc1cc(C)ccc1O)c1ccc(C[NH3+])cc1 ZINC000194980003 1120611549 /nfs/dbraw/zinc/61/15/49/1120611549.db2.gz CEOVHTVONIJXMH-UHFFFAOYSA-N 1 0 284.403 3.576 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCCC23CCOCC3)c1 ZINC000282433081 1120660724 /nfs/dbraw/zinc/66/07/24/1120660724.db2.gz DIFXBECJSGXGDL-PBHICJAKSA-N 1 0 289.419 3.701 20 10 CHCDRO Cc1cnc([C@H](C)C[NH2+][C@H](C)c2ccccc2O)s1 ZINC000186774518 1120666367 /nfs/dbraw/zinc/66/63/67/1120666367.db2.gz KFVPHEQKXAUTGC-ZYHUDNBSSA-N 1 0 276.405 3.611 20 10 CHCDRO C[C@H]([NH2+]C1Cc2ccccc2C1)c1ccc(N(C)C)cc1 ZINC000184007019 1120673248 /nfs/dbraw/zinc/67/32/48/1120673248.db2.gz OEUGCWJBYPVYME-AWEZNQCLSA-N 1 0 280.415 3.571 20 10 CHCDRO C[C@@H]1CC[C@H]([NH2+]Cc2cc(Cl)ccc2O)C[C@@H]1C ZINC000085040896 1120715167 /nfs/dbraw/zinc/71/51/67/1120715167.db2.gz YVTIHNGCIJUMQJ-SUNKGSAMSA-N 1 0 267.800 3.960 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H]2CC[C@H](C)C[C@@H]2C)c1O ZINC000070112021 1128941535 /nfs/dbraw/zinc/94/15/35/1128941535.db2.gz RTBMEUHKRNULLY-KCQAQPDRSA-N 1 0 277.408 3.705 20 10 CHCDRO C[N@@H+](Cc1cc(-c2ccccc2)ccc1O)C[C@H]1CCOC1 ZINC000093839874 1120887317 /nfs/dbraw/zinc/88/73/17/1120887317.db2.gz WMEBTUYZOWJATP-OAHLLOKOSA-N 1 0 297.398 3.528 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](C)[C@H](C)CCSCC)c1 ZINC000093871049 1120892781 /nfs/dbraw/zinc/89/27/81/1120892781.db2.gz LSAOYPWQOBUHIX-CYBMUJFWSA-N 1 0 297.464 3.754 20 10 CHCDRO CCOc1cccc(C[N@@H+]2C[C@H](C)[C@@H]2c2ccccc2)c1O ZINC000093867482 1120891801 /nfs/dbraw/zinc/89/18/01/1120891801.db2.gz PZVHFWPBAYRNFV-KBXCAEBGSA-N 1 0 297.398 3.984 20 10 CHCDRO CCSCC[C@H](C)[N@H+](C)Cc1cc(C)ccc1O ZINC000093871033 1120892736 /nfs/dbraw/zinc/89/27/36/1120892736.db2.gz JLSYXWMNDNERML-ZDUSSCGKSA-N 1 0 267.438 3.664 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cncc(C)c1)c1ccc(N(C)C)cc1 ZINC000181837489 1120894378 /nfs/dbraw/zinc/89/43/78/1120894378.db2.gz KZFZGVOOBSLXHQ-GOSISDBHSA-N 1 0 283.419 3.697 20 10 CHCDRO COc1ccc2ccc(O)c(C[N@H+](C)CCC3CC3)c2c1 ZINC000162890416 1120908159 /nfs/dbraw/zinc/90/81/59/1120908159.db2.gz AOIVRDFNICLDLI-UHFFFAOYSA-N 1 0 285.387 3.786 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(C)c(C)n2)c(O)c1 ZINC000314309312 1120926655 /nfs/dbraw/zinc/92/66/55/1120926655.db2.gz QSDUFJFINWECAO-AWEZNQCLSA-N 1 0 270.376 3.563 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCCN(C)c2ccccc2)c1 ZINC000314318963 1120927201 /nfs/dbraw/zinc/92/72/01/1120927201.db2.gz YIQGYCPYFPOUGI-MRXNPFEDSA-N 1 0 298.430 3.878 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CC[C@@H]3CCCC[C@H]3C2)c1 ZINC000251167492 1120963891 /nfs/dbraw/zinc/96/38/91/1120963891.db2.gz OTAORSCZHKPULD-GJZGRUSLSA-N 1 0 259.393 3.713 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]C[C@H]2Cc3ccccc32)cc1 ZINC000314761894 1120974972 /nfs/dbraw/zinc/97/49/72/1120974972.db2.gz QZPMMBFRLONQLQ-GOSISDBHSA-N 1 0 294.442 3.962 20 10 CHCDRO Cc1ccccc1CC[NH2+][C@H](C)c1ccccc1O ZINC000094182666 1120980202 /nfs/dbraw/zinc/98/02/02/1120980202.db2.gz UIGCJAVNVXCHQE-CQSZACIVSA-N 1 0 255.361 3.594 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCCC1(C)C)c1ccc(N(C)C)cc1 ZINC000094321270 1121000027 /nfs/dbraw/zinc/00/00/27/1121000027.db2.gz INGBGSJPTZRLBK-BBRMVZONSA-N 1 0 260.425 3.982 20 10 CHCDRO COC[C@H]([NH2+][C@@H](C)c1ccc2ccccc2c1O)C(C)C ZINC000086683219 1121029529 /nfs/dbraw/zinc/02/95/29/1121029529.db2.gz AUHJOALZCLSJEZ-GUYCJALGSA-N 1 0 287.403 3.867 20 10 CHCDRO CC[NH+](CC)CCC[C@@H](C)[N@H+](CC)Cc1ccccc1O ZINC001167838924 1121041726 /nfs/dbraw/zinc/04/17/26/1121041726.db2.gz XDPOKZXVIXPMRB-MRXNPFEDSA-N 1 0 292.467 3.725 20 10 CHCDRO C[C@@H]([NH2+][C@H]1CCCC1(C)C)c1cc(F)ccc1O ZINC000094618525 1121087371 /nfs/dbraw/zinc/08/73/71/1121087371.db2.gz UMMBXKNWSZVRDR-YGRLFVJLSA-N 1 0 251.345 3.761 20 10 CHCDRO C[N@H+](Cc1ccccc1)Cc1cc(Cl)ccc1O ZINC000220903302 1121127612 /nfs/dbraw/zinc/12/76/12/1121127612.db2.gz UZXNFEOTMGLMIW-UHFFFAOYSA-N 1 0 261.752 3.678 20 10 CHCDRO CCOc1cccc(C[NH2+][C@H](C)c2ccsc2)c1O ZINC000061360762 1121176147 /nfs/dbraw/zinc/17/61/47/1121176147.db2.gz OUSCFGNGKLZJSK-LLVKDONJSA-N 1 0 277.389 3.703 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CCC[C@@H]2CCC[C@H]21 ZINC000228172718 1121183920 /nfs/dbraw/zinc/18/39/20/1121183920.db2.gz XOXFXVWVMDAPGB-SMDDNHRTSA-N 1 0 265.784 3.810 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cc(C)cc(C)c2)c1 ZINC000182434391 1128969766 /nfs/dbraw/zinc/96/97/66/1128969766.db2.gz SYOLZXCWPNGSIY-CQSZACIVSA-N 1 0 285.387 3.868 20 10 CHCDRO CC[C@@H]([NH2+]CCC1(F)CCC1)c1ccccc1O ZINC000702433203 1121199683 /nfs/dbraw/zinc/19/96/83/1121199683.db2.gz UXORJYFEZVLHBG-CYBMUJFWSA-N 1 0 251.345 3.715 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H]2C[C@@H](OC(C)C)C2(C)C)cc1C ZINC000766087909 1121206566 /nfs/dbraw/zinc/20/65/66/1121206566.db2.gz HEZVBSYEAIIBFY-IAGOWNOFSA-N 1 0 291.435 3.691 20 10 CHCDRO C[C@@H]([NH2+]CCC1SCCS1)c1ccc(N(C)C)cc1 ZINC000703313409 1121246393 /nfs/dbraw/zinc/24/63/93/1121246393.db2.gz SCBJHPDJIROVQI-GFCCVEGCSA-N 1 0 296.505 3.599 20 10 CHCDRO C[C@H]([NH2+]Cc1cnc2ccccc2c1)c1ccccc1O ZINC001175419216 1121318446 /nfs/dbraw/zinc/31/84/46/1121318446.db2.gz TYSXANWSXSVODY-ZDUSSCGKSA-N 1 0 278.355 3.791 20 10 CHCDRO CCC[N@@H+](Cc1c(O)ccc(F)c1Cl)CC1CC1 ZINC001237122484 1128979128 /nfs/dbraw/zinc/97/91/28/1128979128.db2.gz VBKAJHPGFWENCL-UHFFFAOYSA-N 1 0 271.763 3.807 20 10 CHCDRO Oc1ccc(F)c(Cl)c1C[N@@H+]1CC[C@H]2CCC[C@H]2C1 ZINC001237123789 1128981918 /nfs/dbraw/zinc/98/19/18/1128981918.db2.gz LGCPLBWEMYMJSA-MNOVXSKESA-N 1 0 283.774 3.807 20 10 CHCDRO CCC[C@H](C[NH2+][C@@H](C)c1cc(C)ccc1O)OCC ZINC000705314322 1121395875 /nfs/dbraw/zinc/39/58/75/1121395875.db2.gz HVSKCTGAGPLFQJ-UONOGXRCSA-N 1 0 265.397 3.556 20 10 CHCDRO C[C@H]1CC[C@H](C)[NH+]1Cc1cc(Br)ccc1O ZINC000706497667 1121432176 /nfs/dbraw/zinc/43/21/76/1121432176.db2.gz DPZQPZLIWWJVKR-UWVGGRQHSA-N 1 0 284.197 3.528 20 10 CHCDRO COc1cccc(C[NH2+][C@@H]2C[C@H](C)CC(C)(C)C2)c1O ZINC000708233266 1121464586 /nfs/dbraw/zinc/46/45/86/1121464586.db2.gz KNFSFYIUZZQPST-GXTWGEPZSA-N 1 0 277.408 3.705 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]C2CCC3(CC3)CC2)c1O ZINC000709949487 1121471860 /nfs/dbraw/zinc/47/18/60/1121471860.db2.gz WPNONDCAOVMVPF-UHFFFAOYSA-N 1 0 295.810 3.867 20 10 CHCDRO C[C@H](CC1CCC1)[NH2+][C@@H](C)c1ccc(N(C)C)cc1 ZINC000710229789 1121474821 /nfs/dbraw/zinc/47/48/21/1121474821.db2.gz VNSCBKALQGLKQF-KGLIPLIRSA-N 1 0 260.425 3.982 20 10 CHCDRO CC[C@@H]([NH2+]CCSC(C)C)c1ccccc1O ZINC000283084271 1121587755 /nfs/dbraw/zinc/58/77/55/1121587755.db2.gz KXAMEEHLQSCFDB-CYBMUJFWSA-N 1 0 253.411 3.575 20 10 CHCDRO CSCC[C@H](C)[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC000168788811 1121610464 /nfs/dbraw/zinc/61/04/64/1121610464.db2.gz USRLCZFZKXAQQD-AGIUHOORSA-N 1 0 279.449 3.980 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2c(F)cccc2F)c1 ZINC000182803040 1128999762 /nfs/dbraw/zinc/99/97/62/1128999762.db2.gz OCHOZNTWHRZHEE-SNVBAGLBSA-N 1 0 293.313 3.530 20 10 CHCDRO COc1cc(C)cc(C[N@H+](C)[C@@H]2CCc3ccccc32)c1O ZINC000192515848 1129000784 /nfs/dbraw/zinc/00/07/84/1129000784.db2.gz SQONFJWYBQBIRZ-QGZVFWFLSA-N 1 0 297.398 3.829 20 10 CHCDRO COc1cc(C)cc(C[NH2+][C@@H](C)c2ccccc2)c1O ZINC000894146496 1121666992 /nfs/dbraw/zinc/66/69/92/1121666992.db2.gz SOOXPJOTRPIWPB-ZDUSSCGKSA-N 1 0 271.360 3.560 20 10 CHCDRO COc1cc(C)cc(C[NH2+]Cc2ccccc2Cl)c1O ZINC000894149989 1121670745 /nfs/dbraw/zinc/67/07/45/1121670745.db2.gz SRFWAESTDCQDOB-UHFFFAOYSA-N 1 0 291.778 3.652 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C2CCC(F)(F)CC2)c1 ZINC000688504117 1129004452 /nfs/dbraw/zinc/00/44/52/1129004452.db2.gz SMWAGCKVEHQJEC-LLVKDONJSA-N 1 0 269.335 3.929 20 10 CHCDRO Cc1c2ccccc2n(C)c1C[NH2+][C@H]1C=CCCC1 ZINC001178059739 1121764331 /nfs/dbraw/zinc/76/43/31/1121764331.db2.gz IARAJNULUKBOND-AWEZNQCLSA-N 1 0 254.377 3.685 20 10 CHCDRO C[N@H+](CCCc1cccc(F)c1)Cc1ccccc1O ZINC000182873168 1129007955 /nfs/dbraw/zinc/00/79/55/1129007955.db2.gz HIOBQKVQNMIFAU-UHFFFAOYSA-N 1 0 273.351 3.596 20 10 CHCDRO CCN(C)c1ccc(C[N@H+](C)Cc2ccsc2)cc1 ZINC000773729441 1121773393 /nfs/dbraw/zinc/77/33/93/1121773393.db2.gz CSYWTGNOQURONP-UHFFFAOYSA-N 1 0 274.433 3.836 20 10 CHCDRO CCN(C)c1ccc(C[N@H+](C)Cc2ccccc2OC)cc1 ZINC000773733754 1121774206 /nfs/dbraw/zinc/77/42/06/1121774206.db2.gz LODBIYHMMFKTTL-UHFFFAOYSA-N 1 0 298.430 3.783 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CCC[C@@H]2c2cc(C)no2)cc1 ZINC000773731743 1121774279 /nfs/dbraw/zinc/77/42/79/1121774279.db2.gz WRBFAVQINFZNOR-QGZVFWFLSA-N 1 0 299.418 3.776 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)CC(C)(C)OC)c1ccc(N(C)C)cc1 ZINC000766189609 1121781243 /nfs/dbraw/zinc/78/12/43/1121781243.db2.gz GHQWOBUKZVYRPM-RHSMWYFYSA-N 1 0 292.467 3.997 20 10 CHCDRO CCN(C)c1ccc(C[NH+]2CCC(C(F)F)CC2)cc1 ZINC000773764605 1121808384 /nfs/dbraw/zinc/80/83/84/1121808384.db2.gz ADKCWEWAEQHHAS-UHFFFAOYSA-N 1 0 282.378 3.620 20 10 CHCDRO CN(C)c1cc(F)c(C[NH2+][C@@H]2CC3CCC2CC3)cc1F ZINC001178782405 1121814695 /nfs/dbraw/zinc/81/46/95/1121814695.db2.gz GEUOFLVQVQRDQO-ZEPSKSRBSA-N 1 0 294.389 3.699 20 10 CHCDRO CCCOc1ccc(C[NH2+]Cc2occc2C)cc1C ZINC001178841132 1121821290 /nfs/dbraw/zinc/82/12/90/1121821290.db2.gz ZAEBPATVNFGBLW-UHFFFAOYSA-N 1 0 273.376 3.975 20 10 CHCDRO CCC(CC)(C[NH2+]C/C=C/c1ccc(N(C)C)cc1)OC ZINC001178831604 1121821887 /nfs/dbraw/zinc/82/18/87/1121821887.db2.gz WYJJOWCEDQXYHB-CMDGGOBGSA-N 1 0 290.451 3.561 20 10 CHCDRO CCC([NH2+]Cc1ccc(N(C)C)c(F)c1)(C1CC1)C1CC1 ZINC001179153228 1121855805 /nfs/dbraw/zinc/85/58/05/1121855805.db2.gz JFHKLEWFWJBKCP-UHFFFAOYSA-N 1 0 290.426 3.950 20 10 CHCDRO C[C@H]1C[C@@H]([NH2+]Cc2ccc3c(c2)CCO3)c2ccccc21 ZINC000731451112 1121869081 /nfs/dbraw/zinc/86/90/81/1121869081.db2.gz QVAOMCIZSSBAMG-SCLBCKFNSA-N 1 0 279.383 3.960 20 10 CHCDRO CN(C)c1cc(F)c(C[NH2+]C2CCC=CCC2)cc1F ZINC001179615782 1121893853 /nfs/dbraw/zinc/89/38/53/1121893853.db2.gz FGCYLPJBYSIXOZ-UHFFFAOYSA-N 1 0 280.362 3.619 20 10 CHCDRO COc1ccc(C[NH2+]CC2(OC)CCCCCC2)cc1C ZINC001179750745 1121907748 /nfs/dbraw/zinc/90/77/48/1121907748.db2.gz JCVPEYDYFVRFKX-UHFFFAOYSA-N 1 0 291.435 3.833 20 10 CHCDRO CC(C)c1ccc(O)c(C[N@@H+]2CCCOC(C)(C)C2)c1 ZINC001179935581 1121928342 /nfs/dbraw/zinc/92/83/42/1121928342.db2.gz BQEKNKREAMOCIT-UHFFFAOYSA-N 1 0 277.408 3.517 20 10 CHCDRO CCSCC[C@H](C)[N@H+](C)Cc1c(C)cc(OC)cc1O ZINC001179962693 1121936954 /nfs/dbraw/zinc/93/69/54/1121936954.db2.gz QSOGNUCPDSYRON-ZDUSSCGKSA-N 1 0 297.464 3.673 20 10 CHCDRO CCC[C@]1(C)CCC[N@H+](Cc2cc(F)ccc2O)C1 ZINC001180203261 1121962827 /nfs/dbraw/zinc/96/28/27/1121962827.db2.gz NRXUDIMJMMRWMR-MRXNPFEDSA-N 1 0 265.372 3.934 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CC2(O)CCCCCC2)c(O)c1 ZINC000815581711 1121965645 /nfs/dbraw/zinc/96/56/45/1121965645.db2.gz NIFQCQLQLSGVIE-HNNXBMFYSA-N 1 0 291.435 3.745 20 10 CHCDRO C[C@H](CC1CCC1)[NH2+]Cc1ccc(Br)cc1O ZINC000710274619 1121968603 /nfs/dbraw/zinc/96/86/03/1121968603.db2.gz DPZDDFWHLRCVDK-SNVBAGLBSA-N 1 0 298.224 3.823 20 10 CHCDRO CC[C@H](C[NH2+]Cc1cc(C)ccc1O)c1ccccc1 ZINC000733323419 1121975806 /nfs/dbraw/zinc/97/58/06/1121975806.db2.gz ZZBJMZJTIVLMHE-OAHLLOKOSA-N 1 0 269.388 3.984 20 10 CHCDRO CN(C)c1ccc(C[NH2+]C2CC(C)(c3ccccc3)C2)cc1 ZINC000733326434 1121977743 /nfs/dbraw/zinc/97/77/43/1121977743.db2.gz CMRGJFQLNBHTRW-UHFFFAOYSA-N 1 0 294.442 3.963 20 10 CHCDRO COc1cccc2cc(C[NH2+]Cc3cc(C)ccc3O)oc21 ZINC000733326855 1121978460 /nfs/dbraw/zinc/97/84/60/1121978460.db2.gz GGQYUIFVTUYKGI-UHFFFAOYSA-N 1 0 297.354 3.745 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C2CC2)[C@@H]2C=CCCC2)cc1 ZINC000733609738 1122000348 /nfs/dbraw/zinc/00/03/48/1122000348.db2.gz HXASFAPXLMUONC-QGZVFWFLSA-N 1 0 270.420 3.826 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2cc(F)c(N(C)C)cc2F)CC1(C)C ZINC001180673487 1122005256 /nfs/dbraw/zinc/00/52/56/1122005256.db2.gz OLAOFOVTMCWWLH-GFCCVEGCSA-N 1 0 296.405 3.899 20 10 CHCDRO C[N@H+](Cc1ccccc1O)Cc1cccc2cnccc21 ZINC000183127201 1129024944 /nfs/dbraw/zinc/02/49/44/1129024944.db2.gz HGHVUCCVPRJQKM-UHFFFAOYSA-N 1 0 278.355 3.572 20 10 CHCDRO Oc1ccc(F)cc1C[N@@H+]1Cc2ccccc2C2(CCC2)C1 ZINC001181656677 1122068002 /nfs/dbraw/zinc/06/80/02/1122068002.db2.gz UFOJZFQBHXZANM-UHFFFAOYSA-N 1 0 297.373 3.969 20 10 CHCDRO c1ccc2c(c1)C[NH+](Cc1ccc(N3CCCC3)cc1)C2 ZINC001204319039 1122112107 /nfs/dbraw/zinc/11/21/07/1122112107.db2.gz FEZOYFGLMPSOMC-UHFFFAOYSA-N 1 0 278.399 3.803 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H]2CCO[C@H](CC(C)C)C2)cc1C ZINC000271994742 1122185632 /nfs/dbraw/zinc/18/56/32/1122185632.db2.gz MPMKADPRSJVDGU-DLBZAZTESA-N 1 0 291.435 3.692 20 10 CHCDRO CC(C)C[C@@H]1C[C@H]([NH2+]Cc2c(O)cccc2Cl)CCO1 ZINC000272034706 1122188296 /nfs/dbraw/zinc/18/82/96/1122188296.db2.gz UYMQQNSWSKWSCK-CHWSQXEVSA-N 1 0 297.826 3.729 20 10 CHCDRO Cc1ccc(C)n1C1CC[NH+](Cc2ccccc2O)CC1 ZINC000272329362 1122197558 /nfs/dbraw/zinc/19/75/58/1122197558.db2.gz VUZNZDCQQKIWHM-UHFFFAOYSA-N 1 0 284.403 3.648 20 10 CHCDRO COc1cc(C)c(C[NH2+]Cc2cc(C)cc(C)c2)c(O)c1 ZINC001183023566 1122201744 /nfs/dbraw/zinc/20/17/44/1122201744.db2.gz GWFWDAGAITXEEG-UHFFFAOYSA-N 1 0 285.387 3.616 20 10 CHCDRO CC(C)c1ccc(O)c(C[N@H+](C)C[C@H]2CC2(C)C)c1 ZINC001183085138 1122203025 /nfs/dbraw/zinc/20/30/25/1122203025.db2.gz VPRKMXYSMUQELY-OAHLLOKOSA-N 1 0 261.409 3.994 20 10 CHCDRO CCC[C@H](C[NH2+]Cc1cc(Cl)c(C)cc1O)OCC ZINC001183065273 1122205036 /nfs/dbraw/zinc/20/50/36/1122205036.db2.gz JTOWMSNZHDOKEF-CYBMUJFWSA-N 1 0 285.815 3.649 20 10 CHCDRO CN(C)c1ccc(C[NH2+]Cc2cccc3cnccc32)cc1 ZINC000237126654 1122211167 /nfs/dbraw/zinc/21/11/67/1122211167.db2.gz ONUJAQGGBFYCNC-UHFFFAOYSA-N 1 0 291.398 3.591 20 10 CHCDRO CC[C@@H]1[C@@H](C)CC[N@@H+]1Cc1c(O)ccc2ccncc21 ZINC000774623144 1122221033 /nfs/dbraw/zinc/22/10/33/1122221033.db2.gz ZFRNCQVXRZNZAU-BLLLJJGKSA-N 1 0 270.376 3.561 20 10 CHCDRO CC[C@H]1[C@H](C)CC[N@@H+]1Cc1c(O)ccc2ccncc21 ZINC000774623160 1122221240 /nfs/dbraw/zinc/22/12/40/1122221240.db2.gz ZFRNCQVXRZNZAU-WBMJQRKESA-N 1 0 270.376 3.561 20 10 CHCDRO CC1=CCC[C@H](C)[C@H]1C[N@@H+]1Cc2cccc(O)c2C1 ZINC001183454575 1122224228 /nfs/dbraw/zinc/22/42/28/1122224228.db2.gz MHLFGBRQEDGYBA-ZFWWWQNUSA-N 1 0 257.377 3.700 20 10 CHCDRO C[C@@H]([NH2+]CC[C@@H]1CCO[C@H](C)C1)c1ccc(N(C)C)cc1 ZINC000273294375 1122226201 /nfs/dbraw/zinc/22/62/01/1122226201.db2.gz SSKCERQIVACCIY-BZUAXINKSA-N 1 0 290.451 3.608 20 10 CHCDRO C[C@@H]([NH2+]CC[C@H]1CCO[C@H](C)C1)c1ccc(N(C)C)cc1 ZINC000273294378 1122226652 /nfs/dbraw/zinc/22/66/52/1122226652.db2.gz SSKCERQIVACCIY-OAGGEKHMSA-N 1 0 290.451 3.608 20 10 CHCDRO COCC[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1O)c1ccco1 ZINC000273391118 1122231492 /nfs/dbraw/zinc/23/14/92/1122231492.db2.gz DNDKQVORCMZDNW-SMDDNHRTSA-N 1 0 293.338 3.553 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCO[C@H](CC(C)C)C2)c1 ZINC000273519290 1122237807 /nfs/dbraw/zinc/23/78/07/1122237807.db2.gz TYOZEFMOIOMJOZ-ARFHVFGLSA-N 1 0 291.435 3.945 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@@H]2C[C@@H]2[C@@H]2C[C@@H]2C)cc1Cl ZINC001183822052 1122242246 /nfs/dbraw/zinc/24/22/46/1122242246.db2.gz AUGTUBVTEVLQDS-VMXABPDPSA-N 1 0 279.811 3.736 20 10 CHCDRO [O-]c1cccc(F)c1C[NH2+]C/C=C\c1ccc(F)cc1F ZINC001183920028 1122248102 /nfs/dbraw/zinc/24/81/02/1122248102.db2.gz SUSHULIAHGAMRU-IHWYPQMZSA-N 1 0 293.288 3.613 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCC[C@@H](C)[C@H](C)C2)c1O ZINC001203602261 1122303344 /nfs/dbraw/zinc/30/33/44/1122303344.db2.gz LSTGZLFKRPTXRI-ZIAGYGMSSA-N 1 0 277.408 3.659 20 10 CHCDRO Oc1ccc(Cl)cc1C[N@H+]1C[C@H]2CC[C@@H](C1)C2(F)F ZINC001203650743 1122415441 /nfs/dbraw/zinc/41/54/41/1122415441.db2.gz AAHMYQIVTFAGFR-PHIMTYICSA-N 1 0 287.737 3.523 20 10 CHCDRO C[NH+](C)Cc1cc(NCc2ccccc2O)ccc1Cl ZINC000282221264 1122424102 /nfs/dbraw/zinc/42/41/02/1122424102.db2.gz MSVUYHIVNJSXHA-UHFFFAOYSA-N 1 0 290.794 3.719 20 10 CHCDRO C[C@H]([NH2+]C[C@@H](C1CCCCC1)N(C)C)c1ccccc1O ZINC000183425809 1129054470 /nfs/dbraw/zinc/05/44/70/1129054470.db2.gz JCOARAKJLAEOFD-YOEHRIQHSA-N 1 0 290.451 3.553 20 10 CHCDRO CCCN(CC1(OC)CCCCC1)c1ccc(C[NH3+])cc1 ZINC000775141208 1122440327 /nfs/dbraw/zinc/44/03/27/1122440327.db2.gz ZLFXSCGRMYCGLH-UHFFFAOYSA-N 1 0 290.451 3.711 20 10 CHCDRO CCCN(c1ccc(C[NH3+])cc1)[C@@H](C)CCc1ccco1 ZINC000775141052 1122440641 /nfs/dbraw/zinc/44/06/41/1122440641.db2.gz VKVITSZVWMEOAU-HNNXBMFYSA-N 1 0 286.419 3.976 20 10 CHCDRO Cc1ccc([C@H](C[NH2+][C@H](C)c2ccccc2O)N(C)C)cc1 ZINC000183468033 1129056813 /nfs/dbraw/zinc/05/68/13/1129056813.db2.gz AVRFXKXFWHGBBT-QAPCUYQASA-N 1 0 298.430 3.654 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCCN(c2ccccc2)C1)c1ccccc1O ZINC000183514158 1129059413 /nfs/dbraw/zinc/05/94/13/1129059413.db2.gz XJGCZCLLONZOOY-JKSUJKDBSA-N 1 0 296.414 3.712 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCCO[C@@H]1C(C)(C)C)c1ccccc1O ZINC000183519956 1129059738 /nfs/dbraw/zinc/05/97/38/1129059738.db2.gz FUYHNKXYKIWXAJ-VBQJREDUSA-N 1 0 291.435 3.884 20 10 CHCDRO C[C@@H]([NH2+]C[C@H](C)Oc1cccc(F)c1)c1ccccc1O ZINC000183534250 1129061122 /nfs/dbraw/zinc/06/11/22/1129061122.db2.gz LWTQICHZPWXJGK-QWHCGFSZSA-N 1 0 289.350 3.649 20 10 CHCDRO CC[C@H]([NH2+]Cc1cc(C)ccc1O)c1ccccc1OC ZINC000071407547 1129062361 /nfs/dbraw/zinc/06/23/61/1129062361.db2.gz LYPZRIQHUPQJOS-INIZCTEOSA-N 1 0 285.387 3.950 20 10 CHCDRO CCS[C@@H]1CCCC[N@H+](Cc2ccc(N(C)C)cc2)C1 ZINC001190935119 1122560665 /nfs/dbraw/zinc/56/06/65/1122560665.db2.gz QEZFNWNIKGIJIX-QGZVFWFLSA-N 1 0 292.492 3.860 20 10 CHCDRO CC[C@@H]1C[C@@H](C)C[N@@H+]1Cc1ccc(N(C)CC)cc1 ZINC001191232475 1122586634 /nfs/dbraw/zinc/58/66/34/1122586634.db2.gz IAEMVYMARYNBJA-GDBMZVCRSA-N 1 0 260.425 3.763 20 10 CHCDRO CC[C@H]([NH2+]Cc1cccnc1)c1cc(Cl)ccc1O ZINC000775482852 1122615813 /nfs/dbraw/zinc/61/58/13/1122615813.db2.gz DJPHNBVPMRHUKR-AWEZNQCLSA-N 1 0 276.767 3.682 20 10 CHCDRO CC[C@@H]([NH2+]CC1CCOCC1)c1cc(Cl)ccc1O ZINC000775499575 1122628141 /nfs/dbraw/zinc/62/81/41/1122628141.db2.gz JTTXUQFZLKFNTA-CQSZACIVSA-N 1 0 283.799 3.513 20 10 CHCDRO CC[C@@H]([NH2+]C[C@@H](O)CC(C)(C)C)c1cc(Cl)ccc1O ZINC000775507881 1122632057 /nfs/dbraw/zinc/63/20/57/1122632057.db2.gz OVXBOKSZZZUDPO-GXTWGEPZSA-N 1 0 299.842 3.883 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccc(C)c(OC)c1)c1ccccc1O ZINC000775509211 1122632652 /nfs/dbraw/zinc/63/26/52/1122632652.db2.gz JDBCUARVYQZOFW-QGZVFWFLSA-N 1 0 299.414 3.993 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](OC)C(C)C)c1cc(Cl)ccc1O ZINC000775512058 1122633806 /nfs/dbraw/zinc/63/38/06/1122633806.db2.gz JVUDSRXNTLBBPB-DZGCQCFKSA-N 1 0 285.815 3.757 20 10 CHCDRO CC[C@H]([NH2+][C@@H](COC)Cc1ccccc1)c1ccccc1O ZINC000775514082 1122634325 /nfs/dbraw/zinc/63/43/25/1122634325.db2.gz VOWLLTHNEYUTBV-AEFFLSMTSA-N 1 0 299.414 3.691 20 10 CHCDRO CCC[C@@H](CCO)C[NH2+][C@@H](CC)c1cc(Cl)ccc1O ZINC000775512475 1122634991 /nfs/dbraw/zinc/63/49/91/1122634991.db2.gz LCWMVIJJNSLKJJ-WFASDCNBSA-N 1 0 299.842 3.885 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)C[C@H]1CCOC1)c1cc(Cl)ccc1O ZINC000775514445 1122635487 /nfs/dbraw/zinc/63/54/87/1122635487.db2.gz VYIXVVXBXNGFON-JMSVASOKSA-N 1 0 297.826 3.901 20 10 CHCDRO CC[C@H]([NH2+]Cc1cccc(F)n1)c1cc(Cl)ccc1O ZINC000775523249 1122638224 /nfs/dbraw/zinc/63/82/24/1122638224.db2.gz GSRAJKNFHCFNNZ-ZDUSSCGKSA-N 1 0 294.757 3.821 20 10 CHCDRO CC[C@H]([NH2+]Cc1cncc(C)c1)c1cc(Cl)ccc1O ZINC000775526370 1122643637 /nfs/dbraw/zinc/64/36/37/1122643637.db2.gz RSAUMYUFLBFTMD-HNNXBMFYSA-N 1 0 290.794 3.990 20 10 CHCDRO CC[C@@H]([NH2+]CCOC(C)(C)C)c1cc(Cl)ccc1O ZINC000775533224 1122650018 /nfs/dbraw/zinc/65/00/18/1122650018.db2.gz FVYOGZOWANWWMG-CYBMUJFWSA-N 1 0 285.815 3.901 20 10 CHCDRO COc1ccc(C[C@@H](C)C[NH2+][C@@H](C)c2ccccc2O)cc1 ZINC000183631317 1129072850 /nfs/dbraw/zinc/07/28/50/1129072850.db2.gz ZHPGZDHWTOAVKW-CABCVRRESA-N 1 0 299.414 3.930 20 10 CHCDRO CCOC(C)(C)C[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2C ZINC000159253622 1122799935 /nfs/dbraw/zinc/79/99/35/1122799935.db2.gz XEDUIJLKMHKUQR-OLZOCXBDSA-N 1 0 277.408 3.654 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+](C)Cc2cccc(O)c2)c1O ZINC000775633159 1122837816 /nfs/dbraw/zinc/83/78/16/1122837816.db2.gz FDFUIGPKBHBTRP-UHFFFAOYSA-N 1 0 291.778 3.692 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCC[C@H]2Cc2ccccc2)c1O ZINC000775649082 1122863153 /nfs/dbraw/zinc/86/31/53/1122863153.db2.gz ZREYGZZCTQOPBT-SFHVURJKSA-N 1 0 281.399 3.908 20 10 CHCDRO CCS[C@@H]1CCCC[N@H+](Cc2cccc(C)c2O)C1 ZINC000775698785 1122911686 /nfs/dbraw/zinc/91/16/86/1122911686.db2.gz ZIOKSXZLBDZVOI-OAHLLOKOSA-N 1 0 279.449 3.808 20 10 CHCDRO CC[C@@H]1C[N@H+](Cc2cc(Cl)cc(C)c2O)CCS1 ZINC000775702311 1122914453 /nfs/dbraw/zinc/91/44/53/1122914453.db2.gz OQPYGBGLQUAGIN-CYBMUJFWSA-N 1 0 285.840 3.681 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CCCC23CCCCC3)c1 ZINC000775724068 1122924586 /nfs/dbraw/zinc/92/45/86/1122924586.db2.gz CJIAUFCIUWFNRL-UHFFFAOYSA-N 1 0 275.392 3.700 20 10 CHCDRO Cc1cc(Cl)cc(C[N@H+]2CC[C@H]2C(C)C)c1O ZINC000775766279 1122952441 /nfs/dbraw/zinc/95/24/41/1122952441.db2.gz VXCDUMBJKGJWMH-ZDUSSCGKSA-N 1 0 253.773 3.584 20 10 CHCDRO Oc1ccc(C[N@@H+]2CCC[C@H]2C2CCCCC2)cc1O ZINC001203880459 1122959973 /nfs/dbraw/zinc/95/99/73/1122959973.db2.gz SKTBQIZBGDXMPE-HNNXBMFYSA-N 1 0 275.392 3.643 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccnc(Cl)c1)c1ccc(N(C)C)cc1 ZINC000775832371 1122984785 /nfs/dbraw/zinc/98/47/85/1122984785.db2.gz ZXPMVEKSJCOIBI-GFCCVEGCSA-N 1 0 289.810 3.652 20 10 CHCDRO C[C@@H]1[C@H](C(F)(F)F)CCC[N@@H+]1Cc1ccccc1O ZINC000776014052 1123035220 /nfs/dbraw/zinc/03/52/20/1123035220.db2.gz QGVSAHASFPGBQN-ZYHUDNBSSA-N 1 0 273.298 3.555 20 10 CHCDRO CCC1(c2ccccc2)C[NH+](Cc2ccccc2O)C1 ZINC000839186414 1123043071 /nfs/dbraw/zinc/04/30/71/1123043071.db2.gz LAEDFHSFWNGJIP-UHFFFAOYSA-N 1 0 267.372 3.556 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]C[C@H]1CCc2ccccc21 ZINC000776174778 1123101650 /nfs/dbraw/zinc/10/16/50/1123101650.db2.gz GINKZSMIBGNGFR-CYBMUJFWSA-N 1 0 287.790 3.865 20 10 CHCDRO CCOCc1cc(C[NH2+][C@H](C)CC(C)C)ccc1OC ZINC001201594789 1123129350 /nfs/dbraw/zinc/12/93/50/1123129350.db2.gz LDFKQONVESHZJZ-CQSZACIVSA-N 1 0 279.424 3.756 20 10 CHCDRO CCC1(C[NH2+]Cc2cc(Cl)cc(C)c2O)CCOCC1 ZINC000776220420 1123155778 /nfs/dbraw/zinc/15/57/78/1123155778.db2.gz NEHGJBQLONXISN-UHFFFAOYSA-N 1 0 297.826 3.650 20 10 CHCDRO COc1cc(C[NH2+][C@@H](C)C2CCC2)c(O)c(C(C)(C)C)c1 ZINC001201881133 1123156639 /nfs/dbraw/zinc/15/66/39/1123156639.db2.gz IONVGINZIPOWKW-LBPRGKRZSA-N 1 0 291.435 3.977 20 10 CHCDRO Cc1cc(C[N@H+]2CC[C@@H]2C)c(C)n1-c1ccccc1 ZINC001137853997 1123214254 /nfs/dbraw/zinc/21/42/54/1123214254.db2.gz DNKYANOPJAMAHZ-ZDUSSCGKSA-N 1 0 254.377 3.688 20 10 CHCDRO Cc1cc[nH+]c(NCc2ccccc2O)c1C1CC1 ZINC000850362663 1123257262 /nfs/dbraw/zinc/25/72/62/1123257262.db2.gz RJICMBVLKPLCRQ-UHFFFAOYSA-N 1 0 254.333 3.585 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CCC(C)(C)F)c(Cl)c1 ZINC000850373672 1123259502 /nfs/dbraw/zinc/25/95/02/1123259502.db2.gz CGMFWQFJZLMOBB-UHFFFAOYSA-N 1 0 259.752 3.582 20 10 CHCDRO C[C@@]1(CC[NH2+]Cc2cc(Cl)ccc2O)CC1(F)F ZINC000850380116 1123260293 /nfs/dbraw/zinc/26/02/93/1123260293.db2.gz BQZGEEZFXBEEKA-GFCCVEGCSA-N 1 0 275.726 3.571 20 10 CHCDRO Cc1cc(O)c(C[NH2+]CC[C@@]2(C)CC2(F)F)cc1C ZINC000850380122 1123260521 /nfs/dbraw/zinc/26/05/21/1123260521.db2.gz BXWMVEGVNVSBJX-AWEZNQCLSA-N 1 0 269.335 3.534 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H](C)c1ccccn1)c1ccc(C)cc1O ZINC000850481641 1123273115 /nfs/dbraw/zinc/27/31/15/1123273115.db2.gz IHMFWOAETPCYHH-GOEBONIOSA-N 1 0 284.403 3.940 20 10 CHCDRO CC[C@@H]([NH2+]C[C@H]1CCN1C(C)(C)C)c1ccc(C)cc1O ZINC000850483546 1123274040 /nfs/dbraw/zinc/27/40/40/1123274040.db2.gz ZTXFDMOUZGJNTM-GDBMZVCRSA-N 1 0 290.451 3.614 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](C)c1ccccn1)c1ccc(N(C)C)cc1 ZINC000850482918 1123274343 /nfs/dbraw/zinc/27/43/43/1123274343.db2.gz SIBVLBGLDDYTEM-QAPCUYQASA-N 1 0 297.446 3.992 20 10 CHCDRO CC[C@@H](COCC1CC1)[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000850492215 1123274348 /nfs/dbraw/zinc/27/43/48/1123274348.db2.gz BRMBJYPJVNESKE-ZBFHGGJFSA-N 1 0 291.435 3.865 20 10 CHCDRO CC[C@H](COCC1CC1)[NH2+][C@H](C)c1ccc(Cl)cc1O ZINC000850495264 1123275160 /nfs/dbraw/zinc/27/51/60/1123275160.db2.gz ZFHCHTHGKRBXLY-BXUZGUMPSA-N 1 0 297.826 3.901 20 10 CHCDRO Cc1ccncc1CC[NH2+][C@H](C)c1cc(Cl)ccc1O ZINC000850506334 1123276000 /nfs/dbraw/zinc/27/60/00/1123276000.db2.gz IYGIITASDCUEHU-GFCCVEGCSA-N 1 0 290.794 3.642 20 10 CHCDRO CC[C@H]([NH2+]CCc1cnccc1C)c1ccc(N(C)C)cc1 ZINC000850509154 1123277209 /nfs/dbraw/zinc/27/72/09/1123277209.db2.gz YUJXFJBVGCCVGU-IBGZPJMESA-N 1 0 297.446 3.739 20 10 CHCDRO C[C@H]([NH2+][C@@H]1C[C@@H](C)c2c1c(O)ccc2F)c1cscn1 ZINC000850511485 1123278305 /nfs/dbraw/zinc/27/83/05/1123278305.db2.gz GELYEKZPUOCOAT-WCABBAIRSA-N 1 0 292.379 3.887 20 10 CHCDRO C[C@@H]1C[C@@H]([NH2+]CCCOC(C)(C)C)c2c1c(F)ccc2O ZINC000850527226 1123281626 /nfs/dbraw/zinc/28/16/26/1123281626.db2.gz VNKCWFZHJCHVBN-DGCLKSJQSA-N 1 0 295.398 3.874 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCC(C)(C)F)c(O)c1C ZINC000850531905 1123285289 /nfs/dbraw/zinc/28/52/89/1123285289.db2.gz NSLYQDLDSQNZAZ-LBPRGKRZSA-N 1 0 253.361 3.798 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]C[C@@H]2CCC[C@H](C)O2)c(O)c1 ZINC000850534425 1123286275 /nfs/dbraw/zinc/28/62/75/1123286275.db2.gz JIMDWRPREUHKOV-KKUMJFAQSA-N 1 0 277.408 3.617 20 10 CHCDRO C[C@@H]1C[C@@H]([NH2+]C[C@@]2(C)CC2(F)F)c2c1c(F)ccc2O ZINC000850536498 1123286813 /nfs/dbraw/zinc/28/68/13/1123286813.db2.gz KQRKDTWTGOFUOB-PJCOJXEDSA-N 1 0 285.309 3.715 20 10 CHCDRO C[C@H]([NH2+]C[C@]1(C)CC1(F)F)c1cc2c(cc1O)CCCC2 ZINC000850536655 1123287371 /nfs/dbraw/zinc/28/73/71/1123287371.db2.gz MCSXFIKLQBGFPJ-ZBEGNZNMSA-N 1 0 295.373 3.967 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CC[C@@]2(C)CC2(F)F)c(O)c1 ZINC000850537670 1123288249 /nfs/dbraw/zinc/28/82/49/1123288249.db2.gz WXTLHDDXDDVSSV-FZMZJTMJSA-N 1 0 269.335 3.787 20 10 CHCDRO CC(C)[C@@H](O)[C@@H]([NH2+][C@@H](C)c1ccccc1O)c1ccccc1 ZINC000850555149 1123290955 /nfs/dbraw/zinc/29/09/55/1123290955.db2.gz MIQAYACUKFTLQK-ZOCIIQOWSA-N 1 0 299.414 3.801 20 10 CHCDRO Cc1cc(Cl)cc([C@@H](C)[NH2+]C[C@@H]2CCOC2(C)C)c1O ZINC000850570407 1123294021 /nfs/dbraw/zinc/29/40/21/1123294021.db2.gz GYLIRWZCUDAAAC-NEPJUHHUSA-N 1 0 297.826 3.820 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)c1ccc2ccccc2c1O)c1nccn1C ZINC000850572939 1123295132 /nfs/dbraw/zinc/29/51/32/1123295132.db2.gz QTBFZWFSMINOIX-CHWSQXEVSA-N 1 0 295.386 3.691 20 10 CHCDRO CC[C@H]([NH2+][C@@H](c1ccccc1)[C@@H](C)O)c1ccc(C)cc1O ZINC000850583235 1123296212 /nfs/dbraw/zinc/29/62/12/1123296212.db2.gz JYCYHPSEWWHRHB-DKSSEZFCSA-N 1 0 299.414 3.863 20 10 CHCDRO COc1cccc(C[NH2+][C@H](C)c2ccccc2O)c1C ZINC000850579182 1123296460 /nfs/dbraw/zinc/29/64/60/1123296460.db2.gz SZZKFYJISHNITC-CYBMUJFWSA-N 1 0 271.360 3.560 20 10 CHCDRO CC(C)(C)[C@@H]1C[C@H]([NH2+]Cc2cc(Cl)ccc2O)CCO1 ZINC000721827849 1123304317 /nfs/dbraw/zinc/30/43/17/1123304317.db2.gz PXHJBEQYHHKHRU-HIFRSBDPSA-N 1 0 297.826 3.729 20 10 CHCDRO CSC1(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)CCC1 ZINC000193805634 1129114453 /nfs/dbraw/zinc/11/44/53/1129114453.db2.gz KPGRHGMLGSQNIN-JTQLQIEISA-N 1 0 285.840 3.982 20 10 CHCDRO CSc1cccc(C[N@H+](C)Cc2ccccc2O)c1 ZINC000851840859 1123384353 /nfs/dbraw/zinc/38/43/53/1123384353.db2.gz JXYFVVVSWPBZFV-UHFFFAOYSA-N 1 0 273.401 3.746 20 10 CHCDRO CCCC[N@H+](Cc1cccc(N)c1)Cc1ccccc1O ZINC000852018623 1123393415 /nfs/dbraw/zinc/39/34/15/1123393415.db2.gz ORWPTTMCGBJUMG-UHFFFAOYSA-N 1 0 284.403 3.777 20 10 CHCDRO C[C@@H]([NH2+]Cc1c(F)cc(F)c(F)c1F)c1ccccc1O ZINC000797585733 1123395392 /nfs/dbraw/zinc/39/53/92/1123395392.db2.gz MOBJRLDBTICJIJ-MRVPVSSYSA-N 1 0 299.267 3.799 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H](O)CC(C)(C)C)c1ccc(C)cc1O ZINC000794805590 1123403847 /nfs/dbraw/zinc/40/38/47/1123403847.db2.gz XTEHFXKUPWJUST-ZFWWWQNUSA-N 1 0 279.424 3.538 20 10 CHCDRO COc1cccc(C[NH2+][C@]2(c3ccccc3)CC2(C)C)c1O ZINC000853091208 1123424050 /nfs/dbraw/zinc/42/40/50/1123424050.db2.gz ANMAPJFRMSYHMP-IBGZPJMESA-N 1 0 297.398 3.816 20 10 CHCDRO C[C@H]([NH2+]Cc1cnccc1C(F)(F)F)c1ccccc1O ZINC000853242735 1123429863 /nfs/dbraw/zinc/42/98/63/1123429863.db2.gz RRQQRVWKIOKQLD-JTQLQIEISA-N 1 0 296.292 3.657 20 10 CHCDRO COc1cccc(C[C@H](C)[NH2+][C@H](C)c2ccccc2O)c1 ZINC000783521094 1123470066 /nfs/dbraw/zinc/47/00/66/1123470066.db2.gz DTRMFCIBIJBMAS-UONOGXRCSA-N 1 0 285.387 3.683 20 10 CHCDRO COc1cc(C)cc(C[NH2+]Cc2csc(C)c2C)c1O ZINC000895440131 1123480286 /nfs/dbraw/zinc/48/02/86/1123480286.db2.gz QBDJVYATIUIXTF-UHFFFAOYSA-N 1 0 291.416 3.677 20 10 CHCDRO C[N@H+](CCOc1ccc(Cl)cc1)Cc1ccccc1O ZINC000112583741 1123494406 /nfs/dbraw/zinc/49/44/06/1123494406.db2.gz FQQLFDMOKBKPLT-UHFFFAOYSA-N 1 0 291.778 3.556 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CC(C)(C)CCOC)cc1 ZINC000183940698 1129131994 /nfs/dbraw/zinc/13/19/94/1129131994.db2.gz YUYSLCHKRLORLS-HNNXBMFYSA-N 1 0 292.467 3.856 20 10 CHCDRO C[C@@H]([NH2+]CC[C@@H]1CC1(F)F)c1cc2c(cc1O)CCCC2 ZINC000857082830 1123585508 /nfs/dbraw/zinc/58/55/08/1123585508.db2.gz YKNKUTHXAOOHTM-BXUZGUMPSA-N 1 0 295.373 3.967 20 10 CHCDRO CC[C@H]([NH2+]CC[C@H]1CC1(F)F)c1ccc(N(C)C)cc1 ZINC000857082200 1123585922 /nfs/dbraw/zinc/58/59/22/1123585922.db2.gz URSJRLZSOYGBIT-ZFWWWQNUSA-N 1 0 282.378 3.839 20 10 CHCDRO COc1ccc(C[NH2+]CC(C)(C)c2ccc(C)cn2)cc1C ZINC000858241455 1123639453 /nfs/dbraw/zinc/63/94/53/1123639453.db2.gz UPZOOCOQGCWKCO-UHFFFAOYSA-N 1 0 298.430 3.774 20 10 CHCDRO CC[C@@H]([NH2+]CC[C@H]1CCCOC1)c1ccc(N(C)C)cc1 ZINC000858446289 1123655446 /nfs/dbraw/zinc/65/54/46/1123655446.db2.gz WTUVQTYQJGDRIC-CRAIPNDOSA-N 1 0 290.451 3.610 20 10 CHCDRO C[C@@H]([NH2+]C[C@]1(C)C[C@H]2C[C@H]2C1)c1cc(F)ccc1O ZINC000858538189 1123660979 /nfs/dbraw/zinc/66/09/79/1123660979.db2.gz SXYLUNMDFJIYIM-LSSIXWDNSA-N 1 0 263.356 3.618 20 10 CHCDRO Cc1cccnc1[C@@H]1CCC[C@H]([NH2+]Cc2ccccc2O)C1 ZINC000281126583 1123683056 /nfs/dbraw/zinc/68/30/56/1123683056.db2.gz DPNDKZATHHMAKY-WBVHZDCISA-N 1 0 296.414 3.912 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]C[C@H]1CCC2(CCCC2)O1 ZINC000691828613 1123694052 /nfs/dbraw/zinc/69/40/52/1123694052.db2.gz AOKYUNSZQLFIMI-CQSZACIVSA-N 1 0 295.810 3.627 20 10 CHCDRO Cc1nc(C[N@H+](Cc2ccccc2O)C2CCCC2)[nH]c1C ZINC000862242314 1123794462 /nfs/dbraw/zinc/79/44/62/1123794462.db2.gz CGTBOJXVBJWJCS-UHFFFAOYSA-N 1 0 299.418 3.677 20 10 CHCDRO Cc1ncc(C[N@H+](Cc2ccccc2O)C2CCCC2)o1 ZINC000862242497 1123794726 /nfs/dbraw/zinc/79/47/26/1123794726.db2.gz HMXLUNGDJNPKGD-UHFFFAOYSA-N 1 0 286.375 3.633 20 10 CHCDRO CCOc1ccc(O)c(C[NH+]2C[C@H](C)C(F)(F)[C@@H](C)C2)c1 ZINC000862444030 1123811615 /nfs/dbraw/zinc/81/16/15/1123811615.db2.gz SLSZHPNOLXRHOO-RYUDHWBXSA-N 1 0 299.361 3.514 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CC[C@H]3CC[C@@H](C2)S3)cc1Cl ZINC000862473138 1123812459 /nfs/dbraw/zinc/81/24/59/1123812459.db2.gz FYFXWWKGMKWQNQ-OLZOCXBDSA-N 1 0 297.851 3.824 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H](C)c2ccns2)cc1Cl ZINC000862539194 1123818224 /nfs/dbraw/zinc/81/82/24/1123818224.db2.gz JBSBBIKWVKDQLT-VIFPVBQESA-N 1 0 282.796 3.661 20 10 CHCDRO CCCCOCCC[NH2+][C@H](CC)c1ccccc1O ZINC000119120298 1123831522 /nfs/dbraw/zinc/83/15/22/1123831522.db2.gz BYZYTZSGMVQXIL-OAHLLOKOSA-N 1 0 265.397 3.640 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](C)[C@@H](C)c2ccccc2)c1 ZINC000119380827 1123858329 /nfs/dbraw/zinc/85/83/29/1123858329.db2.gz SALXSSZFKOMOMW-AWEZNQCLSA-N 1 0 285.387 3.984 20 10 CHCDRO CC(C)(C)c1cc(O)c(O)c(C[NH+](C2CC2)C2CC2)c1 ZINC000863304436 1123859567 /nfs/dbraw/zinc/85/95/67/1123859567.db2.gz BWMAYBVSAIOMJI-UHFFFAOYSA-N 1 0 275.392 3.522 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCCC[C@H]2F)c(O)c1 ZINC000840875436 1123888917 /nfs/dbraw/zinc/88/89/17/1123888917.db2.gz GXMYZSUXQFUHTE-IACUBPJLSA-N 1 0 251.345 3.632 20 10 CHCDRO CCOc1cccc(C[NH2+]C2C[C@@H](C)C[C@H](C)C2)c1O ZINC000084461638 1129153173 /nfs/dbraw/zinc/15/31/73/1129153173.db2.gz TUDKGKGOYZKECU-STQMWFEESA-N 1 0 277.408 3.705 20 10 CHCDRO C[C@H]1CC([NH2+]Cc2cc(Cl)ccc2O)C[C@H](C)C1 ZINC000084461687 1129153459 /nfs/dbraw/zinc/15/34/59/1129153459.db2.gz MXSNKLTUFNPRAN-GHMZBOCLSA-N 1 0 267.800 3.960 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CC3(CCC3)C[C@@H]2C)c1 ZINC000763648403 1129154689 /nfs/dbraw/zinc/15/46/89/1129154689.db2.gz SHKQNVFREAZSDI-ZDUSSCGKSA-N 1 0 275.392 3.555 20 10 CHCDRO CC[C@H]([NH2+]CC1CCC(OC)CC1)c1ccc(C)cc1O ZINC000794802103 1123950790 /nfs/dbraw/zinc/95/07/90/1123950790.db2.gz MTJNADOQNUAQDI-DQPZFDDXSA-N 1 0 291.435 3.947 20 10 CHCDRO CC[C@H]([NH2+]CCN(C(C)C)C(C)C)c1ccc(C)cc1O ZINC000794792919 1123950975 /nfs/dbraw/zinc/95/09/75/1123950975.db2.gz HXZRNTSRHSVECN-KRWDZBQOSA-N 1 0 292.467 3.860 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccccc1O)c1ccc(C)cc1O ZINC000794803903 1123952858 /nfs/dbraw/zinc/95/28/58/1123952858.db2.gz KYHWGSTZVADGIH-MRXNPFEDSA-N 1 0 285.387 3.690 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)CC(C)(C)OC)c1ccc(C)cc1O ZINC000794803722 1123953423 /nfs/dbraw/zinc/95/34/23/1123953423.db2.gz SMSKBBGIRINUEA-DZGCQCFKSA-N 1 0 279.424 3.945 20 10 CHCDRO CC[C@H](C[C@@H](C)CO)[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000794803672 1123954211 /nfs/dbraw/zinc/95/42/11/1123954211.db2.gz ROHLLAQICFWWSD-FMKPAKJESA-N 1 0 279.424 3.538 20 10 CHCDRO CC[C@H]([NH2+]C[C@]1(C)CCCC[C@@H]1O)c1ccc(C)cc1O ZINC000794806285 1123955570 /nfs/dbraw/zinc/95/55/70/1123955570.db2.gz ZSUJAZFQANNXRN-SZMVWBNQSA-N 1 0 291.435 3.683 20 10 CHCDRO CC[C@@H]([NH2+]CCc1cnc(C)s1)c1ccc(C)cc1O ZINC000794814041 1123957008 /nfs/dbraw/zinc/95/70/08/1123957008.db2.gz GNQFNDCBTZGZSX-OAHLLOKOSA-N 1 0 290.432 3.749 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1CCC[C@H]1OC)c1ccc(C)cc1O ZINC000794815167 1123958363 /nfs/dbraw/zinc/95/83/63/1123958363.db2.gz HYFDIRIPYBHGFN-JLJPHGGASA-N 1 0 277.408 3.556 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](CC)CSC)c1ccc(C)cc1O ZINC000794818549 1123959703 /nfs/dbraw/zinc/95/97/03/1123959703.db2.gz UIQRLXUGQICYDF-GXTWGEPZSA-N 1 0 267.438 3.883 20 10 CHCDRO CC[C@H](CSC)[NH2+][C@H](CC)c1ccc(C)cc1O ZINC000794818553 1123959824 /nfs/dbraw/zinc/95/98/24/1123959824.db2.gz UIQRLXUGQICYDF-TZMCWYRMSA-N 1 0 267.438 3.883 20 10 CHCDRO CC[C@H]([NH2+]CC1(C2CC2)CC1)c1ccc(C)cc1O ZINC000794817830 1123960937 /nfs/dbraw/zinc/96/09/37/1123960937.db2.gz RMTUYVWPKWNCNT-HNNXBMFYSA-N 1 0 259.393 3.932 20 10 CHCDRO CC[C@H]([NH2+]C1Cc2ccccc2C1)c1ccc(C)cc1O ZINC000794818657 1123961347 /nfs/dbraw/zinc/96/13/47/1123961347.db2.gz XUGYOQBMKJTUPX-SFHVURJKSA-N 1 0 281.399 3.909 20 10 CHCDRO CN(Cc1ccccc1O)c1cc[nH+]c2cc(F)ccc21 ZINC000302689737 1123978561 /nfs/dbraw/zinc/97/85/61/1123978561.db2.gz ZFDZSYOVILTJGP-UHFFFAOYSA-N 1 0 282.318 3.716 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)c2ccc(N(C)C)cc2)nc1C ZINC000314717413 1123992885 /nfs/dbraw/zinc/99/28/85/1123992885.db2.gz DUFKKWATRJOUHL-HNNXBMFYSA-N 1 0 283.419 3.615 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2C[C@H](C)[C@H]3CCCC[C@@H]32)c1 ZINC000783592788 1124001534 /nfs/dbraw/zinc/00/15/34/1124001534.db2.gz KLDRFSWRTMLTFV-XKQJLSEDSA-N 1 0 289.419 3.801 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H](CF)c2ccc(F)cc2)cc1C ZINC000865823082 1124017800 /nfs/dbraw/zinc/01/78/00/1124017800.db2.gz RLQFQXRDIKGYOL-INIZCTEOSA-N 1 0 291.341 3.949 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCCC[C@@H]2F)c1 ZINC000866450791 1124067257 /nfs/dbraw/zinc/06/72/57/1124067257.db2.gz ZQXXANGIOHETMJ-KWCYVHTRSA-N 1 0 251.345 3.632 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]Cc2ccnc(F)c2)cc1 ZINC000866472704 1124068651 /nfs/dbraw/zinc/06/86/51/1124068651.db2.gz CXAGTJAYLCGSHL-CYBMUJFWSA-N 1 0 287.382 3.528 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2cnc(C)s2)c1 ZINC000866456498 1124068677 /nfs/dbraw/zinc/06/86/77/1124068677.db2.gz ZUPUHXMVGRKISH-VHSXEESVSA-N 1 0 292.404 3.578 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2cnc(C)s2)c1 ZINC000866456497 1124069182 /nfs/dbraw/zinc/06/91/82/1124069182.db2.gz ZUPUHXMVGRKISH-UWVGGRQHSA-N 1 0 292.404 3.578 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2cccc3c2CCOC3)c(O)c1 ZINC000866479319 1124071014 /nfs/dbraw/zinc/07/10/14/1124071014.db2.gz RPQWTJVRAAPHGP-AWEZNQCLSA-N 1 0 297.398 3.624 20 10 CHCDRO CCc1onc(C)c1C[NH2+]Cc1ccc2ccccc2c1O ZINC000897336968 1124075111 /nfs/dbraw/zinc/07/51/11/1124075111.db2.gz SKALQTMGORBGNV-UHFFFAOYSA-N 1 0 296.370 3.694 20 10 CHCDRO C[C@@H]([NH2+]C1([C@H]2CCCCO2)CCC1)c1ccccc1O ZINC000866623094 1124090940 /nfs/dbraw/zinc/09/09/40/1124090940.db2.gz RYIGPSCHCZOKDR-CZUORRHYSA-N 1 0 275.392 3.535 20 10 CHCDRO CC[C@H](C[C@@H](C)O)[NH2+][C@@H](C)c1cc(Cl)cc(C)c1O ZINC000866632683 1124091893 /nfs/dbraw/zinc/09/18/93/1124091893.db2.gz BDAJYNPXXVYDTC-NTZNESFSSA-N 1 0 285.815 3.554 20 10 CHCDRO COCC(C)(C)CC[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2C ZINC001119066880 1131246538 /nfs/dbraw/zinc/24/65/38/1131246538.db2.gz VCEDWXORHIEGCR-KBPBESRZSA-N 1 0 291.435 3.901 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@H](C)c2cc3ccccc3o2)c1 ZINC000122074647 1124464305 /nfs/dbraw/zinc/46/43/05/1124464305.db2.gz PDUNECOICNXOGJ-GFCCVEGCSA-N 1 0 297.354 3.998 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1C[C@@H](C)O[C@@H](C)C1)c1ccc(N(C)C)cc1 ZINC001119822914 1131265063 /nfs/dbraw/zinc/26/50/63/1131265063.db2.gz LUKQLLRGLPQDFK-XUWVNRHRSA-N 1 0 290.451 3.607 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ncc(C)s1)c1ccc(N(C)C)cc1 ZINC000122940320 1124544915 /nfs/dbraw/zinc/54/49/15/1124544915.db2.gz OZJHGGIHTPASOR-OAHLLOKOSA-N 1 0 289.448 3.758 20 10 CHCDRO Cc1ccc(C)n1-c1ccc(C2=CCC[NH2+]CC2)cc1 ZINC001238940622 1131274619 /nfs/dbraw/zinc/27/46/19/1131274619.db2.gz DMXIFTLNDMHOFD-UHFFFAOYSA-N 1 0 266.388 3.861 20 10 CHCDRO C[C@H]([NH2+]C[C@@H]1C[C@H]2CCC[C@H]2O1)c1ccc(Cl)cc1O ZINC000872108972 1124685427 /nfs/dbraw/zinc/68/54/27/1124685427.db2.gz ZORNIJYGFAYDPJ-NGOBNIPXSA-N 1 0 295.810 3.654 20 10 CHCDRO Cc1nccnc1[C@@H](C)[NH2+][C@@H](C)c1cc(Cl)ccc1O ZINC000872132356 1124691686 /nfs/dbraw/zinc/69/16/86/1124691686.db2.gz FFJWYZHNCOFLNA-GXSJLCMTSA-N 1 0 291.782 3.556 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)c1ccccc1O)[C@@H](O)c1ccccc1 ZINC000872134423 1124692322 /nfs/dbraw/zinc/69/23/22/1124692322.db2.gz WCJZVVWXUDRNIQ-SKDZVZGDSA-N 1 0 285.387 3.555 20 10 CHCDRO Cc1cccc(C[N@@H+]2CCC[C@@H](OC3CCC3)CC2)c1O ZINC000872261326 1124699061 /nfs/dbraw/zinc/69/90/61/1124699061.db2.gz DMAHFRPWATVALZ-QGZVFWFLSA-N 1 0 289.419 3.624 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CC[C@@H]2CSC[C@H]2C1 ZINC000872721387 1124727606 /nfs/dbraw/zinc/72/76/06/1124727606.db2.gz FOYCPQFUFMWBLJ-HUUCEWRRSA-N 1 0 299.439 3.730 20 10 CHCDRO CCCOc1ccc(C[NH2+][C@H]2CCCc3cn[nH]c32)cc1C ZINC000873080200 1124736799 /nfs/dbraw/zinc/73/67/99/1124736799.db2.gz LEAPZMGLGPLSGI-INIZCTEOSA-N 1 0 299.418 3.674 20 10 CHCDRO CCCOc1ccc(C[NH2+][C@H](C)c2ccc[nH]2)cc1C ZINC000873096931 1124738828 /nfs/dbraw/zinc/73/88/28/1124738828.db2.gz AXQKZVLSEQOVCX-CQSZACIVSA-N 1 0 272.392 3.963 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2ccc(F)cc2)c1 ZINC000020095655 1124805568 /nfs/dbraw/zinc/80/55/68/1124805568.db2.gz KNLOQMIBPZDQRL-RYUDHWBXSA-N 1 0 289.350 3.952 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]C[C@H](C)C(C)(C)C)c1 ZINC000125100475 1124848254 /nfs/dbraw/zinc/84/82/54/1124848254.db2.gz ZRYILRLNAAKVPF-NWDGAFQWSA-N 1 0 265.397 3.734 20 10 CHCDRO Cc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(O)cc2)c(O)c1 ZINC000876637041 1124966798 /nfs/dbraw/zinc/96/67/98/1124966798.db2.gz PANJZIYPPAOXKI-QGZVFWFLSA-N 1 0 283.371 3.743 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)Cc1cc(F)cc(F)c1F ZINC001137873705 1124980649 /nfs/dbraw/zinc/98/06/49/1124980649.db2.gz QMKRDSHCXMJNSG-UHFFFAOYSA-N 1 0 295.304 3.832 20 10 CHCDRO Cc1ccc(CNc2ccc(C[NH+](C)C)c(F)c2)c(O)c1 ZINC000876868641 1124985122 /nfs/dbraw/zinc/98/51/22/1124985122.db2.gz HTENQOBFLUSCMB-UHFFFAOYSA-N 1 0 288.366 3.513 20 10 CHCDRO CCOCc1ccc(C[NH2+]Cc2ccc(C)cc2O)cc1 ZINC000876927247 1124990460 /nfs/dbraw/zinc/99/04/60/1124990460.db2.gz WQVGEGLAFMBXEI-UHFFFAOYSA-N 1 0 285.387 3.527 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2ccccc2OC(C)C)c(O)c1 ZINC000876956166 1124992865 /nfs/dbraw/zinc/99/28/65/1124992865.db2.gz FLAPPZRSUYXKLP-UHFFFAOYSA-N 1 0 285.387 3.778 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](C)CCc2ccc(O)cc2)c(O)c1 ZINC000877016214 1124998052 /nfs/dbraw/zinc/99/80/52/1124998052.db2.gz DEBISBJSLJMNFZ-AWEZNQCLSA-N 1 0 285.387 3.517 20 10 CHCDRO CCc1ccccc1C[NH2+]Cc1c(C)cccc1O ZINC000877060263 1125004045 /nfs/dbraw/zinc/00/40/45/1125004045.db2.gz WEECHPTZMGKPAN-UHFFFAOYSA-N 1 0 255.361 3.553 20 10 CHCDRO CCOCCC1(C[NH2+]Cc2c(C)cccc2O)CCCC1 ZINC000877086083 1125008264 /nfs/dbraw/zinc/00/82/64/1125008264.db2.gz MJUAYAXPWYBNCM-UHFFFAOYSA-N 1 0 291.435 3.777 20 10 CHCDRO CCC(CC)[C@@H]1C[C@H]([NH2+]Cc2c(C)cccc2O)CCO1 ZINC000877167486 1125016744 /nfs/dbraw/zinc/01/67/44/1125016744.db2.gz ZOCXYQPRFNBMOK-QAPCUYQASA-N 1 0 291.435 3.774 20 10 CHCDRO CCC(CC)[C@@H]1C[C@@H]([NH2+]Cc2ccc(C)cc2O)CCO1 ZINC000877166467 1125017259 /nfs/dbraw/zinc/01/72/59/1125017259.db2.gz AMKCOMKIADTRMF-WMZOPIPTSA-N 1 0 291.435 3.774 20 10 CHCDRO Cc1ccc(C2CC[NH+](Cc3c(C)cccc3O)CC2)cn1 ZINC000877197292 1125018057 /nfs/dbraw/zinc/01/80/57/1125018057.db2.gz RIPXCOOFPAIQRE-UHFFFAOYSA-N 1 0 296.414 3.784 20 10 CHCDRO Cc1ccc(C[NH2+][C@@H](c2ccccc2)C(C)(C)CO)c(O)c1 ZINC000877481409 1125033158 /nfs/dbraw/zinc/03/31/58/1125033158.db2.gz GTADSPHGVCOCRU-SFHVURJKSA-N 1 0 299.414 3.550 20 10 CHCDRO Cc1ccc(CNc2ccc(C[NH+](C)C)cc2F)c(O)c1 ZINC000877587301 1125050236 /nfs/dbraw/zinc/05/02/36/1125050236.db2.gz AVNAXEHZGNQWMT-UHFFFAOYSA-N 1 0 288.366 3.513 20 10 CHCDRO CC[C@@H](C[NH2+]Cc1c(C)cccc1O)CC(F)(F)F ZINC000877589501 1125050973 /nfs/dbraw/zinc/05/09/73/1125050973.db2.gz PGRIYRPGLJUNDC-LLVKDONJSA-N 1 0 275.314 3.769 20 10 CHCDRO CCc1cccc(C[NH2+]Cc2c(C)cccc2O)c1 ZINC000877613991 1125053287 /nfs/dbraw/zinc/05/32/87/1125053287.db2.gz FMZFTTCWQNDHME-UHFFFAOYSA-N 1 0 255.361 3.553 20 10 CHCDRO Cc1ncc([C@@H](C)[NH2+]Cc2cc(Cl)cc(C)c2O)s1 ZINC000877684932 1125063092 /nfs/dbraw/zinc/06/30/92/1125063092.db2.gz DITKDTFSOJHUAG-SECBINFHSA-N 1 0 296.823 3.970 20 10 CHCDRO Oc1c(C[NH2+][C@@H]2C[C@H]2C(F)(F)F)ccc2ccccc21 ZINC000877703762 1125065284 /nfs/dbraw/zinc/06/52/84/1125065284.db2.gz SVVOAVLWCIATOS-CHWSQXEVSA-N 1 0 281.277 3.586 20 10 CHCDRO Cc1cccc(C[NH2+]Cc2ccc(C(C)(C)C)o2)c1O ZINC000877735511 1125070909 /nfs/dbraw/zinc/07/09/09/1125070909.db2.gz VOXNDHBPGMDKNE-UHFFFAOYSA-N 1 0 273.376 3.881 20 10 CHCDRO COCC(C)(C)CC[NH2+]Cc1cc(Cl)c(C)cc1O ZINC000877803059 1125079809 /nfs/dbraw/zinc/07/98/09/1125079809.db2.gz CVYAAAIPNNTZRP-UHFFFAOYSA-N 1 0 285.815 3.506 20 10 CHCDRO Oc1c(C[NH2+]C[C@@H]2C[C@@H]3CCC[C@H]3O2)ccc2ccccc21 ZINC000877806532 1125082913 /nfs/dbraw/zinc/08/29/13/1125082913.db2.gz PDKHIBIFTDXDPF-QILLFSRXSA-N 1 0 297.398 3.593 20 10 CHCDRO C[N@@H+](Cc1ccccc1O)C[C@@H]1CC[C@@H](c2ccccc2)O1 ZINC000878242893 1125134271 /nfs/dbraw/zinc/13/42/71/1125134271.db2.gz WSHAYIXOLUHZTA-HKUYNNGSSA-N 1 0 297.398 3.744 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]CC[C@@H]2CCCC2(F)F)c1 ZINC000878361024 1125144575 /nfs/dbraw/zinc/14/45/75/1125144575.db2.gz VTMGHPYGWZCLCD-RYUDHWBXSA-N 1 0 299.361 3.877 20 10 CHCDRO Cc1cc(C[NH2+][C@@H](C)c2ccccc2O)ccc1N(C)C ZINC000879649706 1125222199 /nfs/dbraw/zinc/22/21/99/1125222199.db2.gz CRJRCPNXYSBXOM-AWEZNQCLSA-N 1 0 284.403 3.617 20 10 CHCDRO Cc1cc(C)c(C[NH2+][C@H](C)c2ccccc2O)c(C)n1 ZINC000879649726 1125222543 /nfs/dbraw/zinc/22/25/43/1125222543.db2.gz FFOZSSRZSAPPHT-CYBMUJFWSA-N 1 0 270.376 3.563 20 10 CHCDRO COc1ccc(C[NH2+]CCCOC2CCCCC2)cc1C ZINC000035052776 1125233627 /nfs/dbraw/zinc/23/36/27/1125233627.db2.gz SZCYVBSHIIGLMQ-UHFFFAOYSA-N 1 0 291.435 3.833 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+][C@H](C)C2CCCC2)c1O ZINC000228674601 1125250837 /nfs/dbraw/zinc/25/08/37/1125250837.db2.gz YKAAWJFEMNQTCD-SNVBAGLBSA-N 1 0 283.799 3.723 20 10 CHCDRO CCc1cccc(C[NH2+][C@]2(C)CCOc3ccccc32)c1O ZINC000897386137 1125281272 /nfs/dbraw/zinc/28/12/72/1125281272.db2.gz RNSRLXDASMOXPO-LJQANCHMSA-N 1 0 297.398 3.742 20 10 CHCDRO CCc1cccc(C[NH2+][C@H](C)c2ccc3c(c2)CCO3)c1O ZINC000897418005 1125321673 /nfs/dbraw/zinc/32/16/73/1125321673.db2.gz JUUKCOSOCNLKAN-CYBMUJFWSA-N 1 0 297.398 3.740 20 10 CHCDRO CCC1CCC([N@H+](C)Cc2cc3c(cc2O)OCO3)CC1 ZINC000109745946 1125358779 /nfs/dbraw/zinc/35/87/79/1125358779.db2.gz BHMNWNDMQNWBII-UHFFFAOYSA-N 1 0 291.391 3.522 20 10 CHCDRO CSc1ccc(C[NH2+][C@@H](C)c2ccccc2O)o1 ZINC000883225584 1125379821 /nfs/dbraw/zinc/37/98/21/1125379821.db2.gz JWVMTQKCQQKRMK-JTQLQIEISA-N 1 0 263.362 3.558 20 10 CHCDRO CC(=O)c1cc(F)cc(C[N@@H+]2CC[C@H](C(C)(C)C)C2)c1O ZINC000131355578 1125388186 /nfs/dbraw/zinc/38/81/86/1125388186.db2.gz CHADITSYWFMZRV-ZDUSSCGKSA-N 1 0 293.382 3.602 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CC[C@@H]2CCCC2(F)F)c1O ZINC000883274539 1125390578 /nfs/dbraw/zinc/39/05/78/1125390578.db2.gz NTJGONBEOLYEPG-NEPJUHHUSA-N 1 0 299.361 3.877 20 10 CHCDRO C[C@@H]([NH2+]C[C@H]1CCC2(CCC2)O1)c1ccc(Cl)cc1O ZINC000883357467 1125401349 /nfs/dbraw/zinc/40/13/49/1125401349.db2.gz LYMJEQPSAJQNRW-DGCLKSJQSA-N 1 0 295.810 3.798 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CCC[C@]12CCCO2)c1ccccc1O ZINC000883368900 1125403395 /nfs/dbraw/zinc/40/33/95/1125403395.db2.gz FBWFJNJUHYQAKJ-OIISXLGYSA-N 1 0 275.392 3.535 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@H]2c3ccccc3CC[C@@H]2F)c1 ZINC000883383092 1125406557 /nfs/dbraw/zinc/40/65/57/1125406557.db2.gz SSXNJFOEZHXEHZ-WMZOPIPTSA-N 1 0 285.362 3.816 20 10 CHCDRO Oc1ccccc1C[NH2+][C@H]1c2ccccc2CC[C@@H]1F ZINC000883382435 1125406710 /nfs/dbraw/zinc/40/67/10/1125406710.db2.gz GXMQXJHCVYUVTP-RDJZCZTQSA-N 1 0 271.335 3.507 20 10 CHCDRO COc1cccc(C[N@H+](C)C2CCCCCC2)c1O ZINC000132358005 1125417594 /nfs/dbraw/zinc/41/75/94/1125417594.db2.gz OSSDNODKFJGRES-UHFFFAOYSA-N 1 0 263.381 3.555 20 10 CHCDRO C[C@H]([NH2+]CCCNc1cccc(F)c1)c1ccccc1O ZINC000184462831 1129201320 /nfs/dbraw/zinc/20/13/20/1129201320.db2.gz ZPIJYMANUGRIBP-ZDUSSCGKSA-N 1 0 288.366 3.684 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@@H]2CCc3cccc(O)c32)c1 ZINC000295771527 1129219117 /nfs/dbraw/zinc/21/91/17/1129219117.db2.gz AJPRBUWNQQFBIZ-MLGOLLRUSA-N 1 0 283.371 3.739 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H]2CCc3cccc(O)c32)c1 ZINC000295977004 1129220876 /nfs/dbraw/zinc/22/08/76/1129220876.db2.gz MZLQQDWRDQUNJH-MRXNPFEDSA-N 1 0 283.371 3.568 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCCC(C)(F)F)c1 ZINC000297449056 1129225363 /nfs/dbraw/zinc/22/53/63/1129225363.db2.gz WVZGKUONZVZHQL-LLVKDONJSA-N 1 0 257.324 3.787 20 10 CHCDRO CCOCc1cc(C[NH2+]C(C)(C)CC)ccc1OC ZINC000076398793 1129263281 /nfs/dbraw/zinc/26/32/81/1129263281.db2.gz IXYXERCUJURPNI-UHFFFAOYSA-N 1 0 265.397 3.510 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cc(F)cc(F)c2)c1 ZINC000184931857 1129264236 /nfs/dbraw/zinc/26/42/36/1129264236.db2.gz PIFQKOXAWTZVSQ-SNVBAGLBSA-N 1 0 293.313 3.530 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+]CC2(c3ccccc3)CC2)c1 ZINC000184957528 1129265737 /nfs/dbraw/zinc/26/57/37/1129265737.db2.gz YYZRYURYALRFOG-AWEZNQCLSA-N 1 0 297.398 3.783 20 10 CHCDRO COc1ccccc1C[C@H](C)[NH2+][C@H](C)c1ccccc1O ZINC000037778493 1129268661 /nfs/dbraw/zinc/26/86/61/1129268661.db2.gz GZXMEGGQOASMSX-UONOGXRCSA-N 1 0 285.387 3.683 20 10 CHCDRO COc1ccccc1C[C@H](C)[NH2+][C@@H](C)c1ccccc1O ZINC000037778491 1129268800 /nfs/dbraw/zinc/26/88/00/1129268800.db2.gz GZXMEGGQOASMSX-KBPBESRZSA-N 1 0 285.387 3.683 20 10 CHCDRO Cc1csc(C[NH2+][C@H](C)c2ccc(N(C)C)cc2)c1 ZINC000379256206 1129286445 /nfs/dbraw/zinc/28/64/45/1129286445.db2.gz FJDPCKXGSCAXJT-CYBMUJFWSA-N 1 0 274.433 3.973 20 10 CHCDRO Cc1ncc([C@H](C)[NH2+]Cc2ccc(N(C)C)c(F)c2)s1 ZINC000090406432 1129287512 /nfs/dbraw/zinc/28/75/12/1129287512.db2.gz ZIZLPENOHVMKEX-JTQLQIEISA-N 1 0 293.411 3.507 20 10 CHCDRO CC[C@H](C)CC[NH2+]Cc1cc(Cl)c(C)cc1O ZINC001206605455 1129311540 /nfs/dbraw/zinc/31/15/40/1129311540.db2.gz QPZCDUIQUFXOAO-JTQLQIEISA-N 1 0 255.789 3.880 20 10 CHCDRO CCC(CC)(CO)[NH2+]Cc1cc(-c2ccccc2)ccc1O ZINC000734843092 1129324266 /nfs/dbraw/zinc/32/42/66/1129324266.db2.gz GWZIQCTYOWGHEW-UHFFFAOYSA-N 1 0 299.414 3.700 20 10 CHCDRO CCN(C)c1ccc([C@@H](C)[NH2+]C[C@@H](C)SC)cc1 ZINC000090726485 1129326218 /nfs/dbraw/zinc/32/62/18/1129326218.db2.gz ABNJQFDMLGNFRG-CHWSQXEVSA-N 1 0 266.454 3.545 20 10 CHCDRO CCCCC[C@H](CC)[NH2+]CCc1ccc(O)c(O)c1 ZINC001258427441 1129327029 /nfs/dbraw/zinc/32/70/29/1129327029.db2.gz DLISTNVBJWOZHN-AWEZNQCLSA-N 1 0 265.397 3.589 20 10 CHCDRO CCOc1cccc(C[NH2+]C(C)(C)c2cccs2)c1O ZINC000735087171 1129330629 /nfs/dbraw/zinc/33/06/29/1129330629.db2.gz XTOVPINUGPBKHI-UHFFFAOYSA-N 1 0 291.416 3.877 20 10 CHCDRO Clc1ccc(C[NH2+]CCCSc2nccs2)o1 ZINC000735925756 1129360790 /nfs/dbraw/zinc/36/07/90/1129360790.db2.gz PYKWPCZINXLBOX-UHFFFAOYSA-N 1 0 288.825 3.662 20 10 CHCDRO Cc1cccc(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)n1 ZINC000736945886 1129381871 /nfs/dbraw/zinc/38/18/71/1129381871.db2.gz UOMNEZLOMHYTEQ-UHFFFAOYSA-N 1 0 295.430 3.621 20 10 CHCDRO CC(C)C[N@H+](C)Cc1ccc(N2CCCCC2)cc1 ZINC000248058537 1129399751 /nfs/dbraw/zinc/39/97/51/1129399751.db2.gz PBOJQROKVZFGIP-UHFFFAOYSA-N 1 0 260.425 3.765 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CCC[C@@H]2C2CCC2)c1 ZINC000092781213 1129407790 /nfs/dbraw/zinc/40/77/90/1129407790.db2.gz MWTROSDFHCFESE-MRXNPFEDSA-N 1 0 275.392 3.555 20 10 CHCDRO CCC[C@@H](C)[NH2+]Cc1ccc(N(CC)CC)c(F)c1 ZINC000740002500 1129408838 /nfs/dbraw/zinc/40/88/38/1129408838.db2.gz PAFASURUMUJCMA-CYBMUJFWSA-N 1 0 266.404 3.950 20 10 CHCDRO COc1cccc(C[N@@H+]2CCC3(C2)CCCCC3)c1O ZINC000093663734 1129426679 /nfs/dbraw/zinc/42/66/79/1129426679.db2.gz IOLKTHCZVOCSML-UHFFFAOYSA-N 1 0 275.392 3.557 20 10 CHCDRO Oc1ccc2ccncc2c1C[NH+]1CCC2(CCC2)CC1 ZINC000795717640 1129441684 /nfs/dbraw/zinc/44/16/84/1129441684.db2.gz KACNAEUXZKQTQV-UHFFFAOYSA-N 1 0 282.387 3.707 20 10 CHCDRO Cc1cc(O)c(CNc2[nH+]ccn2-c2ccccc2)cc1C ZINC000795806080 1129447633 /nfs/dbraw/zinc/44/76/33/1129447633.db2.gz TZNBVVXAIZIJSN-UHFFFAOYSA-N 1 0 293.370 3.807 20 10 CHCDRO CC(C)Cn1cc[nH+]c1NCc1c(O)cccc1Cl ZINC000795804861 1129449889 /nfs/dbraw/zinc/44/98/89/1129449889.db2.gz DBWDTRBQCHVUFA-UHFFFAOYSA-N 1 0 279.771 3.510 20 10 CHCDRO CCN(C)c1ccc(C[N@@H+]2CCc3sccc3C2)cc1 ZINC000741752667 1129451300 /nfs/dbraw/zinc/45/13/00/1129451300.db2.gz DRQMRKWAONQTHJ-UHFFFAOYSA-N 1 0 286.444 3.763 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@H](C)c2ccc(C)c(F)c2)c1 ZINC000094953023 1129456234 /nfs/dbraw/zinc/45/62/34/1129456234.db2.gz YQRBPSDWAPMMSY-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2C[C@@H]3[C@H](C2)C3(C)C)cc1C(C)C ZINC000742166808 1129468386 /nfs/dbraw/zinc/46/83/86/1129468386.db2.gz RFIZVUYHMQHMKU-IYBDPMFKSA-N 1 0 273.420 3.912 20 10 CHCDRO C[C@@H]1CCC[C@H](C)[N@H+](Cc2c(O)ccc3ccncc32)C1 ZINC000742154176 1129468450 /nfs/dbraw/zinc/46/84/50/1129468450.db2.gz FBUNGRJJXAUDBA-KGLIPLIRSA-N 1 0 284.403 3.951 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@H](C)CCc2ccco2)cc1C ZINC000742366365 1129472159 /nfs/dbraw/zinc/47/21/59/1129472159.db2.gz ZBUYBSFRFHAKGH-CQSZACIVSA-N 1 0 273.376 3.713 20 10 CHCDRO CCOc1cccc(C[NH2+][C@@H]2CC[C@@H](C)C[C@H]2C)c1O ZINC000250520102 1129483020 /nfs/dbraw/zinc/48/30/20/1129483020.db2.gz RTBMEUHKRNULLY-UMVBOHGHSA-N 1 0 277.408 3.705 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CCC[C@@H](C)[C@H]2C)cc1C ZINC000250881801 1129501187 /nfs/dbraw/zinc/50/11/87/1129501187.db2.gz VBMMRQLUASPYOH-XNRPHZJLSA-N 1 0 261.409 3.918 20 10 CHCDRO CC[C@H](C)[N@H+](C)Cc1ccc(N2CCC(OC)CC2)cc1 ZINC000828273134 1131381672 /nfs/dbraw/zinc/38/16/72/1131381672.db2.gz IADNUJSYFGDYPP-HNNXBMFYSA-N 1 0 290.451 3.532 20 10 CHCDRO CC(C)O[C@@H]1C[C@@H]([NH2+][C@@H](C)c2cc(F)ccc2O)C1(C)C ZINC000766330173 1129604372 /nfs/dbraw/zinc/60/43/72/1129604372.db2.gz BQHTZCYBIHBTJN-IUIKQTSFSA-N 1 0 295.398 3.774 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CC(C)(C)SC)cc1 ZINC000766362210 1129660207 /nfs/dbraw/zinc/66/02/07/1129660207.db2.gz QNQSNOUHBMVCGB-ZDUSSCGKSA-N 1 0 280.481 3.935 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@H](C)c2ccncc2)cc1 ZINC000766491244 1129669715 /nfs/dbraw/zinc/66/97/15/1129669715.db2.gz YREXPOQKJCFWAL-HOTGVXAUSA-N 1 0 297.446 3.992 20 10 CHCDRO CC[C@H]([NH2+]CC1(C)CC(F)(F)C1)c1ccccc1O ZINC000720901145 1129718098 /nfs/dbraw/zinc/71/80/98/1129718098.db2.gz QENIAZNETBKIEI-LBPRGKRZSA-N 1 0 269.335 3.868 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)[C@H](C)c2cnccn2)cc1 ZINC000767299426 1129784725 /nfs/dbraw/zinc/78/47/25/1129784725.db2.gz PVBFHJABKJBDAS-OAHLLOKOSA-N 1 0 298.434 3.516 20 10 CHCDRO CC[C@H]([NH2+]Cc1ccc(N2CCCC2)cc1)c1ccncc1 ZINC000742372688 1129816869 /nfs/dbraw/zinc/81/68/69/1129816869.db2.gz TYJOSASAXNNVSU-IBGZPJMESA-N 1 0 295.430 3.923 20 10 CHCDRO CCSCCC[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000380448972 1129831147 /nfs/dbraw/zinc/83/11/47/1129831147.db2.gz PHSLDYPEGPUZIZ-UHFFFAOYSA-N 1 0 292.492 3.910 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2CC3CCC2CC3)c1 ZINC000380548645 1129831721 /nfs/dbraw/zinc/83/17/21/1129831721.db2.gz XFWYCTMLDOARAU-ITDKRANNSA-N 1 0 275.392 3.630 20 10 CHCDRO CCOc1ccc(C[N@H+]([C@@H](C)C(C)C)C2CC2)c(O)c1 ZINC000768137180 1129834758 /nfs/dbraw/zinc/83/47/58/1129834758.db2.gz HHIQKHSAHHICKV-ZDUSSCGKSA-N 1 0 277.408 3.800 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)C2CCCCC2)cc1F ZINC000768138489 1129835273 /nfs/dbraw/zinc/83/52/73/1129835273.db2.gz LXQXDVBQFMIUGU-UHFFFAOYSA-N 1 0 264.388 3.656 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+]2CCC[C@H]2Cc2ccccc2)c1 ZINC000768231119 1129845556 /nfs/dbraw/zinc/84/55/56/1129845556.db2.gz VGYDOGFDHZLLHF-SFHVURJKSA-N 1 0 281.399 3.908 20 10 CHCDRO COc1cccc(C[N@H+](Cc2ccccc2C)C2CC2)c1O ZINC000768252343 1129846523 /nfs/dbraw/zinc/84/65/23/1129846523.db2.gz JXHAOQGFDSQWMY-UHFFFAOYSA-N 1 0 297.398 3.874 20 10 CHCDRO CC[N@H+](CCOC)Cc1cc(-c2ccccc2)ccc1O ZINC000768253193 1129846840 /nfs/dbraw/zinc/84/68/40/1129846840.db2.gz VYKNJQDCALZZDP-UHFFFAOYSA-N 1 0 285.387 3.528 20 10 CHCDRO CCOc1ccc(C[N@H+](Cc2ccco2)C(C)C)c(O)c1 ZINC000768251118 1129847651 /nfs/dbraw/zinc/84/76/51/1129847651.db2.gz ZSILCASIYOYVHC-UHFFFAOYSA-N 1 0 289.375 3.795 20 10 CHCDRO Cc1cccc(C[N@@H+](C)Cc2cc(C)ccc2O)c1 ZINC000768262877 1129847909 /nfs/dbraw/zinc/84/79/09/1129847909.db2.gz LGRHABKJSPRSMC-UHFFFAOYSA-N 1 0 255.361 3.641 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](C)[C@H]2CCC[C@@H](C)C2)c1 ZINC000768261224 1129849178 /nfs/dbraw/zinc/84/91/78/1129849178.db2.gz AFAOMFMVSACQIQ-HIFRSBDPSA-N 1 0 277.408 3.801 20 10 CHCDRO CCOc1cccc(C[N@@H+]2CCC[C@H]2c2ccccn2)c1O ZINC000768354141 1129853425 /nfs/dbraw/zinc/85/34/25/1129853425.db2.gz FPFHJKHWDUVJJZ-INIZCTEOSA-N 1 0 298.386 3.523 20 10 CHCDRO C[C@H](Cc1ccsc1)[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000382062163 1129854937 /nfs/dbraw/zinc/85/49/37/1129854937.db2.gz 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/nfs/dbraw/zinc/86/14/60/1129861460.db2.gz BROZZSDMSNSYMK-CYBMUJFWSA-N 1 0 297.826 3.684 20 10 CHCDRO CCOc1ccc(C[N@H+]([C@H](C)C2CC2)C2CC2)c(O)c1 ZINC000768533358 1129861805 /nfs/dbraw/zinc/86/18/05/1129861805.db2.gz VTWWXQNEIFEFCN-GFCCVEGCSA-N 1 0 275.392 3.554 20 10 CHCDRO CCOc1ccc(O)c(C[N@H+](C)[C@@H](C)C(C)(C)C)c1 ZINC000768544021 1129863540 /nfs/dbraw/zinc/86/35/40/1129863540.db2.gz MJVYXTZXBWTPMO-LBPRGKRZSA-N 1 0 265.397 3.657 20 10 CHCDRO CCOc1cccc(C[NH2+]CC2CCC(F)(F)CC2)c1O ZINC000800294057 1129865287 /nfs/dbraw/zinc/86/52/87/1129865287.db2.gz VCXQGBSIRBKUDY-UHFFFAOYSA-N 1 0 299.361 3.706 20 10 CHCDRO C[N@H+](CCSC1CCCCC1)Cc1ccccc1O ZINC000800355622 1129868292 /nfs/dbraw/zinc/86/82/92/1129868292.db2.gz JKWXXFJIQXTCEZ-UHFFFAOYSA-N 1 0 279.449 3.890 20 10 CHCDRO Cc1cc2cc(NCc3ccc(O)c(O)c3)ccc2c[nH+]1 ZINC001169997285 1129877730 /nfs/dbraw/zinc/87/77/30/1129877730.db2.gz RDMGHGCUKFOBDX-UHFFFAOYSA-N 1 0 280.327 3.567 20 10 CHCDRO Cc1cccc(C[NH2+]C[C@H]2CCCC(F)(F)C2)c1O 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C[C@H]([NH2+]CC[C@@H]1C[C@@H](C)O[C@@H](C)C1)c1cc(F)ccc1O ZINC000802309030 1129991342 /nfs/dbraw/zinc/99/13/42/1129991342.db2.gz MSTRTMKDKNWWCP-CRWXNKLISA-N 1 0 295.398 3.776 20 10 CHCDRO C[C@@]1([NH2+]Cc2cc(-c3ccccc3)ccc2O)CCCOC1 ZINC000771896845 1129995708 /nfs/dbraw/zinc/99/57/08/1129995708.db2.gz RJTCENWZPWICJX-LJQANCHMSA-N 1 0 297.398 3.718 20 10 CHCDRO CCO[C@@H]1CCC[N@H+](Cc2ccc(N(CC)CC)cc2)C1 ZINC000771934513 1129996594 /nfs/dbraw/zinc/99/65/94/1129996594.db2.gz ARMXMGWRFAFCLJ-GOSISDBHSA-N 1 0 290.451 3.534 20 10 CHCDRO CCOc1ccc(O)c(C[N@@H+]2CC[C@H]2c2ccccc2)c1 ZINC000771941322 1129997592 /nfs/dbraw/zinc/99/75/92/1129997592.db2.gz ZYVHFBMNQWYDBO-KRWDZBQOSA-N 1 0 283.371 3.738 20 10 CHCDRO CCCC[N@@H+](Cc1ccccc1O)Cc1cccnc1C ZINC000802657825 1130027613 /nfs/dbraw/zinc/02/76/13/1130027613.db2.gz VGEYXORTAXWTCZ-UHFFFAOYSA-N 1 0 284.403 3.898 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)Cc2ccc(O)cc2)cc1 ZINC000785970478 1130070949 /nfs/dbraw/zinc/07/09/49/1130070949.db2.gz GZGQSNMHVPJLIS-UHFFFAOYSA-N 1 0 298.430 3.870 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)[C@@H](C)OC)c1cc(Cl)ccc1O ZINC000786576305 1130108863 /nfs/dbraw/zinc/10/88/63/1130108863.db2.gz SPHMAHKYWDHOEG-CWSCBRNRSA-N 1 0 271.788 3.510 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)[C@H](C)OC)c1cc(Cl)ccc1O ZINC000786576309 1130108937 /nfs/dbraw/zinc/10/89/37/1130108937.db2.gz SPHMAHKYWDHOEG-KWBADKCTSA-N 1 0 271.788 3.510 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)CCC(C)(C)OC)cc1 ZINC000787151624 1130132631 /nfs/dbraw/zinc/13/26/31/1130132631.db2.gz IQQYWUCKPWLXSY-UHFFFAOYSA-N 1 0 292.467 3.780 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2cnn(CC3CCC3)c2)c(O)c1 ZINC000903239389 1130134046 /nfs/dbraw/zinc/13/40/46/1130134046.db2.gz DFJXYNLEMXOBLL-AWEZNQCLSA-N 1 0 299.418 3.548 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CC[C@@H](C3CC3)O2)c(O)c1C ZINC000903250694 1130136989 /nfs/dbraw/zinc/13/69/89/1130136989.db2.gz CHDQPUMPHWUBFQ-QRTARXTBSA-N 1 0 289.419 3.617 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CC[C@@H]2CCCC[C@@H]2O)c(O)c1 ZINC000903266261 1130140211 /nfs/dbraw/zinc/14/02/11/1130140211.db2.gz XAVNXEZXDKQOSR-JYJNAYRXSA-N 1 0 291.435 3.601 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCSC(C)(C)C1)c1ccccc1O ZINC000903285404 1130146563 /nfs/dbraw/zinc/14/65/63/1130146563.db2.gz ZILPDGBUEHMVCV-RYUDHWBXSA-N 1 0 265.422 3.717 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]Cc2c(C)cc(CO)cc2C)c1 ZINC000903307842 1130149601 /nfs/dbraw/zinc/14/96/01/1130149601.db2.gz LLZWQZIXKPPIDY-HNNXBMFYSA-N 1 0 299.414 3.661 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2cncs2)c1 ZINC000903312765 1130152148 /nfs/dbraw/zinc/15/21/48/1130152148.db2.gz YOBWFOSZOPBKEN-WDEREUQCSA-N 1 0 262.378 3.569 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@@H](c2ccccn2)C2CC2)c(O)c1 ZINC000903335660 1130160394 /nfs/dbraw/zinc/16/03/94/1130160394.db2.gz RLCUJRDYZSFQNQ-FZKQIMNGSA-N 1 0 282.387 3.898 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@@H](c2ccccn2)C2CC2)c1O ZINC000903335283 1130160553 /nfs/dbraw/zinc/16/05/53/1130160553.db2.gz NJLGPUAOJORIRM-SJKOYZFVSA-N 1 0 298.386 3.598 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+][C@H](c1ccccn1)C1CC1)CC2 ZINC000903336505 1130161824 /nfs/dbraw/zinc/16/18/24/1130161824.db2.gz ZOBFKWQQPDZTQY-KDOFPFPSSA-N 1 0 280.371 3.515 20 10 CHCDRO C[C@H]([NH2+][C@H]1CCOC12CCCC2)c1ccc(N(C)C)cc1 ZINC000903382434 1130169062 /nfs/dbraw/zinc/16/90/62/1130169062.db2.gz GYIFUYFQKWKVBJ-YOEHRIQHSA-N 1 0 288.435 3.505 20 10 CHCDRO C[C@H]([NH2+][C@@H]1CCOC12CCCC2)c1ccc(N(C)C)cc1 ZINC000903382433 1130169181 /nfs/dbraw/zinc/16/91/81/1130169181.db2.gz GYIFUYFQKWKVBJ-WMLDXEAASA-N 1 0 288.435 3.505 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CC2(N(C)C)CCCC2)c(O)c1 ZINC000788504298 1130191424 /nfs/dbraw/zinc/19/14/24/1130191424.db2.gz GWQGKASZWJUMIJ-HNNXBMFYSA-N 1 0 290.451 3.534 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H](CCO)CC(C)C)c(O)c1 ZINC000788611366 1130195336 /nfs/dbraw/zinc/19/53/36/1130195336.db2.gz NAPGUYPMMZKJDE-CVEARBPZSA-N 1 0 293.451 3.704 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]CCOC2CCCC2)c(O)c1 ZINC000788572189 1130195563 /nfs/dbraw/zinc/19/55/63/1130195563.db2.gz MUDOZLJCMFTDDE-CQSZACIVSA-N 1 0 277.408 3.619 20 10 CHCDRO CC1(C)Nc2ccccc2[C@H]1[NH2+]Cc1cc(F)ccc1O ZINC000903948955 1130211615 /nfs/dbraw/zinc/21/16/15/1130211615.db2.gz WMCKAAKZUXLUGT-MRXNPFEDSA-N 1 0 286.350 3.566 20 10 CHCDRO CC[C@@H](C)C[N@H+](CC)Cc1c(O)ccc2ccncc21 ZINC000748263750 1130226461 /nfs/dbraw/zinc/22/64/61/1130226461.db2.gz XRTNSLLPVJQQJD-CYBMUJFWSA-N 1 0 272.392 3.808 20 10 CHCDRO CC1(C)CC[N@H+](Cc2cc(Cl)ccc2O)CCS1 ZINC000789763636 1130275109 /nfs/dbraw/zinc/27/51/09/1130275109.db2.gz NPEXCABFUPYAAZ-UHFFFAOYSA-N 1 0 285.840 3.763 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)cc1)CC1(OC)CCCC1 ZINC000792156380 1130432252 /nfs/dbraw/zinc/43/22/52/1130432252.db2.gz BUTIPZYKHCLULY-UHFFFAOYSA-N 1 0 290.451 3.534 20 10 CHCDRO Cc1ccnc(C[N@@H+](Cc2ccc(N(C)C)cc2)C2CC2)c1 ZINC000792206588 1130439017 /nfs/dbraw/zinc/43/90/17/1130439017.db2.gz PGMQYTIGOUVALD-UHFFFAOYSA-N 1 0 295.430 3.621 20 10 CHCDRO CN(C)c1ccc(C[N@H+](C)CC2CC2)c(C(F)(F)F)c1 ZINC000792793522 1130497202 /nfs/dbraw/zinc/49/72/02/1130497202.db2.gz QSIJFGSVOPIYKV-UHFFFAOYSA-N 1 0 286.341 3.613 20 10 CHCDRO CN(C)c1ccc(C=C2CC[NH2+]CC2)c2ccccc21 ZINC001240878754 1130499870 /nfs/dbraw/zinc/49/98/70/1130499870.db2.gz WWCMGKBRIXYPGU-UHFFFAOYSA-N 1 0 266.388 3.673 20 10 CHCDRO CC1CC([NH2+]Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000747100818 1130516813 /nfs/dbraw/zinc/51/68/13/1130516813.db2.gz VXEDKZUVQWBHEA-UHFFFAOYSA-N 1 0 267.372 3.947 20 10 CHCDRO Cc1ccc([C@H]2CC[N@H+](Cc3ccccc3O)C2)c(C)c1 ZINC000793232088 1130532731 /nfs/dbraw/zinc/53/27/31/1130532731.db2.gz IMHCFRGJINGAGF-INIZCTEOSA-N 1 0 281.399 3.999 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2CC[C@@H](C(F)(F)F)[C@@H]2C)cc1C ZINC000793231272 1130533341 /nfs/dbraw/zinc/53/33/41/1130533341.db2.gz LXVWIFMHYQCPIC-WCQYABFASA-N 1 0 287.325 3.782 20 10 CHCDRO COc1cccc(C[NH2+]CC2CCC(C)(C)CC2)c1O ZINC000383843999 1130545524 /nfs/dbraw/zinc/54/55/24/1130545524.db2.gz NHEJZIUQIPGLOY-UHFFFAOYSA-N 1 0 277.408 3.707 20 10 CHCDRO Cc1cccc(C[NH2+]CCCc2ccccc2F)c1O ZINC000793346168 1130548662 /nfs/dbraw/zinc/54/86/62/1130548662.db2.gz HPBBMZNXJYWUNH-UHFFFAOYSA-N 1 0 273.351 3.562 20 10 CHCDRO Cc1ccc(O)c(C[N@H+](CC2CC2)CC2CCC2)c1 ZINC000793390292 1130551560 /nfs/dbraw/zinc/55/15/60/1130551560.db2.gz NVRWCGDFWIYCTC-UHFFFAOYSA-N 1 0 259.393 3.713 20 10 CHCDRO COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+]Cc2ccccc2O)cc1 ZINC000793527193 1130563232 /nfs/dbraw/zinc/56/32/32/1130563232.db2.gz ONKSATVOXKOEGZ-FSPWUOQZSA-N 1 0 297.398 3.683 20 10 CHCDRO CC[C@]1(C)CC[N@H+](Cc2c(O)ccc3ccncc32)C1 ZINC000758398082 1130609497 /nfs/dbraw/zinc/60/94/97/1130609497.db2.gz TVYZJSQWNCUSGE-QGZVFWFLSA-N 1 0 270.376 3.562 20 10 CHCDRO CN(C)c1ccc(C[NH2+][C@H](c2cccnc2)C2CC2)cc1F ZINC000758633871 1130620176 /nfs/dbraw/zinc/62/01/76/1130620176.db2.gz ZBOASKCKNKILOJ-SFHVURJKSA-N 1 0 299.393 3.528 20 10 CHCDRO COc1ccc(C[NH2+][C@@H](c2cccnc2)C2CC2)cc1C ZINC000758624089 1130620209 /nfs/dbraw/zinc/62/02/09/1130620209.db2.gz NEYKGBWRLFKUGL-GOSISDBHSA-N 1 0 282.387 3.640 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)C[C@@H]2CCCCO2)cc1 ZINC000759644398 1130665771 /nfs/dbraw/zinc/66/57/71/1130665771.db2.gz SKVAWVAHNHWESO-SFHVURJKSA-N 1 0 290.451 3.534 20 10 CHCDRO CCC[N@H+](CCc1ccncc1C)Cc1ccccc1O ZINC000827959379 1130680630 /nfs/dbraw/zinc/68/06/30/1130680630.db2.gz SRRJIDFRUJVZER-UHFFFAOYSA-N 1 0 284.403 3.550 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](C(C)C)[C@H]2CCOC2)cc1C(C)C ZINC000812290152 1130682542 /nfs/dbraw/zinc/68/25/42/1130682542.db2.gz AFFJNONUZPACJT-INIZCTEOSA-N 1 0 291.435 3.823 20 10 CHCDRO CCC[N@H+](CCC(=O)CC(C)C)Cc1ccccc1O ZINC000827959079 1130684661 /nfs/dbraw/zinc/68/46/61/1130684661.db2.gz KKUIPZPGPWCENT-UHFFFAOYSA-N 1 0 277.408 3.610 20 10 CHCDRO Oc1c(C[N@@H+]2C[C@H]3[C@H](CF)[C@H]3C2)cccc1-c1ccccc1 ZINC001234999715 1130699850 /nfs/dbraw/zinc/69/98/50/1130699850.db2.gz YAVXDNORJUSSKT-NNZMDNLPSA-N 1 0 297.373 3.707 20 10 CHCDRO CC[N@H+](CCOC)Cc1cccc(-c2ccccc2)c1O ZINC001234992921 1130700530 /nfs/dbraw/zinc/70/05/30/1130700530.db2.gz TVFPSVSFHIHMDK-UHFFFAOYSA-N 1 0 285.387 3.528 20 10 CHCDRO CC(C)[N@H+](CCCO)Cc1cccc(-c2ccccc2)c1O ZINC001234996693 1130700888 /nfs/dbraw/zinc/70/08/88/1130700888.db2.gz MNCIEXCGOWWGMH-UHFFFAOYSA-N 1 0 299.414 3.652 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@](C)(OC)C2CC2)cc1 ZINC000812734654 1130709362 /nfs/dbraw/zinc/70/93/62/1130709362.db2.gz PPNPZFDGLPOCTF-KSSFIOAISA-N 1 0 290.451 3.608 20 10 CHCDRO Cc1ccccc1[C@@H]1CCC[N@@H+]1Cc1ccc(N)cc1 ZINC001235443866 1130744976 /nfs/dbraw/zinc/74/49/76/1130744976.db2.gz POSPJXZJOYCMKQ-SFHVURJKSA-N 1 0 266.388 3.914 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]Cc2cccc(C)c2C)c1 ZINC000813331676 1130761262 /nfs/dbraw/zinc/76/12/62/1130761262.db2.gz QZHGTBBLKJTGOC-CQSZACIVSA-N 1 0 285.387 3.868 20 10 CHCDRO CC1CC([N@H+](C)Cc2ccc(C(C)(C)C)cc2O)C1 ZINC001235675900 1130765448 /nfs/dbraw/zinc/76/54/48/1130765448.db2.gz LSOSCGXFBOGVLT-UHFFFAOYSA-N 1 0 261.409 3.920 20 10 CHCDRO CO[C@@H]1CC[N@H+](Cc2ccc(C(C)(C)C)cc2O)[C@@H](C)C1 ZINC001235682438 1130767339 /nfs/dbraw/zinc/76/73/39/1130767339.db2.gz WTYZOFLAIUAOEV-XJKSGUPXSA-N 1 0 291.435 3.689 20 10 CHCDRO COCC[N@H+](Cc1ccc(C(C)(C)C)cc1O)C(C)C ZINC001235681683 1130768518 /nfs/dbraw/zinc/76/85/18/1130768518.db2.gz CFYDLQCZMHHEIH-UHFFFAOYSA-N 1 0 279.424 3.547 20 10 CHCDRO Nc1ccc(C[N@@H+]2CCC[C@@H]2c2ccccc2F)cc1 ZINC001235718159 1130772832 /nfs/dbraw/zinc/77/28/32/1130772832.db2.gz FIXXJCHLMKPYNC-QGZVFWFLSA-N 1 0 270.351 3.745 20 10 CHCDRO Cc1ccoc1C[NH2+][C@@H]1C[C@H](C)c2c1c(O)ccc2F ZINC000813882617 1130793957 /nfs/dbraw/zinc/79/39/57/1130793957.db2.gz FILWEPABUYIDMC-CMPLNLGQSA-N 1 0 275.323 3.771 20 10 CHCDRO Cc1ccc(CC[NH2+][C@H](C)c2ccccc2O)c(C)c1 ZINC000783505394 1130830848 /nfs/dbraw/zinc/83/08/48/1130830848.db2.gz VTYIMXJVWFWWQE-OAHLLOKOSA-N 1 0 269.388 3.902 20 10 CHCDRO C[C@H](C[NH2+][C@@H](C)c1ccccc1O)c1cccc(F)c1 ZINC000783500446 1130831564 /nfs/dbraw/zinc/83/15/64/1130831564.db2.gz GQXDJWKGXBCCNN-OLZOCXBDSA-N 1 0 273.351 3.986 20 10 CHCDRO C[C@H]([NH2+][C@H]1C[C@H]1Cc1ccccc1)c1ccccc1O ZINC000783516092 1130832570 /nfs/dbraw/zinc/83/25/70/1130832570.db2.gz AXMLVLCJUQBXJM-LXZKKBNFSA-N 1 0 267.372 3.674 20 10 CHCDRO C[C@H]1COc2ccccc2C[N@@H+]1Cc1ccc(N(C)C)cc1 ZINC000783598517 1130842003 /nfs/dbraw/zinc/84/20/03/1130842003.db2.gz VJFDPIINCGYLKE-HNNXBMFYSA-N 1 0 296.414 3.536 20 10 CHCDRO COc1ccc(O)c(C[N@@H+]2CCCC3(CCCC3)C2)c1 ZINC000783746013 1130852296 /nfs/dbraw/zinc/85/22/96/1130852296.db2.gz UEPWYZFYPDZUFE-UHFFFAOYSA-N 1 0 275.392 3.557 20 10 CHCDRO CC(C)[C@H](CC(F)(F)F)[NH2+]Cc1cc(F)ccc1O ZINC000783741548 1130852911 /nfs/dbraw/zinc/85/29/11/1130852911.db2.gz RFQJYXFMWOAXQL-NSHDSACASA-N 1 0 279.277 3.598 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2cscn2)c1 ZINC000697819208 1130863207 /nfs/dbraw/zinc/86/32/07/1130863207.db2.gz JQASNEUQQSTBMZ-GHMZBOCLSA-N 1 0 262.378 3.569 20 10 CHCDRO CS[C@@H](C[NH2+]Cc1ccc(N(C)C)c(F)c1)C(C)(C)C ZINC000784626347 1130914017 /nfs/dbraw/zinc/91/40/17/1130914017.db2.gz QVCMKCSYUONBKT-HNNXBMFYSA-N 1 0 298.471 3.759 20 10 CHCDRO COc1cccc(C2CC[NH+](Cc3ccc(N)cc3)CC2)c1 ZINC001236322250 1130914871 /nfs/dbraw/zinc/91/48/71/1130914871.db2.gz LIJDZUZVOMLVKZ-UHFFFAOYSA-N 1 0 296.414 3.657 20 10 CHCDRO Cc1cc(C[N@@H+]2CCC[C@@H]2c2ccccn2)ccc1N(C)C ZINC000815060790 1130954554 /nfs/dbraw/zinc/95/45/54/1130954554.db2.gz SMUVVXFNEHDHLG-LJQANCHMSA-N 1 0 295.430 3.793 20 10 CHCDRO Cc1cc(C[N@@H+](C)[C@H](C)C2(C)CC2)ccc1N(C)C ZINC000815059642 1130954628 /nfs/dbraw/zinc/95/46/28/1130954628.db2.gz GAJXWLWHXMSGMG-CQSZACIVSA-N 1 0 260.425 3.681 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2cnn3ccccc23)c(O)c1C ZINC000797051874 1130956628 /nfs/dbraw/zinc/95/66/28/1130956628.db2.gz FYSWTQQMRCXMIZ-AWEZNQCLSA-N 1 0 295.386 3.508 20 10 CHCDRO Cc1cc(C[NH2+]C2(c3ccccc3F)CC2)ccc1N(C)C ZINC000815083622 1130956927 /nfs/dbraw/zinc/95/69/27/1130956927.db2.gz UTPNJKLOTDQGIC-UHFFFAOYSA-N 1 0 298.405 3.979 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cnn2ccccc12)c1ccc(C)cc1O ZINC000797058264 1130957453 /nfs/dbraw/zinc/95/74/53/1130957453.db2.gz RIKIYAJVMUBZDX-MRXNPFEDSA-N 1 0 295.386 3.589 20 10 CHCDRO Cc1noc(C)c1[C@H](C)[NH2+]Cc1ccc(N(C)C)c(C)c1 ZINC000815083366 1130957697 /nfs/dbraw/zinc/95/76/97/1130957697.db2.gz OHNHNXLSTJRMDR-LBPRGKRZSA-N 1 0 287.407 3.517 20 10 CHCDRO CCOCC(C)(C)[NH2+]Cc1ccc(N(CC)CC)c(F)c1 ZINC000815148225 1130967368 /nfs/dbraw/zinc/96/73/68/1130967368.db2.gz OSJDLINKCMBDSJ-UHFFFAOYSA-N 1 0 296.430 3.577 20 10 CHCDRO Cc1cccc(C[NH2+]Cc2c(F)cc(F)c(F)c2F)c1O ZINC000797605819 1130998469 /nfs/dbraw/zinc/99/84/69/1130998469.db2.gz WIUQUWLDCSDALM-UHFFFAOYSA-N 1 0 299.267 3.547 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@H](C)N2CCCCC2)c(O)c1 ZINC000815562408 1130999143 /nfs/dbraw/zinc/99/91/43/1130999143.db2.gz DUILUTAKPBJWPD-JKSUJKDBSA-N 1 0 290.451 3.534 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CCN2CCCC[C@H]2C)c(O)c1 ZINC000815559867 1130999678 /nfs/dbraw/zinc/99/96/78/1130999678.db2.gz RTKZCJLSRDRGJJ-CVEARBPZSA-N 1 0 290.451 3.534 20 10 CHCDRO COCCC1(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)CCC1 ZINC000815589258 1131004926 /nfs/dbraw/zinc/00/49/26/1131004926.db2.gz NHHUFTGDZPVUMF-HNNXBMFYSA-N 1 0 291.435 3.866 20 10 CHCDRO COC1CCC(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)CC1 ZINC000815586751 1131005048 /nfs/dbraw/zinc/00/50/48/1131005048.db2.gz PZTXRNAKOODJPN-FHERZECASA-N 1 0 291.435 3.865 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2cc(OCc3ccccc3)ccc2O)C1 ZINC001236780170 1131006019 /nfs/dbraw/zinc/00/60/19/1131006019.db2.gz YSDUDBUALXBZMG-OAHLLOKOSA-N 1 0 297.398 3.813 20 10 CHCDRO Cc1cc(C)c([C@H](C)[NH2+]CC2(C3CC3)CC2)c(O)c1 ZINC000815597845 1131006402 /nfs/dbraw/zinc/00/64/02/1131006402.db2.gz HMJZKENVGYNBLZ-ZDUSSCGKSA-N 1 0 259.393 3.850 20 10 CHCDRO CCc1ccc(C[N@H+](C)Cc2cccc(F)c2)c(O)c1 ZINC001236784011 1131006448 /nfs/dbraw/zinc/00/64/48/1131006448.db2.gz RBMQIXUOAMGITL-UHFFFAOYSA-N 1 0 273.351 3.726 20 10 CHCDRO CCc1ccc(C[N@H+](C)CCc2ccccc2F)c(O)c1 ZINC001236788604 1131007264 /nfs/dbraw/zinc/00/72/64/1131007264.db2.gz PTEPMJOAYUQDLJ-UHFFFAOYSA-N 1 0 287.378 3.768 20 10 CHCDRO CC1=CCC[N@H+](Cc2cc(C(C)(C)C)cc(O)c2O)C1 ZINC000797822319 1131007226 /nfs/dbraw/zinc/00/72/26/1131007226.db2.gz NTDLKFATOQFLJC-UHFFFAOYSA-N 1 0 275.392 3.547 20 10 CHCDRO CCc1ccc(C[N@H+](C)CCc2cccc(F)c2)c(O)c1 ZINC001236787295 1131007469 /nfs/dbraw/zinc/00/74/69/1131007469.db2.gz HZWNEZOLGSBHQP-UHFFFAOYSA-N 1 0 287.378 3.768 20 10 CHCDRO CCc1ccc(C[N@@H+]2CCC[C@@H]2Cc2ccccn2)c(O)c1 ZINC001236791078 1131007741 /nfs/dbraw/zinc/00/77/41/1131007741.db2.gz CWHLORMSMBBBGW-GOSISDBHSA-N 1 0 296.414 3.557 20 10 CHCDRO Cc1cc(C)c([C@@H](C)[NH2+]C[C@@H](O)C2CCCCC2)c(O)c1 ZINC000815575481 1131008069 /nfs/dbraw/zinc/00/80/69/1131008069.db2.gz SRYUWYNOONARMM-RHSMWYFYSA-N 1 0 291.435 3.601 20 10 CHCDRO c1cc(C[NH2+][C@@H]2CCCC23CCCC3)cc2c1OCC2 ZINC000815573637 1131008401 /nfs/dbraw/zinc/00/84/01/1131008401.db2.gz PAPFVTCMJKQHFE-QGZVFWFLSA-N 1 0 271.404 3.824 20 10 CHCDRO CCc1ccc(C[N@H+](C)Cc2ccc(Cl)nc2)c(O)c1 ZINC001236791557 1131009046 /nfs/dbraw/zinc/00/90/46/1131009046.db2.gz ISJJSBPXTJPMMQ-UHFFFAOYSA-N 1 0 290.794 3.635 20 10 CHCDRO COc1cc(O)c(C[N@@H+]2CCC[C@H](C)CC2)c(Cl)c1 ZINC001236797185 1131010065 /nfs/dbraw/zinc/01/00/65/1131010065.db2.gz CNXIONWOYULWCT-NSHDSACASA-N 1 0 283.799 3.676 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2cc[nH]c(=O)c2)c(O)c1C ZINC000815642449 1131013772 /nfs/dbraw/zinc/01/37/72/1131013772.db2.gz BQKUGEDVRYKAKV-CHWSQXEVSA-N 1 0 286.375 3.521 20 10 CHCDRO CC[N@H+](Cc1ccccc1)Cc1c(C)cc(OC)cc1O ZINC001236818301 1131013943 /nfs/dbraw/zinc/01/39/43/1131013943.db2.gz LPGUUDAIWIPUBE-UHFFFAOYSA-N 1 0 285.387 3.731 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1cc[nH]c(=O)c1)c1ccc(C)cc1O ZINC000815642825 1131014641 /nfs/dbraw/zinc/01/46/41/1131014641.db2.gz MXAVUIAAAIAZPP-WFASDCNBSA-N 1 0 286.375 3.603 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CCC2(OC)CCC2)cc1 ZINC000815641721 1131014762 /nfs/dbraw/zinc/01/47/62/1131014762.db2.gz GQRMSFCNPITWJD-HNNXBMFYSA-N 1 0 290.451 3.753 20 10 CHCDRO Cc1cc(Cl)cc([C@H](C)[NH2+]CC[C@@H](C)F)c1O ZINC000815645453 1131014801 /nfs/dbraw/zinc/01/48/01/1131014801.db2.gz FYWUYUWNKMITBP-ZJUUUORDSA-N 1 0 259.752 3.753 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)c1cc(Cl)ccc1O)c1cc[nH]c(=O)c1 ZINC000815642677 1131015267 /nfs/dbraw/zinc/01/52/67/1131015267.db2.gz JNIFLKSUTSFHHO-NXEZZACHSA-N 1 0 292.766 3.558 20 10 CHCDRO CC1(F)CC[NH+](Cc2cc3ccccc3cc2O)CC1 ZINC001236827196 1131016966 /nfs/dbraw/zinc/01/69/66/1131016966.db2.gz QYXFLMMKEXDGDX-UHFFFAOYSA-N 1 0 273.351 3.869 20 10 CHCDRO CC(C)C1([NH2+][C@@H](C)c2cc(Cl)ccc2O)CC1 ZINC000815647276 1131017123 /nfs/dbraw/zinc/01/71/23/1131017123.db2.gz DWGLIVHEKHMWLI-JTQLQIEISA-N 1 0 253.773 3.885 20 10 CHCDRO CC(C)c1ccc(C[NH+]2CCC(CF)CC2)c(O)c1 ZINC001237048144 1131040239 /nfs/dbraw/zinc/04/02/39/1131040239.db2.gz DKLASTYAPPGPGP-UHFFFAOYSA-N 1 0 265.372 3.697 20 10 CHCDRO CCOCc1cc(C[NH2+]C[C@@H]2CCC[C@H]2C)ccc1OC ZINC000798503889 1131040355 /nfs/dbraw/zinc/04/03/55/1131040355.db2.gz UZVLXQOWBAGTSM-ZBFHGGJFSA-N 1 0 291.435 3.758 20 10 CHCDRO CC(C)c1ccc(C[N@@H+]2CCCOC(C)(C)C2)c(O)c1 ZINC001237049496 1131040844 /nfs/dbraw/zinc/04/08/44/1131040844.db2.gz PZTXEDZTVGXLET-UHFFFAOYSA-N 1 0 277.408 3.517 20 10 CHCDRO C[N@H+](Cc1ccc(OCC(F)(F)F)cc1O)C(C)(C)C ZINC001237054882 1131042603 /nfs/dbraw/zinc/04/26/03/1131042603.db2.gz HMVOALNLGDUFQQ-UHFFFAOYSA-N 1 0 291.313 3.564 20 10 CHCDRO COCC[C@@H]1CCCC[N@@H+]1Cc1ccc(C(C)C)cc1O ZINC001237054434 1131043323 /nfs/dbraw/zinc/04/33/23/1131043323.db2.gz XYGPOBRAHPQGGU-KRWDZBQOSA-N 1 0 291.435 3.907 20 10 CHCDRO Oc1ccc(C(F)(F)F)cc1C[N@@H+]1CCC[C@@H](F)CC1 ZINC001237138093 1131054553 /nfs/dbraw/zinc/05/45/53/1131054553.db2.gz TXOZFKRTKJMNTA-GFCCVEGCSA-N 1 0 291.288 3.735 20 10 CHCDRO C[C@H]1CCCC[N@H+](Cc2c(O)ccc(F)c2Cl)C1 ZINC001237122553 1131054651 /nfs/dbraw/zinc/05/46/51/1131054651.db2.gz VYZMQHQWXPIRQT-JTQLQIEISA-N 1 0 271.763 3.807 20 10 CHCDRO CN(C)c1ccc(C[NH2+]CCc2ccc3[nH]ccc3c2)cc1 ZINC000799349661 1131082037 /nfs/dbraw/zinc/08/20/37/1131082037.db2.gz IDVAVEALPMEYQR-UHFFFAOYSA-N 1 0 293.414 3.566 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCCC[C@@H]2OC)cc1 ZINC000799351583 1131082068 /nfs/dbraw/zinc/08/20/68/1131082068.db2.gz CHHKZDNVXBFWRZ-ROUUACIJSA-N 1 0 290.451 3.580 20 10 CHCDRO CCc1cccc(C)c1C[N@H+](C)Cc1ccccc1O ZINC001237330401 1131085564 /nfs/dbraw/zinc/08/55/64/1131085564.db2.gz QUTFYZJRWNZWPZ-UHFFFAOYSA-N 1 0 269.388 3.895 20 10 CHCDRO CC[C@@H]1C[N@H+](Cc2ccc3ccccc3c2O)C[C@@H](C)O1 ZINC000816496367 1131100948 /nfs/dbraw/zinc/10/09/48/1131100948.db2.gz GZKPJUVWAMGSKV-CZUORRHYSA-N 1 0 285.387 3.545 20 10 CHCDRO COc1cccc([C@H]2CC[N@H+](Cc3c(C)cccc3O)C2)c1 ZINC001237490802 1131104343 /nfs/dbraw/zinc/10/43/43/1131104343.db2.gz BKUSCABGFWOIDS-INIZCTEOSA-N 1 0 297.398 3.699 20 10 CHCDRO C[C@@H]1C[NH+](Cc2ccc3ccccc3c2O)C[C@H]1C ZINC000816513510 1131104560 /nfs/dbraw/zinc/10/45/60/1131104560.db2.gz STNSIQLVADVBLA-CHWSQXEVSA-N 1 0 255.361 3.633 20 10 CHCDRO Cc1ccccc1C[N@@H+](C)Cc1c(C)cccc1O ZINC001237489997 1131104696 /nfs/dbraw/zinc/10/46/96/1131104696.db2.gz OOUVXLHBFQJNRY-UHFFFAOYSA-N 1 0 255.361 3.641 20 10 CHCDRO CN(C)C1(C[NH2+]Cc2ccc3ccccc3c2O)CCCC1 ZINC000816530802 1131105298 /nfs/dbraw/zinc/10/52/98/1131105298.db2.gz VHPPAVDRNHOXPQ-UHFFFAOYSA-N 1 0 298.430 3.509 20 10 CHCDRO Cc1cccc(O)c1C[N@H+](C)CCc1ccccc1F ZINC001237496504 1131106140 /nfs/dbraw/zinc/10/61/40/1131106140.db2.gz YVKGOXTXBLAQDQ-UHFFFAOYSA-N 1 0 273.351 3.514 20 10 CHCDRO CO[C@H]1CCCC[C@@H]1[NH2+][C@H]1C[C@@H](C)c2c1c(O)ccc2F ZINC000799728928 1131106108 /nfs/dbraw/zinc/10/61/08/1131106108.db2.gz GOWSUFYEIJDJSZ-HTUGSXCWSA-N 1 0 293.382 3.627 20 10 CHCDRO C[C@@H]1CC[N@H+](Cc2ccc3ccccc3c2O)CCS1 ZINC000816591478 1131108496 /nfs/dbraw/zinc/10/84/96/1131108496.db2.gz GBJFMJMAATVXCP-CYBMUJFWSA-N 1 0 287.428 3.873 20 10 CHCDRO C[C@@H]1CC[C@H]([NH2+]Cc2ccc3ccccc3c2O)C1 ZINC000816584970 1131108616 /nfs/dbraw/zinc/10/86/16/1131108616.db2.gz XWRMFUOHZNCXBV-DOMZBBRYSA-N 1 0 255.361 3.824 20 10 CHCDRO CS[C@H]1CC[C@H]([NH2+]Cc2ccc3ccccc3c2O)C1 ZINC000816554771 1131109422 /nfs/dbraw/zinc/10/94/22/1131109422.db2.gz IRVDMRNTNSRQAC-GJZGRUSLSA-N 1 0 287.428 3.919 20 10 CHCDRO CC(C)[C@H]1C[C@@H]([NH2+]Cc2ccc3ccccc3c2O)CCO1 ZINC000816560172 1131111657 /nfs/dbraw/zinc/11/16/57/1131111657.db2.gz HAYDLNSLEJPZIY-FUHWJXTLSA-N 1 0 299.414 3.839 20 10 CHCDRO CC1(C)CC[C@@H](C[NH2+]Cc2ccc3ccccc3c2O)O1 ZINC000816574678 1131112889 /nfs/dbraw/zinc/11/28/89/1131112889.db2.gz PGAQUMSJIJOGBP-HNNXBMFYSA-N 1 0 285.387 3.593 20 10 CHCDRO COc1cc(Cl)cc(C[NH2+]C2CC(C(C)(C)C)C2)c1O ZINC000816641798 1131117695 /nfs/dbraw/zinc/11/76/95/1131117695.db2.gz GUTXBCCEROECSH-UHFFFAOYSA-N 1 0 297.826 3.969 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2ccc(OCc3ccccc3)cc2O)[C@H]1C ZINC000816648269 1131119261 /nfs/dbraw/zinc/11/92/61/1131119261.db2.gz HZDLMLRHTGBFIL-CABCVRRESA-N 1 0 297.398 3.811 20 10 CHCDRO Oc1ccc(-c2ccc(F)cc2)cc1C[N@@H+]1CC[C@@H](F)C1 ZINC001237641599 1131123187 /nfs/dbraw/zinc/12/31/87/1131123187.db2.gz UMHBLRKTGVSBQW-MRXNPFEDSA-N 1 0 289.325 3.742 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+](C)C2CC(C)C2)c1O ZINC001237681394 1131126446 /nfs/dbraw/zinc/12/64/46/1131126446.db2.gz OWTUIXCJLSAXDU-UHFFFAOYSA-N 1 0 253.773 3.584 20 10 CHCDRO Cc1cc(O)c(C[N@H+](C)CC2CCC2)cc1Br ZINC001237679671 1131127040 /nfs/dbraw/zinc/12/70/40/1131127040.db2.gz UDXDJMIAXQMLPS-UHFFFAOYSA-N 1 0 298.224 3.695 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+]2CCC[C@@](C)(F)C2)c1O ZINC001237681813 1131127292 /nfs/dbraw/zinc/12/72/92/1131127292.db2.gz SXMWVBGWTFZOLS-CQSZACIVSA-N 1 0 271.763 3.678 20 10 CHCDRO Cc1cc(Cl)cc(C[N@@H+](C)C2CC(F)(F)C2)c1O ZINC001237681030 1131127305 /nfs/dbraw/zinc/12/73/05/1131127305.db2.gz KJOKTTWCFOGMOJ-UHFFFAOYSA-N 1 0 275.726 3.584 20 10 CHCDRO COc1ccc(C)c(C[N@H+](C)Cc2ccc(N(C)C)cc2)c1 ZINC001237715014 1131132575 /nfs/dbraw/zinc/13/25/75/1131132575.db2.gz HWYIIEGFSGCJGO-UHFFFAOYSA-N 1 0 298.430 3.702 20 10 CHCDRO C[C@H]1CC[N@H+](Cc2cc(F)cc(Cl)c2[O-])[C@@H](C)C1 ZINC001237798439 1131140987 /nfs/dbraw/zinc/14/09/87/1131140987.db2.gz FNHVHSHUHITTEJ-UWVGGRQHSA-N 1 0 271.763 3.805 20 10 CHCDRO C[C@@H]1CCC[N@H+](Cc2cc(F)cc(Cl)c2[O-])CC1 ZINC001237808952 1131141859 /nfs/dbraw/zinc/14/18/59/1131141859.db2.gz WUAWRJIYWFDTDH-SNVBAGLBSA-N 1 0 271.763 3.807 20 10 CHCDRO C[C@H]1CCC[N@H+](Cc2cc(F)cc(Cl)c2[O-])CC1 ZINC001237808951 1131142735 /nfs/dbraw/zinc/14/27/35/1131142735.db2.gz WUAWRJIYWFDTDH-JTQLQIEISA-N 1 0 271.763 3.807 20 10 CHCDRO CC[C@@H]1CCC[N@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001116441619 1131145232 /nfs/dbraw/zinc/14/52/32/1131145232.db2.gz KGIISMWAZIPODI-MRXNPFEDSA-N 1 0 272.436 3.909 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[N@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC001116442909 1131147208 /nfs/dbraw/zinc/14/72/08/1131147208.db2.gz WRPDXNRXZGIYHS-HDICACEKSA-N 1 0 284.447 3.909 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[N@@H+]1CCCC2(CC2)C1 ZINC001116631701 1131157614 /nfs/dbraw/zinc/15/76/14/1131157614.db2.gz JNYWUHSHBPIELA-UHFFFAOYSA-N 1 0 270.420 3.663 20 10 CHCDRO COc1cccc(C[NH2+]C2CC3(C2)CCCCC3)c1O ZINC000817409228 1131158856 /nfs/dbraw/zinc/15/88/56/1131158856.db2.gz DTIGUZWRGGQSSQ-UHFFFAOYSA-N 1 0 275.392 3.603 20 10 CHCDRO COc1ccc(C[NH2+]C[C@H]2CC23CCSCC3)cc1C ZINC000817411469 1131160959 /nfs/dbraw/zinc/16/09/59/1131160959.db2.gz RNMIHJWFOCHBAH-OAHLLOKOSA-N 1 0 291.460 3.627 20 10 CHCDRO Cc1cc(F)cc(C[N@@H+]2CCC[C@](C)(F)CC2)c1O ZINC001238058201 1131165284 /nfs/dbraw/zinc/16/52/84/1131165284.db2.gz PHDSAZZHLTUDGB-HNNXBMFYSA-N 1 0 269.335 3.554 20 10 CHCDRO Cc1ccc(CC[N@@H+](C)Cc2cc(F)cc(C)c2O)cc1 ZINC001238060674 1131166527 /nfs/dbraw/zinc/16/65/27/1131166527.db2.gz DZHYSCVCCOLIMH-UHFFFAOYSA-N 1 0 287.378 3.823 20 10 CHCDRO Cc1cc(F)cc(C[N@@H+]2CCC[C@@H](C(F)(F)F)C2)c1O ZINC001238063579 1131167122 /nfs/dbraw/zinc/16/71/22/1131167122.db2.gz YZNKUNZIBIYURX-LLVKDONJSA-N 1 0 291.288 3.614 20 10 CHCDRO CC[C@@H]([NH2+][C@H]1CCO[C@H](CC)C1)c1ccc(N(C)C)cc1 ZINC000817585729 1131174369 /nfs/dbraw/zinc/17/43/69/1131174369.db2.gz HKLDCWFRRUNCGM-CGTJXYLNSA-N 1 0 290.451 3.751 20 10 CHCDRO Cc1ccc(O)c([C@H](C)[NH2+]C[C@@H]2CC23CCSCC3)c1 ZINC000817590631 1131175095 /nfs/dbraw/zinc/17/50/95/1131175095.db2.gz ZHRRIORFUBPKSE-KBPBESRZSA-N 1 0 291.460 3.885 20 10 CHCDRO Cc1cc(C[NH2+][C@H](C)c2ccc(Cl)cc2O)cc(C)n1 ZINC000817590054 1131175300 /nfs/dbraw/zinc/17/53/00/1131175300.db2.gz SQUAZGXRACWDQZ-GFCCVEGCSA-N 1 0 290.794 3.908 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CC23CCSCC3)c(O)c1 ZINC000817589591 1131175365 /nfs/dbraw/zinc/17/53/65/1131175365.db2.gz OQAKKOIVPSPAOI-ZIAGYGMSSA-N 1 0 291.460 3.885 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2CC23CCSCC3)c1 ZINC000817590633 1131175374 /nfs/dbraw/zinc/17/53/74/1131175374.db2.gz ZHRRIORFUBPKSE-KGLIPLIRSA-N 1 0 291.460 3.885 20 10 CHCDRO C[C@H]([NH2+]CCc1ccc(N)cc1)c1ccc(Cl)cc1 ZINC000817955900 1131190030 /nfs/dbraw/zinc/19/00/30/1131190030.db2.gz KMVKCZOFHAXHOU-LBPRGKRZSA-N 1 0 274.795 3.816 20 10 CHCDRO Nc1ccc(CC[NH2+][C@H]2CCCCC23CCCC3)cc1 ZINC000817956818 1131190243 /nfs/dbraw/zinc/19/02/43/1131190243.db2.gz DKURWRMPMZVAOP-KRWDZBQOSA-N 1 0 272.436 3.904 20 10 CHCDRO CCC[C@H]([NH2+]CCc1ccc(N)cc1)c1ccccc1 ZINC000817955696 1131190641 /nfs/dbraw/zinc/19/06/41/1131190641.db2.gz FQCBRHBZBUZIJF-SFHVURJKSA-N 1 0 268.404 3.942 20 10 CHCDRO Cc1cc([C@H]([NH2+]CCc2ccc(N)cc2)C2CC2)ccc1F ZINC000817956395 1131190959 /nfs/dbraw/zinc/19/09/59/1131190959.db2.gz YEMSCMOUEXIVNE-LJQANCHMSA-N 1 0 298.405 4.000 20 10 CHCDRO C[C@H]([NH2+]CCc1ccc(N)cc1)c1cc(F)c(F)c(F)c1 ZINC000817956056 1131191301 /nfs/dbraw/zinc/19/13/01/1131191301.db2.gz PEQMXWQMBDKQEF-JTQLQIEISA-N 1 0 294.320 3.579 20 10 CHCDRO Cc1ccc([C@@H]([NH2+]CCc2ccc(N)cc2)C2CCC2)o1 ZINC000817958735 1131191354 /nfs/dbraw/zinc/19/13/54/1131191354.db2.gz XSMGYVOJTPZJGX-SFHVURJKSA-N 1 0 284.403 3.844 20 10 CHCDRO C[C@@H]([NH2+]CCc1ccc(N)cc1)c1ccc(Cl)c(F)c1 ZINC000817957793 1131191384 /nfs/dbraw/zinc/19/13/84/1131191384.db2.gz PDSDNJZQAKRRCZ-LLVKDONJSA-N 1 0 292.785 3.955 20 10 CHCDRO CC[C@@H]([NH2+]CCc1ccc(N)cc1)c1ccc(OC)cc1 ZINC000817956418 1131191674 /nfs/dbraw/zinc/19/16/74/1131191674.db2.gz YQPPUYFZBKVNIR-GOSISDBHSA-N 1 0 284.403 3.561 20 10 CHCDRO CC(C)[C@H]1CCC[C@@H]([NH2+]CCc2ccc(N)cc2)C1 ZINC000817957733 1131191683 /nfs/dbraw/zinc/19/16/83/1131191683.db2.gz OUVSABQXWQGLSA-DOTOQJQBSA-N 1 0 260.425 3.616 20 10 CHCDRO C[C@@H]([NH2+]CCC1=CC[NH2+]CC1)c1ccc2ccccc2c1O ZINC000817986853 1131195404 /nfs/dbraw/zinc/19/54/04/1131195404.db2.gz USPWNYRKEZYTMX-CQSZACIVSA-N 1 0 296.414 3.506 20 10 CHCDRO F[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(N2CCCC2)cc1 ZINC001117948711 1131205665 /nfs/dbraw/zinc/20/56/65/1131205665.db2.gz YTTURWGDQRJJDO-IAGOWNOFSA-N 1 0 276.399 3.657 20 10 CHCDRO COc1ccc(N2CC[C@H](C[NH2+][C@@H](C)C(C)(C)C)C2)cc1 ZINC000818341814 1131209650 /nfs/dbraw/zinc/20/96/50/1131209650.db2.gz GZIXXRLLLRFLQM-LSDHHAIUSA-N 1 0 290.451 3.546 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@@H]2CSc3ccccc32)cc1C ZINC000824483224 1131470628 /nfs/dbraw/zinc/47/06/28/1131470628.db2.gz JDJTYHPLSLAFSJ-OAHLLOKOSA-N 1 0 299.439 3.988 20 10 CHCDRO COc1ccc(O)c(C[NH2+][C@H](C)c2ccc(F)c(C)c2)c1 ZINC000824548141 1131476707 /nfs/dbraw/zinc/47/67/07/1131476707.db2.gz AKUAZPONRFGWQV-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO C[C@@H]1C[C@H](F)C[N@@H+]1Cc1ccc(N2CCCCC2)cc1 ZINC001138215734 1131477920 /nfs/dbraw/zinc/47/79/20/1131477920.db2.gz RRPHEELARQYUCR-ZBFHGGJFSA-N 1 0 276.399 3.609 20 10 CHCDRO CCC[N@H+](CCOC)Cc1ccc(N2CCCCC2)cc1 ZINC001138214192 1131477939 /nfs/dbraw/zinc/47/79/39/1131477939.db2.gz XEIYVOBOPYRDGW-UHFFFAOYSA-N 1 0 290.451 3.535 20 10 CHCDRO CS[C@@H]1CC[N@H+](Cc2cc(-c3ccccc3)ccc2O)C1 ZINC000824683232 1131479822 /nfs/dbraw/zinc/47/98/22/1131479822.db2.gz ANOWTNCDGUGOPK-QGZVFWFLSA-N 1 0 299.439 3.997 20 10 CHCDRO Cc1c(C[N@@H+]2CCC(F)(F)[C@@H](C)C2)c2ccccc2n1C ZINC001138252786 1131482412 /nfs/dbraw/zinc/48/24/12/1131482412.db2.gz UWZDNPNEKTUXIE-LBPRGKRZSA-N 1 0 292.373 3.964 20 10 CHCDRO Cc1c(C[N@H+]2C[C@@H](C)CC23CC3)c2ccccc2n1C ZINC001138259087 1131482980 /nfs/dbraw/zinc/48/29/80/1131482980.db2.gz AHBNRVOMXKKWET-ZDUSSCGKSA-N 1 0 268.404 3.861 20 10 CHCDRO CC(C)[C@H]1C[C@@H](C[NH2+]Cc2c(O)cccc2Cl)CCO1 ZINC000824799621 1131484787 /nfs/dbraw/zinc/48/47/87/1131484787.db2.gz PEKNGWUQPGICPG-BLLLJJGKSA-N 1 0 297.826 3.586 20 10 CHCDRO CC[C@@H]1C[C@H]1C[NH2+]Cc1ccc2ccccc2c1O ZINC000824783207 1131485812 /nfs/dbraw/zinc/48/58/12/1131485812.db2.gz HNIQYFCKGQPKNV-DOMZBBRYSA-N 1 0 255.361 3.681 20 10 CHCDRO CO[C@H]1CC[N@H+](Cc2ccc3ccccc3c2O)CC1(C)C ZINC000824820230 1131485826 /nfs/dbraw/zinc/48/58/26/1131485826.db2.gz BPBDHOKDKDZLOJ-KRWDZBQOSA-N 1 0 299.414 3.792 20 10 CHCDRO Cc1ccc2c(C[N@@H+](C)Cc3ccccc3O)c[nH]c2c1 ZINC001136976038 1131491714 /nfs/dbraw/zinc/49/17/14/1131491714.db2.gz WQCKDXHBGZROAX-UHFFFAOYSA-N 1 0 280.371 3.814 20 10 CHCDRO CN1CCCc2cc(C[N@@H+]3CCCC[C@](C)(F)C3)ccc21 ZINC001138354672 1131493592 /nfs/dbraw/zinc/49/35/92/1131493592.db2.gz POFCKUFIKLUOQS-SFHVURJKSA-N 1 0 290.426 3.783 20 10 CHCDRO CN1CCCc2cc(C[N@H+](C)Cc3cccs3)ccc21 ZINC001138358591 1131494215 /nfs/dbraw/zinc/49/42/15/1131494215.db2.gz VSENGBIASJJKMV-UHFFFAOYSA-N 1 0 286.444 3.763 20 10 CHCDRO CN1CCCc2cc(C[NH+]3Cc4ccccc4C3)ccc21 ZINC001138354215 1131494244 /nfs/dbraw/zinc/49/42/44/1131494244.db2.gz BBJDVENRYSZYOT-UHFFFAOYSA-N 1 0 278.399 3.585 20 10 CHCDRO CN1CCCc2cc(C[N@@H+]3CCC[C@H]4CCC[C@H]43)ccc21 ZINC001138355739 1131494273 /nfs/dbraw/zinc/49/42/73/1131494273.db2.gz BDCPTXRWNAKFBF-VQIMIIECSA-N 1 0 284.447 3.834 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)C2CCCC2)c(OC)c1 ZINC001138389339 1131496868 /nfs/dbraw/zinc/49/68/68/1131496868.db2.gz MKMPMPOFIFDBHK-UHFFFAOYSA-N 1 0 290.451 3.916 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)Cc1c(F)cccc1OC ZINC001138386946 1131496888 /nfs/dbraw/zinc/49/68/88/1131496888.db2.gz RLKZFVLFLWZRKC-UHFFFAOYSA-N 1 0 289.350 3.562 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CCC[C@]2(CCSC2)C1 ZINC000825215277 1131502196 /nfs/dbraw/zinc/50/21/96/1131502196.db2.gz KSPJWEKQMVIGLW-HNNXBMFYSA-N 1 0 297.851 3.765 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCC[C@]3(CCSC3)C2)cc1C ZINC000825215042 1131502604 /nfs/dbraw/zinc/50/26/04/1131502604.db2.gz DMIANLVVMVYFHQ-KRWDZBQOSA-N 1 0 291.460 3.728 20 10 CHCDRO Cc1csc([C@@H](C)[NH2+]Cc2cc(Cl)c(C)cc2O)n1 ZINC000825197326 1131503499 /nfs/dbraw/zinc/50/34/99/1131503499.db2.gz KNCADRUDBYQMKI-SNVBAGLBSA-N 1 0 296.823 3.970 20 10 CHCDRO Cc1cc(O)c(C[N@@H+](C)[C@@H](C)c2ccccn2)cc1Cl ZINC000825450498 1131511921 /nfs/dbraw/zinc/51/19/21/1131511921.db2.gz HOFFDIQYYDMGKV-LBPRGKRZSA-N 1 0 290.794 3.942 20 10 CHCDRO Cc1c(F)cc(F)cc1C[N@H+](C)Cc1ccccc1O ZINC001143767748 1131530499 /nfs/dbraw/zinc/53/04/99/1131530499.db2.gz KKBLQZOXEXTOCY-UHFFFAOYSA-N 1 0 277.314 3.611 20 10 CHCDRO CC(C)Oc1cccc(C[N@@H+]2CCc3cccc(O)c3C2)c1 ZINC001138985894 1131568416 /nfs/dbraw/zinc/56/84/16/1131568416.db2.gz PAEURCLYIWDNLX-UHFFFAOYSA-N 1 0 297.398 3.738 20 10 CHCDRO Cc1cc(O)c(C[N@@H+]2CCS[C@@H]3CCCC[C@@H]32)cc1C ZINC000753106442 1131575090 /nfs/dbraw/zinc/57/50/90/1131575090.db2.gz QVMYMWYFQRLHLH-DOTOQJQBSA-N 1 0 291.460 3.869 20 10 CHCDRO C[N@H+](Cc1ccc2cccnc2c1)Cc1ccccc1O ZINC001139170482 1131591090 /nfs/dbraw/zinc/59/10/90/1131591090.db2.gz FDAMXJKUDDLXSB-UHFFFAOYSA-N 1 0 278.355 3.572 20 10 CHCDRO CC[C@@H]([NH2+][C@@H]1CNc2ccccc2C1)c1ccc(C)cc1O ZINC000844921624 1131608083 /nfs/dbraw/zinc/60/80/83/1131608083.db2.gz QQXSGPPSTGKUPS-DOTOQJQBSA-N 1 0 296.414 3.778 20 10 CHCDRO CCc1cccc(C[N@@H+]2CCc3cccc(O)c3C2)c1 ZINC001144326601 1131618789 /nfs/dbraw/zinc/61/87/89/1131618789.db2.gz IKAKUSJTXYMAHH-UHFFFAOYSA-N 1 0 267.372 3.513 20 10 CHCDRO Cc1cc(C[N@H+]2C[C@H]3[C@H](CCC3(F)F)C2)ccc1N(C)C ZINC001139671772 1131626541 /nfs/dbraw/zinc/62/65/41/1131626541.db2.gz ZZYZUZZWROPJBI-CABCVRRESA-N 1 0 294.389 3.538 20 10 CHCDRO Cc1cc(C[N@@H+]2CCCC3(CCC3)C2)ccc1N(C)C ZINC001139673966 1131628213 /nfs/dbraw/zinc/62/82/13/1131628213.db2.gz OOAFFIGCPFNOHD-UHFFFAOYSA-N 1 0 272.436 3.827 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)Cc1cncc2ccccc21 ZINC001139896837 1131649317 /nfs/dbraw/zinc/64/93/17/1131649317.db2.gz MTGYOVCFLVIEJF-UHFFFAOYSA-N 1 0 292.382 3.963 20 10 CHCDRO C[N@H+](Cc1cc(F)ccc1O)Cc1cccc2cccnc21 ZINC001140055055 1131660223 /nfs/dbraw/zinc/66/02/23/1131660223.db2.gz GCZNBMZTDHLEKI-UHFFFAOYSA-N 1 0 296.345 3.712 20 10 CHCDRO CCC[N@H+](Cc1cc2cnccc2o1)Cc1ccccc1O ZINC000845906452 1131668925 /nfs/dbraw/zinc/66/89/25/1131668925.db2.gz LIIXVOAEAGVXEV-UHFFFAOYSA-N 1 0 296.370 3.946 20 10 CHCDRO Cc1ccc(C)c(C[NH+]2CCC(OC3CCC3)CC2)c1O ZINC001140178227 1131672936 /nfs/dbraw/zinc/67/29/36/1131672936.db2.gz DEDXHPCAPCPPTR-UHFFFAOYSA-N 1 0 289.419 3.543 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCCC(F)(F)[C@@H](F)C2)c1O ZINC001140178643 1131673496 /nfs/dbraw/zinc/67/34/96/1131673496.db2.gz RZICUHXCAKRQGA-ZDUSSCGKSA-N 1 0 287.325 3.578 20 10 CHCDRO Cc1ccc(C)c(C[N@@H+]2CCC[C@@H]2Cc2ccccn2)c1O ZINC001140182496 1131673526 /nfs/dbraw/zinc/67/35/26/1131673526.db2.gz SJVDYPKSWFVWSH-QGZVFWFLSA-N 1 0 296.414 3.611 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2CCCC23CCC3)c1 ZINC000845970675 1131674184 /nfs/dbraw/zinc/67/41/84/1131674184.db2.gz BMIKBCHLVOOPMD-LRDDRELGSA-N 1 0 275.392 3.774 20 10 CHCDRO COC[C@@H](CC(C)(C)C)[NH2+][C@@H](C)c1cc(OC)ccc1O ZINC000845970842 1131674208 /nfs/dbraw/zinc/67/42/08/1131674208.db2.gz DBEZWYLXMNTUDI-QWHCGFSZSA-N 1 0 295.423 3.503 20 10 CHCDRO Cc1cc(F)c(C[NH2+][C@@H](C)c2ccccc2O)c(F)c1 ZINC000845989366 1131674422 /nfs/dbraw/zinc/67/44/22/1131674422.db2.gz GPJJUCVHSFVRKY-NSHDSACASA-N 1 0 277.314 3.830 20 10 CHCDRO CN(C)c1ccc(/C=C\C[NH2+]C2(C3CCC3)CC2)cc1 ZINC000846056712 1131678866 /nfs/dbraw/zinc/67/88/66/1131678866.db2.gz YERQXLFTLADLLY-PLNGDYQASA-N 1 0 270.420 3.688 20 10 CHCDRO CN(C)c1ccc(C[NH2+]CC[C@]2(C)C[C@@]2(F)Cl)cc1 ZINC000846036450 1131681785 /nfs/dbraw/zinc/68/17/85/1131681785.db2.gz LNWZMZFNQXYYCQ-CABCVRRESA-N 1 0 284.806 3.547 20 10 CHCDRO CC(C)n1cc([C@H](C)[NH2+][C@@H]2CCc3cccc(O)c32)cn1 ZINC000834581915 1131684807 /nfs/dbraw/zinc/68/48/07/1131684807.db2.gz QYKSPHGAFFMKNU-SWLSCSKDSA-N 1 0 285.391 3.508 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCC[C@]3(CC3(F)F)C2)cc1F ZINC000846107850 1131686316 /nfs/dbraw/zinc/68/63/16/1131686316.db2.gz LCPGCYMOBHORKH-HNNXBMFYSA-N 1 0 298.352 3.513 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+]CCC[C@H]1CC1(Cl)Cl ZINC000846110830 1131687255 /nfs/dbraw/zinc/68/72/55/1131687255.db2.gz OLWAGNULIMAAFN-JTQLQIEISA-N 1 0 292.181 3.595 20 10 CHCDRO COc1cccc2c1CC[C@@H]2[NH2+][C@@H]1CCc2cccc(O)c21 ZINC000834625161 1131688330 /nfs/dbraw/zinc/68/83/30/1131688330.db2.gz UUPOPYUCSXIRLM-JKSUJKDBSA-N 1 0 295.382 3.665 20 10 CHCDRO CC(C)c1csc(C[NH2+][C@@H]2CCc3cccc(O)c32)n1 ZINC000834624877 1131688476 /nfs/dbraw/zinc/68/84/76/1131688476.db2.gz RDSSUCUOOPWGEJ-GFCCVEGCSA-N 1 0 288.416 3.749 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000846103844 1131690128 /nfs/dbraw/zinc/69/01/28/1131690128.db2.gz ACTZHHBFJHXHIP-INIZCTEOSA-N 1 0 294.389 3.682 20 10 CHCDRO CCSCC[C@H](C)[NH2+][C@@H](C)c1cccc(OC)c1O ZINC000846148916 1131691272 /nfs/dbraw/zinc/69/12/72/1131691272.db2.gz ULNNQMVXBPIHGN-RYUDHWBXSA-N 1 0 283.437 3.583 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]CC2(C)CCCC2)c1O ZINC000846150811 1131691303 /nfs/dbraw/zinc/69/13/03/1131691303.db2.gz PHWDKZWJEZUBQH-GFCCVEGCSA-N 1 0 263.381 3.632 20 10 CHCDRO CCCC1(C[NH2+][C@@H](C)c2cccc(OC)c2O)CC1 ZINC000846153124 1131692168 /nfs/dbraw/zinc/69/21/68/1131692168.db2.gz GCLVGLMWNHJBRO-LBPRGKRZSA-N 1 0 263.381 3.632 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@H]2CC[C@H](C)CC2)c1O ZINC000846150446 1131692427 /nfs/dbraw/zinc/69/24/27/1131692427.db2.gz HNJYBMFKQJQPRH-JHJVBQTASA-N 1 0 263.381 3.630 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@@H](C)CCC2CC2)c1O ZINC000846163854 1131692779 /nfs/dbraw/zinc/69/27/79/1131692779.db2.gz MEJGNSURTLSMJA-NWDGAFQWSA-N 1 0 263.381 3.630 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+][C@@H](C)CCC(C)C)c1O ZINC000846136187 1131693671 /nfs/dbraw/zinc/69/36/71/1131693671.db2.gz HGGOUBIUXKUPJC-QWHCGFSZSA-N 1 0 265.397 3.876 20 10 CHCDRO COc1cccc([C@H](C)Nc2cc3c(c[nH+]2)CCCC3)c1O ZINC000846172638 1131693907 /nfs/dbraw/zinc/69/39/07/1131693907.db2.gz ZPZOLGNGFATDKN-LBPRGKRZSA-N 1 0 298.386 3.848 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]C[C@@H]2C[C@H]2c2ccccc2)c1O ZINC000846169408 1131694051 /nfs/dbraw/zinc/69/40/51/1131694051.db2.gz HLQLCSBZRYHPFF-QRTARXTBSA-N 1 0 297.398 3.855 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]C[C@H]2CCCCC2(F)F)c1O ZINC000846169354 1131694098 /nfs/dbraw/zinc/69/40/98/1131694098.db2.gz HEONUXDPSVWXKC-NWDGAFQWSA-N 1 0 299.361 3.877 20 10 CHCDRO CCOc1cccc(CC[NH2+][C@@H]2CCc3cccc(O)c32)c1 ZINC000834688673 1131694622 /nfs/dbraw/zinc/69/46/22/1131694622.db2.gz DBAQGLYQCYMPTJ-QGZVFWFLSA-N 1 0 297.398 3.611 20 10 CHCDRO CCc1cccc(C[NH2+][C@@H]2CCc3cccc(O)c32)c1 ZINC000846209733 1131695633 /nfs/dbraw/zinc/69/56/33/1131695633.db2.gz TWAGBOYAPHQOMY-MRXNPFEDSA-N 1 0 267.372 3.732 20 10 CHCDRO CC[C@H]([NH2+]CCC1(CO)CCC1)c1cc(Cl)ccc1O ZINC000846209196 1131695939 /nfs/dbraw/zinc/69/59/39/1131695939.db2.gz BTFDMZAPKWCCRN-AWEZNQCLSA-N 1 0 297.826 3.639 20 10 CHCDRO CC[C@@H]([NH2+][C@H](C)COCC1CC1)c1ccc(C)cc1O ZINC000846206214 1131695967 /nfs/dbraw/zinc/69/59/67/1131695967.db2.gz XPYFCHSLIYCXFD-CZUORRHYSA-N 1 0 277.408 3.556 20 10 CHCDRO COc1cccc([C@@H](C)[NH2+]Cc2ccc(F)c(F)c2)c1O ZINC000846147650 1131696134 /nfs/dbraw/zinc/69/61/34/1131696134.db2.gz WTYNVFJPWTYARW-SNVBAGLBSA-N 1 0 293.313 3.530 20 10 CHCDRO CC[C@@H]([NH2+][C@@H](C)COCC1CC1)c1ccc(N(C)C)cc1 ZINC000846202393 1131700042 /nfs/dbraw/zinc/70/00/42/1131700042.db2.gz CHLVUHNYCYCSCA-KBXCAEBGSA-N 1 0 290.451 3.608 20 10 CHCDRO C[C@@]1(F)CCCC[N@H+](Cc2c(O)cccc2Cl)C1 ZINC001140337872 1131702373 /nfs/dbraw/zinc/70/23/73/1131702373.db2.gz KFWGHIWJZVTFPP-CQSZACIVSA-N 1 0 271.763 3.760 20 10 CHCDRO Oc1cccc(Cl)c1C[N@@H+]1CC[C@@H](F)C(F)(F)CC1 ZINC001140338114 1131702497 /nfs/dbraw/zinc/70/24/97/1131702497.db2.gz VRIICMFNYKICFY-GFCCVEGCSA-N 1 0 293.716 3.615 20 10 CHCDRO C[N@@H+](Cc1c(O)cccc1Cl)C[C@@H]1CC1(C)C ZINC001140341581 1131703135 /nfs/dbraw/zinc/70/31/35/1131703135.db2.gz XHILSCMVDPYOPX-JTQLQIEISA-N 1 0 253.773 3.524 20 10 CHCDRO CC[C@@H]([NH2+]CC1(OC)CCCC1)c1ccc(C)cc1O ZINC000834815408 1131707326 /nfs/dbraw/zinc/70/73/26/1131707326.db2.gz VKIRDWTXJMTNHA-OAHLLOKOSA-N 1 0 277.408 3.701 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]CCCC2CCOCC2)c(O)c1C ZINC000834819586 1131707669 /nfs/dbraw/zinc/70/76/69/1131707669.db2.gz YBDVYEFZKUEIEG-HNNXBMFYSA-N 1 0 291.435 3.866 20 10 CHCDRO CC[C@H](C)[C@@H](C[NH2+][C@H](C)c1c(C)cc(C)cc1O)OC ZINC000834860610 1131713409 /nfs/dbraw/zinc/71/34/09/1131713409.db2.gz SUTKXOWLBPDRRC-JGGQBBKZSA-N 1 0 279.424 3.721 20 10 CHCDRO CO[C@@](C)(C[NH2+][C@H]1CCc2cccc(O)c21)c1ccccc1 ZINC000834885985 1131718511 /nfs/dbraw/zinc/71/85/11/1131718511.db2.gz ZCRXIGBQSLMVPI-LPHOPBHVSA-N 1 0 297.398 3.531 20 10 CHCDRO CC[C@@H]([NH2+]CC1(CF)CCOCC1)c1ccc(C)cc1O ZINC000834884960 1131718699 /nfs/dbraw/zinc/71/86/99/1131718699.db2.gz FMLIJMHOIMVNCE-OAHLLOKOSA-N 1 0 295.398 3.508 20 10 CHCDRO Cc1ccc(F)c(CC[NH2+][C@@H]2CCc3cccc(O)c32)c1 ZINC000834895105 1131721959 /nfs/dbraw/zinc/72/19/59/1131721959.db2.gz YTLZAAMYDYKEBU-MRXNPFEDSA-N 1 0 285.362 3.659 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+][C@H]2C[C@@H](C)n3ccnc32)c(O)c1C ZINC000834896494 1131722327 /nfs/dbraw/zinc/72/23/27/1131722327.db2.gz WRWXYOVYEQFNDR-ZLDLUXBVSA-N 1 0 285.391 3.562 20 10 CHCDRO Oc1cccc2c1[C@H]([NH2+]C1(Cc3ccc(F)cc3)CC1)CC2 ZINC000834897889 1131722753 /nfs/dbraw/zinc/72/27/53/1131722753.db2.gz WSMGSRGHERWYII-MRXNPFEDSA-N 1 0 297.373 3.884 20 10 CHCDRO C[C@H]([NH2+]C1(Cc2ccc(F)cc2)CC1)c1ccccc1O ZINC000834897896 1131723437 /nfs/dbraw/zinc/72/34/37/1131723437.db2.gz WVPOGGLXDXPLOD-ZDUSSCGKSA-N 1 0 285.362 3.957 20 10 CHCDRO CCc1ncc(C[NH2+][C@H](C)c2cc(Cl)cc(C)c2O)o1 ZINC000834900911 1131725673 /nfs/dbraw/zinc/72/56/73/1131725673.db2.gz TVFOOUWLTPOSEZ-SNVBAGLBSA-N 1 0 294.782 3.755 20 10 CHCDRO CCc1ncc(C[NH2+][C@@H](CC)c2ccc(N(C)C)cc2)o1 ZINC000834901097 1131726125 /nfs/dbraw/zinc/72/61/25/1131726125.db2.gz WUJARTRKRRJUKF-INIZCTEOSA-N 1 0 287.407 3.544 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]CC(C)(C)C(C)(C)O)cc1 ZINC000834902961 1131726476 /nfs/dbraw/zinc/72/64/76/1131726476.db2.gz MGDDLXMOZUXLIR-AWEZNQCLSA-N 1 0 292.467 3.590 20 10 CHCDRO CC[C@@H]([NH2+]Cc1cnc(C)cc1C)c1ccc(C)cc1O ZINC000834902105 1131726707 /nfs/dbraw/zinc/72/67/07/1131726707.db2.gz DURSLBFCLLBMMD-QGZVFWFLSA-N 1 0 284.403 3.953 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2C[C@H]2C2CC2)c(O)c1C ZINC000834906220 1131728492 /nfs/dbraw/zinc/72/84/92/1131728492.db2.gz NRZBYBSFCSOVRO-NOLJZWGESA-N 1 0 259.393 3.706 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CC(C)(C)C2(O)CCCC2)c1 ZINC000834905377 1131728551 /nfs/dbraw/zinc/72/85/51/1131728551.db2.gz GMXOPNUTQDVCJO-CQSZACIVSA-N 1 0 291.435 3.683 20 10 CHCDRO CCO[C@@H]1CCCC[C@H]1[NH2+][C@H](C)c1cc(F)ccc1O ZINC000834910619 1131729902 /nfs/dbraw/zinc/72/99/02/1131729902.db2.gz FIVYMZSMPWHUEC-DJSGYFEHSA-N 1 0 281.371 3.530 20 10 CHCDRO CCC(C)(C)OCC[NH2+][C@@H](C)c1c(C)cc(C)cc1O ZINC000834911746 1131732233 /nfs/dbraw/zinc/73/22/33/1131732233.db2.gz AMFOATAYHKVJNW-AWEZNQCLSA-N 1 0 279.424 3.865 20 10 CHCDRO Oc1cc(Cl)ccc1C[N@@H+]1CCCC(F)(F)CC1 ZINC001140461605 1131746969 /nfs/dbraw/zinc/74/69/69/1131746969.db2.gz NGSVXDAQWLWZBS-UHFFFAOYSA-N 1 0 275.726 3.667 20 10 CHCDRO C[C@H]1CCCC[N@H+](Cc2ccc(Cl)cc2O)C1 ZINC001140461632 1131749263 /nfs/dbraw/zinc/74/92/63/1131749263.db2.gz OFVVENBTEZXYMC-NSHDSACASA-N 1 0 253.773 3.668 20 10 CHCDRO CC(C)[N@@H+](Cc1ccc(Cl)cc1[O-])CC1CC1 ZINC001140466942 1131752781 /nfs/dbraw/zinc/75/27/81/1131752781.db2.gz NANBEFVHKAIWQS-UHFFFAOYSA-N 1 0 253.773 3.666 20 10 CHCDRO CN(C)c1ccc(/C=C\C[N@@H+]2CCC[C@H]2c2ccc[nH]2)cc1 ZINC000835025438 1131759420 /nfs/dbraw/zinc/75/94/20/1131759420.db2.gz VJSMIJQBRIRMEH-UTSMFGRCSA-N 1 0 295.430 3.931 20 10 CHCDRO CC(C)OCCC[N@H+](C)C/C=C\c1ccc(N(C)C)cc1 ZINC000835025912 1131759674 /nfs/dbraw/zinc/75/96/74/1131759674.db2.gz NJLQZACAVUVHPB-VURMDHGXSA-N 1 0 290.451 3.513 20 10 CHCDRO COc1ccc(C[NH2+]C/C=C\c2ccc(N(C)C)cc2)cc1 ZINC000835033336 1131761495 /nfs/dbraw/zinc/76/14/95/1131761495.db2.gz SKJNAUPCXLQWOL-PLNGDYQASA-N 1 0 296.414 3.564 20 10 CHCDRO CSCCCCC[NH2+]C/C=C\c1ccc(N(C)C)cc1 ZINC000835047318 1131763981 /nfs/dbraw/zinc/76/39/81/1131763981.db2.gz QRJMBWLKGURZFU-FPLPWBNLSA-N 1 0 292.492 3.889 20 10 CHCDRO CC(C)OCCCC[NH2+]C/C=C/c1ccc(N(C)C)cc1 ZINC000835048294 1131765118 /nfs/dbraw/zinc/76/51/18/1131765118.db2.gz PTQOTCSLQCITON-BQYQJAHWSA-N 1 0 290.451 3.561 20 10 CHCDRO C[C@@H](c1cccnc1)[N@H+](C)C/C=C\c1ccc(N(C)C)cc1 ZINC000835048546 1131765412 /nfs/dbraw/zinc/76/54/12/1131765412.db2.gz UJMVUKKRJVRYRS-WLMCBFPDSA-N 1 0 295.430 3.854 20 10 CHCDRO Oc1ccc(Cl)cc1C[NH2+]CCC1CC(F)(F)C1 ZINC000835060014 1131767005 /nfs/dbraw/zinc/76/70/05/1131767005.db2.gz GKDFJAMSZCGQIE-UHFFFAOYSA-N 1 0 275.726 3.571 20 10 CHCDRO C[C@@H]([NH2+]C1CCC1)c1ccc(N2CCCCC2)cc1 ZINC000772959721 1131772704 /nfs/dbraw/zinc/77/27/04/1131772704.db2.gz MKWKCZYHRCHOLO-CQSZACIVSA-N 1 0 258.409 3.880 20 10 CHCDRO Cc1ccc(C[NH2+]Cc2cccc(C(F)F)c2)c(O)c1 ZINC001330639996 1131774771 /nfs/dbraw/zinc/77/47/71/1131774771.db2.gz CALYNJGUHACKMH-UHFFFAOYSA-N 1 0 277.314 3.928 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2c(F)cncc2F)c(O)c1 ZINC000797128374 1131796865 /nfs/dbraw/zinc/79/68/65/1131796865.db2.gz RGBCGKXAMSIIKW-GHMZBOCLSA-N 1 0 292.329 3.786 20 10 CHCDRO CC[N@H+](Cc1ccc(F)cc1)Cc1cc(C)ccc1O ZINC001140622914 1131831205 /nfs/dbraw/zinc/83/12/05/1131831205.db2.gz HIDVKZYFSVRSTL-UHFFFAOYSA-N 1 0 273.351 3.862 20 10 CHCDRO Cc1ccc(O)c(C[N@@H+](C)Cc2cccc3cccnc32)c1 ZINC001140621130 1131831662 /nfs/dbraw/zinc/83/16/62/1131831662.db2.gz QADYBAFWSFAJAA-UHFFFAOYSA-N 1 0 292.382 3.881 20 10 CHCDRO Cc1ccncc1[C@@H](C)[NH2+]Cc1ccc(N(C)C)c(C)c1 ZINC000772996749 1131877886 /nfs/dbraw/zinc/87/78/86/1131877886.db2.gz GZBXWZWKDMMWRB-OAHLLOKOSA-N 1 0 283.419 3.615 20 10 CHCDRO COc1ccc(O)c([C@@H](C)[NH2+]C[C@@H]2CCCC(F)(F)C2)c1 ZINC000282786025 1131900257 /nfs/dbraw/zinc/90/02/57/1131900257.db2.gz PVJIKVVCQOGHQM-VXGBXAGGSA-N 1 0 299.361 3.877 20 10 CHCDRO Cc1c(O)ccc(C[NH+]2CCC(c3ccccc3)CC2)c1O ZINC001140743873 1131905021 /nfs/dbraw/zinc/90/50/21/1131905021.db2.gz CKYDQQDGJLNAMW-UHFFFAOYSA-N 1 0 297.398 3.786 20 10 CHCDRO Cc1c(O)ccc(C[N@@H+]2CCC[C@H]3CCCC[C@H]32)c1O ZINC001140749190 1131906992 /nfs/dbraw/zinc/90/69/92/1131906992.db2.gz QUCDOJHEZKCANS-UKRRQHHQSA-N 1 0 275.392 3.561 20 10 CHCDRO CCC1CC[NH+](Cc2ccc(N(CC)CC)cc2O)CC1 ZINC001140850541 1131945987 /nfs/dbraw/zinc/94/59/87/1131945987.db2.gz ORZNHVNCSRUVEA-UHFFFAOYSA-N 1 0 290.451 3.860 20 10 CHCDRO CCN(CC)c1ccc(C[N@H+](C)Cc2ccccc2)c(O)c1 ZINC001140852005 1131947827 /nfs/dbraw/zinc/94/78/27/1131947827.db2.gz YDUBITRCPDGMNR-UHFFFAOYSA-N 1 0 298.430 3.870 20 10 CHCDRO Oc1ccccc1C[NH2+]C[C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000712975638 1131959926 /nfs/dbraw/zinc/95/99/26/1131959926.db2.gz WIUOUKNTUFDRDB-DGCLKSJQSA-N 1 0 287.325 3.851 20 10 CHCDRO Cc1ccc(C[N@@H+]2CC[C@@H](Cc3ccccc3)C2)c(O)c1 ZINC001140949651 1131969307 /nfs/dbraw/zinc/96/93/07/1131969307.db2.gz HCFCPCLDCGSFGS-KRWDZBQOSA-N 1 0 281.399 3.765 20 10 CHCDRO Cc1ccc(C[N@@H+]2CC[C@@H](Oc3ccccc3C)C2)c(O)c1 ZINC001140949820 1131969731 /nfs/dbraw/zinc/96/97/31/1131969731.db2.gz MIMLCPGBCAPLGH-QGZVFWFLSA-N 1 0 297.398 3.662 20 10 CHCDRO Cc1ccc(C[N@@H+]2CC[C@H](c3cccc(F)c3)C2)c(O)c1 ZINC001140950978 1131972274 /nfs/dbraw/zinc/97/22/74/1131972274.db2.gz RONZBACKZMTSFY-HNNXBMFYSA-N 1 0 285.362 3.829 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCc2cccc(F)c2)c1 ZINC000036778521 1131974953 /nfs/dbraw/zinc/97/49/53/1131974953.db2.gz NIGMUMFOZWKUBS-CYBMUJFWSA-N 1 0 273.351 3.733 20 10 CHCDRO COc1ccc(C[NH2+][C@H]2CCc3c(F)cccc3C2)cc1C ZINC001171411718 1131979048 /nfs/dbraw/zinc/97/90/48/1131979048.db2.gz MRPIKRPKCZEWBP-INIZCTEOSA-N 1 0 299.389 3.790 20 10 CHCDRO CCC[C@H]1CCCC[N@@H+]1Cc1c(O)cc(OC)cc1OC ZINC001141028380 1131989690 /nfs/dbraw/zinc/98/96/90/1131989690.db2.gz MPAWEMOPRATVNL-ZDUSSCGKSA-N 1 0 293.407 3.564 20 10 CHCDRO c1c(C[N@@H+]2CCC3(CCC3)C2)cc2c3c1CCCN3CCC2 ZINC001141078329 1132007066 /nfs/dbraw/zinc/00/70/66/1132007066.db2.gz RZVZUQPPBPQJOA-UHFFFAOYSA-N 1 0 296.458 3.761 20 10 CHCDRO CCCCCC[C@H](C)[NH2+]Cc1cccc(OC)c1O ZINC000037139042 1132007213 /nfs/dbraw/zinc/00/72/13/1132007213.db2.gz RAMLFTVKMRLUNA-ZDUSSCGKSA-N 1 0 265.397 3.849 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(C)nc1Cl)c1ccccc1O ZINC000838912161 1132157822 /nfs/dbraw/zinc/15/78/22/1132157822.db2.gz DBBYNFDOMLKDKH-CQSZACIVSA-N 1 0 290.794 3.990 20 10 CHCDRO CCOc1ccc(C[NH+]2CC3(C2)CCCCC3)c(O)c1 ZINC000839132306 1132182743 /nfs/dbraw/zinc/18/27/43/1132182743.db2.gz MKNCVAHJRCRDKR-UHFFFAOYSA-N 1 0 275.392 3.557 20 10 CHCDRO Oc1ccc(-c2ccccc2)cc1C[N@@H+]1C[C@@H]2C[C@H]1CS2 ZINC000839193920 1132190105 /nfs/dbraw/zinc/19/01/05/1132190105.db2.gz ZAQUFGRPHNCNOC-IRXDYDNUSA-N 1 0 297.423 3.749 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)[C@@H](C)CCOCC(C)C ZINC001172485278 1132230770 /nfs/dbraw/zinc/23/07/70/1132230770.db2.gz VRAQFZFIQGKPSE-HNNXBMFYSA-N 1 0 279.424 3.665 20 10 CHCDRO Cc1cc(C)c(O)c(C[N@@H+]2CCC[C@@]3(CCSC3)C2)c1 ZINC000840142307 1132247004 /nfs/dbraw/zinc/24/70/04/1132247004.db2.gz FRQPCQNQDVRDFQ-QGZVFWFLSA-N 1 0 291.460 3.728 20 10 CHCDRO CO[C@H]1CC[N@H+](Cc2cc(C(C)C)c(C)cc2O)C[C@H]1C ZINC000840127113 1132247718 /nfs/dbraw/zinc/24/77/18/1132247718.db2.gz RLPJDUTWEWZWHZ-KDOFPFPSSA-N 1 0 291.435 3.681 20 10 CHCDRO Oc1cccc(C[NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)c1O ZINC001172554782 1132265135 /nfs/dbraw/zinc/26/51/35/1132265135.db2.gz DNKGLBMOBLLUFT-GDBMZVCRSA-N 1 0 283.371 3.524 20 10 CHCDRO C[N@@H+]1CC[C@H](Oc2ccc(NN=C3C=CC(=O)C=C3)cc2)C1 ZINC001231319764 1132280074 /nfs/dbraw/zinc/28/00/74/1132280074.db2.gz KSZSXXPIHDLLHY-KRWDZBQOSA-N 1 0 297.358 3.891 20 10 CHCDRO CCO[C@H]1C[C@@H]([NH2+][C@H](C)c2cc(Cl)cc(C)c2O)C1 ZINC000840765545 1132285394 /nfs/dbraw/zinc/28/53/94/1132285394.db2.gz WUPADWCTQPIVCE-RTXFEEFZSA-N 1 0 283.799 3.572 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C2CCC(OC)CC2)cc1 ZINC000840791489 1132288267 /nfs/dbraw/zinc/28/82/67/1132288267.db2.gz GHXDZRRNDPWSGF-NXVRBGIVSA-N 1 0 290.451 3.751 20 10 CHCDRO C[C@H]([NH2+]C1CC(C)(C)OC(C)(C)C1)c1ccccc1O ZINC001172647937 1132288566 /nfs/dbraw/zinc/28/85/66/1132288566.db2.gz PPRNRHXEHWDUNA-LBPRGKRZSA-N 1 0 277.408 3.779 20 10 CHCDRO Cc1ccc(C[N@@H+]2CCc3cccc(O)c3C2)cc1Cl ZINC001231424357 1132292353 /nfs/dbraw/zinc/29/23/53/1132292353.db2.gz RSZXSFGPXCXUEL-UHFFFAOYSA-N 1 0 287.790 3.912 20 10 CHCDRO CO[C@H]1c2ccccc2C[C@H]1[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000840847415 1132293318 /nfs/dbraw/zinc/29/33/18/1132293318.db2.gz NGCMSZCYEJFCSS-IRWQIABSSA-N 1 0 297.398 3.664 20 10 CHCDRO CCN(C)c1ccc([C@H](C)[NH2+]C[C@@H]2C[C@@H](C)O[C@H]2C)cc1 ZINC000840874171 1132298414 /nfs/dbraw/zinc/29/84/14/1132298414.db2.gz XUAUEIJAXYWEJK-AESZEHBQSA-N 1 0 290.451 3.607 20 10 CHCDRO CC[C@H]([NH2+]C[C@@H]1C[C@@H](C)O[C@H]1C)c1ccc(N(C)C)cc1 ZINC000840874055 1132298712 /nfs/dbraw/zinc/29/87/12/1132298712.db2.gz WJVMUPNJXWRPHV-OAOQPFQOSA-N 1 0 290.451 3.607 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCc3cccc(O)c3C2)cc1C ZINC001231485878 1132299978 /nfs/dbraw/zinc/29/99/78/1132299978.db2.gz OGUYTCFRHYEGET-UHFFFAOYSA-N 1 0 281.399 3.876 20 10 CHCDRO COC1([C@H](C)[NH2+][C@@H]2C[C@H](C)c3c2c(O)ccc3F)CCC1 ZINC000840882697 1132301840 /nfs/dbraw/zinc/30/18/40/1132301840.db2.gz ACNGYGJQJAAFHN-GMXVVIOVSA-N 1 0 293.382 3.627 20 10 CHCDRO CC[N@H+](CCC(F)(F)F)Cc1ccc(N(C)C)cc1C ZINC000840912385 1132308372 /nfs/dbraw/zinc/30/83/72/1132308372.db2.gz GBFDFUWHPAFUSH-UHFFFAOYSA-N 1 0 288.357 3.835 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+][C@@H](C)CCc1cccn1C ZINC000840933678 1132309373 /nfs/dbraw/zinc/30/93/73/1132309373.db2.gz HIGYXROGIYEUCK-INIZCTEOSA-N 1 0 299.462 3.510 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C[C@@H](C)c2nccs2)c(Cl)c1 ZINC000840938929 1132310075 /nfs/dbraw/zinc/31/00/75/1132310075.db2.gz IMMJKKKAWLGGPX-SNVBAGLBSA-N 1 0 296.823 3.704 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]C[C@H]1CCC(F)(F)C1 ZINC000840942005 1132311176 /nfs/dbraw/zinc/31/11/76/1132311176.db2.gz VOHQJHUTPJJUIR-ZDUSSCGKSA-N 1 0 282.378 3.586 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[N@@H+]1CCC[C@H]1c1cccnc1 ZINC000840947029 1132311526 /nfs/dbraw/zinc/31/15/26/1132311526.db2.gz ZPMXARXMJZQBCC-IBGZPJMESA-N 1 0 295.430 3.793 20 10 CHCDRO CCOc1cccc(C[N@H+](CC)Cc2occc2C)c1O ZINC000840970789 1132314986 /nfs/dbraw/zinc/31/49/86/1132314986.db2.gz WHYRQTTYBXSADD-UHFFFAOYSA-N 1 0 289.375 3.714 20 10 CHCDRO C[C@@H]1C[N@H+](Cc2c(O)ccc3ccccc32)CCC[C@@]1(C)O ZINC001231586953 1132316974 /nfs/dbraw/zinc/31/69/74/1132316974.db2.gz NTLNOTIRAQHSDX-AUUYWEPGSA-N 1 0 299.414 3.528 20 10 CHCDRO Oc1ccc2ccccc2c1C[N@@H+]1CCc2occc2C1 ZINC001231590845 1132318003 /nfs/dbraw/zinc/31/80/03/1132318003.db2.gz NUTJHIIMKNVENK-UHFFFAOYSA-N 1 0 279.339 3.697 20 10 CHCDRO C[N@H+](Cc1c(O)ccc2ccccc21)C1CC(F)(F)C1 ZINC001231588325 1132319135 /nfs/dbraw/zinc/31/91/35/1132319135.db2.gz PLUYZFCVDXXAKF-UHFFFAOYSA-N 1 0 277.314 3.775 20 10 CHCDRO Cc1cccc(C[NH+]2CCC(Cc3ccncc3)CC2)c1O ZINC001231594523 1132320734 /nfs/dbraw/zinc/32/07/34/1132320734.db2.gz KGBOWKYKPOCJNT-UHFFFAOYSA-N 1 0 296.414 3.550 20 10 CHCDRO CC(C)COc1ccc(C[NH2+]CCc2ccc(N)cc2)cc1 ZINC000841033858 1132321562 /nfs/dbraw/zinc/32/15/62/1132321562.db2.gz CISABQPWCUZRIB-UHFFFAOYSA-N 1 0 298.430 3.636 20 10 CHCDRO CCCC[C@H]1CCC[C@H]1[NH2+]CCc1ccc(N)cc1 ZINC000841035847 1132321671 /nfs/dbraw/zinc/32/16/71/1132321671.db2.gz PLLVPLNBNDLLSF-DOTOQJQBSA-N 1 0 260.425 3.760 20 10 CHCDRO Nc1ccc(CC[NH2+][C@H]2CC[C@H](Cc3ccccc3)C2)cc1 ZINC000841038781 1132322665 /nfs/dbraw/zinc/32/26/65/1132322665.db2.gz QEAMDDYKBXGRFE-QUCCMNQESA-N 1 0 294.442 3.812 20 10 CHCDRO Nc1ccc(CC[NH2+][C@H]2CCC[C@H]2Cc2ccccc2)cc1 ZINC000841037065 1132322902 /nfs/dbraw/zinc/32/29/02/1132322902.db2.gz YDYFFKLMRDZJGL-ICSRJNTNSA-N 1 0 294.442 3.812 20 10 CHCDRO C[NH+]1CCC(c2ccc(Nc3cccc(O)c3O)cc2)CC1 ZINC001212690341 1132360605 /nfs/dbraw/zinc/36/06/05/1132360605.db2.gz GZHPOGYEQQIBFJ-UHFFFAOYSA-N 1 0 298.386 3.651 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)cc1)[C@H]1CCC[C@H](OC)C1 ZINC001172950292 1132373247 /nfs/dbraw/zinc/37/32/47/1132373247.db2.gz MGPWCMBGCOZFRU-ROUUACIJSA-N 1 0 290.451 3.532 20 10 CHCDRO CCC(CC)[N@H+](CC)Cc1ccc(N(C)C)cc1OC ZINC001231854593 1132378233 /nfs/dbraw/zinc/37/82/33/1132378233.db2.gz JBTJZAYWUGKOHW-UHFFFAOYSA-N 1 0 278.440 3.772 20 10 CHCDRO Cc1cc(C)c(C[NH+]2CCC(c3ccncc3)CC2)c(O)c1 ZINC001231845917 1132378318 /nfs/dbraw/zinc/37/83/18/1132378318.db2.gz UMDMDWYANZONJJ-UHFFFAOYSA-N 1 0 296.414 3.784 20 10 CHCDRO Cc1cc(C)c(C[NH+]2CC3(C2)CCCCC3)c(O)c1 ZINC001231846111 1132379170 /nfs/dbraw/zinc/37/91/70/1132379170.db2.gz AXKWYLUEVNQLTK-UHFFFAOYSA-N 1 0 259.393 3.775 20 10 CHCDRO Cc1cc(C)c(C[N@@H+]2CCC[C@H](C(F)(F)F)C2)c(O)c1 ZINC001231845931 1132380043 /nfs/dbraw/zinc/38/00/43/1132380043.db2.gz VGLBWQNPNNKPJR-LBPRGKRZSA-N 1 0 287.325 3.783 20 10 CHCDRO Cc1cc(C)c(O)c(C[NH+]2CCC(OC3CCC3)CC2)c1 ZINC000841688167 1132383537 /nfs/dbraw/zinc/38/35/37/1132383537.db2.gz ZNAFQQGBRXCYHR-UHFFFAOYSA-N 1 0 289.419 3.543 20 10 CHCDRO CCCOC1CC[NH+](Cc2cc(Cl)c(C)cc2O)CC1 ZINC001231870576 1132383705 /nfs/dbraw/zinc/38/37/05/1132383705.db2.gz KDSPDVICYRWRJL-UHFFFAOYSA-N 1 0 297.826 3.745 20 10 CHCDRO Cc1cc(O)c(C[N@H+]2CCC[C@@H](C)[C@H]2C)cc1Cl ZINC001231871113 1132384747 /nfs/dbraw/zinc/38/47/47/1132384747.db2.gz YKNOIQRRYBBWSE-ZYHUDNBSSA-N 1 0 267.800 3.974 20 10 CHCDRO Cc1cccc(C[NH2+][C@H](C)c2ccc(Cl)cc2O)n1 ZINC000841745244 1132387887 /nfs/dbraw/zinc/38/78/87/1132387887.db2.gz OWEARXXEUSOGSS-LLVKDONJSA-N 1 0 276.767 3.600 20 10 CHCDRO C[C@@H]([NH2+][C@H](C)c1ccc(Cl)cc1O)c1ccccn1 ZINC000841743132 1132388655 /nfs/dbraw/zinc/38/86/55/1132388655.db2.gz CTYYDKACWIMJOF-GHMZBOCLSA-N 1 0 276.767 3.852 20 10 CHCDRO C[C@H]([NH2+][C@@H](CO)C1CCCCC1)c1ccc(Cl)cc1O ZINC000841751192 1132388842 /nfs/dbraw/zinc/38/88/42/1132388842.db2.gz MILRQXZGGSHEHP-NHYWBVRUSA-N 1 0 297.826 3.637 20 10 CHCDRO Cc1ncccc1C[N@@H+](C)Cc1ccc2ccccc2c1O ZINC001231882380 1132389808 /nfs/dbraw/zinc/38/98/08/1132389808.db2.gz JHNKUSOWMLSVGX-UHFFFAOYSA-N 1 0 292.382 3.881 20 10 CHCDRO C[C@H]([NH2+]C[C@H](O)C1CCCCC1)c1ccc(Cl)cc1O ZINC000841746420 1132390011 /nfs/dbraw/zinc/39/00/11/1132390011.db2.gz GOXLRKGQCAAZNH-ZBEGNZNMSA-N 1 0 297.826 3.637 20 10 CHCDRO C[C@H](C[NH2+][C@@H](C)c1ccc(Cl)cc1O)c1nccs1 ZINC000841751606 1132390425 /nfs/dbraw/zinc/39/04/25/1132390425.db2.gz IFJHOUFAEYDTQL-ZJUUUORDSA-N 1 0 296.823 3.956 20 10 CHCDRO C[C@H]([NH2+]Cc1ccccc1O)[C@@H]1C[C@H]1c1cccs1 ZINC000841747672 1132390773 /nfs/dbraw/zinc/39/07/73/1132390773.db2.gz RWULLDGBBQDBBN-FPMFFAJLSA-N 1 0 273.401 3.736 20 10 CHCDRO C[C@H]([NH2+]CCOCC1CCC1)c1ccc(Cl)cc1O ZINC000841751200 1132390890 /nfs/dbraw/zinc/39/08/90/1132390890.db2.gz FTVLCGMPCMHEIR-NSHDSACASA-N 1 0 283.799 3.513 20 10 CHCDRO CO[C@@H]1CC[N@H+](Cc2ccc3ccccc3c2O)[C@H](C)C1 ZINC001231884012 1132391322 /nfs/dbraw/zinc/39/13/22/1132391322.db2.gz UGSCSKHXFNDNBV-CZUORRHYSA-N 1 0 285.387 3.545 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1O)c1ccc[nH]1 ZINC000841753300 1132392234 /nfs/dbraw/zinc/39/22/34/1132392234.db2.gz YRCKOFKCFQTDQN-VHSXEESVSA-N 1 0 264.756 3.786 20 10 CHCDRO C[C@H]([NH2+][C@@H]1C[C@@H](C)n2ccnc21)c1ccc(Cl)cc1O ZINC000841759242 1132395082 /nfs/dbraw/zinc/39/50/82/1132395082.db2.gz XSDTWPFEIRBTOC-GBIKHYSHSA-N 1 0 291.782 3.599 20 10 CHCDRO CCc1nc(C[NH2+][C@@H](C)c2ccc(Cl)cc2O)cs1 ZINC000841762766 1132397136 /nfs/dbraw/zinc/39/71/36/1132397136.db2.gz KAHGHEFFTPKDCH-VIFPVBQESA-N 1 0 296.823 3.915 20 10 CHCDRO Cc1cc(O)c(C[NH2+]C(C)(C)C2CCOCC2)c(Cl)c1 ZINC000842207794 1132414715 /nfs/dbraw/zinc/41/47/15/1132414715.db2.gz RAQJQFRVIBEMHJ-UHFFFAOYSA-N 1 0 297.826 3.649 20 10 CHCDRO CC[C@@H]1CC[C@@H]([NH2+]Cc2ccc(N3CCCC3)cc2)C1 ZINC001173265241 1132432176 /nfs/dbraw/zinc/43/21/76/1132432176.db2.gz RJUBQAXQDOSZEW-NVXWUHKLSA-N 1 0 272.436 3.955 20 10 CHCDRO Oc1cc(O)c(C[N@H+](Cc2ccco2)C2CC2)cc1Cl ZINC001232262225 1132444392 /nfs/dbraw/zinc/44/43/92/1132444392.db2.gz CDYORXLTBKHAIB-UHFFFAOYSA-N 1 0 293.750 3.509 20 10 CHCDRO C[C@H]1CC[C@H]([N@H+](C)Cc2cc(Cl)c(O)cc2O)CC1 ZINC001232266484 1132447252 /nfs/dbraw/zinc/44/72/52/1132447252.db2.gz UZVKYYMLBPUMQN-UMSPYCQHSA-N 1 0 283.799 3.762 20 10 CHCDRO Oc1ccccc1C[NH2+]C1(c2ccccc2F)CCC1 ZINC000842747964 1132457988 /nfs/dbraw/zinc/45/79/88/1132457988.db2.gz OAKJEBKXDPHTCN-UHFFFAOYSA-N 1 0 271.335 3.700 20 10 CHCDRO C[C@@H]([NH2+][C@@H]1CO[C@H](C)C1)c1ccc(N2CCCCC2)cc1 ZINC000842928976 1132477709 /nfs/dbraw/zinc/47/77/09/1132477709.db2.gz LGEAHASKXHXWNM-INMHGKMJSA-N 1 0 288.435 3.505 20 10 CHCDRO CCC[N@H+](Cc1cccc2c1NCC2)Cc1ccccc1O ZINC000843060875 1132495230 /nfs/dbraw/zinc/49/52/30/1132495230.db2.gz QKLJJOZCAASGKF-UHFFFAOYSA-N 1 0 296.414 3.772 20 10 CHCDRO CC(C)(C)c1cccc(C[NH+]2C[C@H]3CCC[C@@H]3C2)c1O ZINC001143103661 1132502862 /nfs/dbraw/zinc/50/28/62/1132502862.db2.gz IMRPGZHJXRSSQD-ZIAGYGMSSA-N 1 0 273.420 3.922 20 10 CHCDRO CC(C)(C)c1cccc(C[N@@H+]2CCC[C@@H]3C[C@@H]32)c1O ZINC001143112820 1132505009 /nfs/dbraw/zinc/50/50/09/1132505009.db2.gz ZEBFRVNJJFUJHT-DOMZBBRYSA-N 1 0 259.393 3.674 20 10 CHCDRO Oc1cccc2c1C[N@H+](Cc1ccc(C(F)F)cc1)CC2 ZINC001143253479 1132524983 /nfs/dbraw/zinc/52/49/83/1132524983.db2.gz VPKSRXJCNSTUOI-UHFFFAOYSA-N 1 0 289.325 3.888 20 10 CHCDRO CN(C)c1ccc(C[NH+]2CCC3(CCCC3)CC2)c(O)c1 ZINC001232835712 1132529011 /nfs/dbraw/zinc/52/90/11/1132529011.db2.gz GDGAGJMOAAUQAY-UHFFFAOYSA-N 1 0 288.435 3.614 20 10 CHCDRO CC[N@H+](Cc1c([O-])cc(Br)cc1F)C(C)C ZINC001233026935 1132564971 /nfs/dbraw/zinc/56/49/71/1132564971.db2.gz IIAYMFUVLCQKGY-UHFFFAOYSA-N 1 0 290.176 3.524 20 10 CHCDRO CC(=O)[C@H]1CCCC[N@@H+]1Cc1cc(C(C)(C)C)ccc1O ZINC001233286950 1132594412 /nfs/dbraw/zinc/59/44/12/1132594412.db2.gz PUVOHDMOUSXGNA-MRXNPFEDSA-N 1 0 289.419 3.633 20 10 CHCDRO CC(C)(C)c1ccc(O)c(C[NH+]2C3CCC2CC3)c1 ZINC001233286018 1132595178 /nfs/dbraw/zinc/59/51/78/1132595178.db2.gz BBFFXOPPCFCXBN-UHFFFAOYSA-N 1 0 259.393 3.817 20 10 CHCDRO CC(C)(C)c1ccc(O)c(C[N@@H+]2CCC[C@@H]3C[C@@H]32)c1 ZINC001233286974 1132595185 /nfs/dbraw/zinc/59/51/85/1132595185.db2.gz QVDPDRJAQLYWFF-DOMZBBRYSA-N 1 0 259.393 3.674 20 10 CHCDRO CCO[C@@H]1CCC[N@H+](Cc2cc(C(C)(C)C)ccc2O)C1 ZINC001233286432 1132595770 /nfs/dbraw/zinc/59/57/70/1132595770.db2.gz UECBAKULPPPSEV-MRXNPFEDSA-N 1 0 291.435 3.691 20 10 CHCDRO COc1cc(Cl)cc(C[NH+]2CC3CCC(CC3)C2)c1O ZINC001233290514 1132596795 /nfs/dbraw/zinc/59/67/95/1132596795.db2.gz GWGLDCNPWMBFDV-UHFFFAOYSA-N 1 0 295.810 3.676 20 10 CHCDRO C[C@@H]1CCC[N@H+](Cc2cccc(OC(F)(F)F)c2O)C1 ZINC001233726504 1132670560 /nfs/dbraw/zinc/67/05/60/1132670560.db2.gz FBHHCFZJVBQDNE-SNVBAGLBSA-N 1 0 289.297 3.523 20 10 CHCDRO CC[C@H](C)[N@H+](C)Cc1cccc(OC(F)(F)F)c1O ZINC001233736529 1132672077 /nfs/dbraw/zinc/67/20/77/1132672077.db2.gz MFHJILISNMJJRC-VIFPVBQESA-N 1 0 277.286 3.521 20 10 CHCDRO C[N@H+](Cc1cccc(OC(F)(F)F)c1O)C(C)(C)C ZINC001233755178 1132675574 /nfs/dbraw/zinc/67/55/74/1132675574.db2.gz RFZGPELRYLBVLV-UHFFFAOYSA-N 1 0 277.286 3.521 20 10 CHCDRO Cc1ccc(NC2=CCC[NH2+]C2)c(C(=O)c2ccccc2)c1 ZINC001159899646 1132920361 /nfs/dbraw/zinc/92/03/61/1132920361.db2.gz HHAFRKOUILPUJU-UHFFFAOYSA-N 1 0 292.382 3.515 20 10 CHCDRO C[C@H]1CCC[N@H+](Cc2c(O)cccc2Cl)[C@H]1C ZINC000252125974 1133185368 /nfs/dbraw/zinc/18/53/68/1133185368.db2.gz KBABVAXFGHJEAR-QWRGUYRKSA-N 1 0 253.773 3.666 20 10 CHCDRO Cc1cc(O)c(C[NH2+][C@@H]2CCCC23CC3)c(Cl)c1 ZINC001203331482 1133316336 /nfs/dbraw/zinc/31/63/36/1133316336.db2.gz AMLODTPAEXCYBQ-CQSZACIVSA-N 1 0 265.784 3.776 20 10 CHCDRO COC(C)(C)[C@H](C)[NH2+][C@H]1C[C@H](C)c2c1c(O)ccc2C ZINC000720244746 1133338186 /nfs/dbraw/zinc/33/81/86/1133338186.db2.gz ASVQSZPCYJDCIU-AVGNSLFASA-N 1 0 277.408 3.652 20 10 CHCDRO COc1ccc(C[N@@H+]2CCCC3(CC(F)C3)CC2)c(O)c1 ZINC001203629088 1133346050 /nfs/dbraw/zinc/34/60/50/1133346050.db2.gz QSIVXBYBGLFSKS-UHFFFAOYSA-N 1 0 293.382 3.505 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[NH2+]CC[C@@H]1CC[C@@H]2C[C@@H]21 ZINC001203692670 1133355060 /nfs/dbraw/zinc/35/50/60/1133355060.db2.gz ZJKCAYNTCBCFQR-YQVWRLOYSA-N 1 0 284.447 3.813 20 10 CHCDRO CC[N@H+](Cc1ccc(N(C)C)cc1)Cc1cccc(F)c1 ZINC001203787694 1133368316 /nfs/dbraw/zinc/36/83/16/1133368316.db2.gz AJQPAIPQYKGZDY-UHFFFAOYSA-N 1 0 286.394 3.914 20 10 CHCDRO Cc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(O)c(O)c2)cc1 ZINC001203878612 1133378815 /nfs/dbraw/zinc/37/88/15/1133378815.db2.gz IFQJEDJVERABLT-MRXNPFEDSA-N 1 0 283.371 3.743 20 10 CHCDRO CN(C)c1ccc(C[NH+]2CCC3(CC[C@@H](F)C3)CC2)cc1 ZINC001203937693 1133385988 /nfs/dbraw/zinc/38/59/88/1133385988.db2.gz MHEQIKKXRIKTON-MRXNPFEDSA-N 1 0 290.426 3.857 20 10 CHCDRO CC[N@H+](Cc1ccoc1)Cc1ccc(N(C)C)cc1C ZINC001204186490 1133416774 /nfs/dbraw/zinc/41/67/74/1133416774.db2.gz BVPHHXLGLONTOL-UHFFFAOYSA-N 1 0 272.392 3.676 20 10 CHCDRO CCc1ccc(C[N@@H+]2CCc3cccc(O)c3C2)cc1 ZINC001204178489 1133417017 /nfs/dbraw/zinc/41/70/17/1133417017.db2.gz UXPNWVIPBBDJKA-UHFFFAOYSA-N 1 0 267.372 3.513 20 10 CHCDRO CC[N@H+](Cc1ccccc1O)Cc1cc(F)ccc1F ZINC001204220329 1133421348 /nfs/dbraw/zinc/42/13/48/1133421348.db2.gz LLXQSBMUYLFFQH-UHFFFAOYSA-N 1 0 277.314 3.693 20 10 CHCDRO CN(C)c1ccc(C[N@@H+]2CCOC(C)(C)C2)c2ccccc21 ZINC001204233002 1133422976 /nfs/dbraw/zinc/42/29/76/1133422976.db2.gz MXNPKRDHTMTTQF-UHFFFAOYSA-N 1 0 298.430 3.517 20 10 CHCDRO CC(C)[N@H+](C)Cc1ccc(N(C)C)c2ccccc12 ZINC001204233599 1133423023 /nfs/dbraw/zinc/42/30/23/1133423023.db2.gz SDWMYSXXXFWQTB-UHFFFAOYSA-N 1 0 256.393 3.746 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[N@@H+]1CCCCC12CC2 ZINC001204321742 1133436378 /nfs/dbraw/zinc/43/63/78/1133436378.db2.gz JYQRQJHSPRPYAZ-UHFFFAOYSA-N 1 0 270.420 3.805 20 10 CHCDRO C[C@H]1CCC[N@H+](Cc2ccc(N3CCCC3)cc2)C1 ZINC001204320055 1133437242 /nfs/dbraw/zinc/43/72/42/1133437242.db2.gz MQPJORYUCYPNTM-HNNXBMFYSA-N 1 0 258.409 3.519 20 10 CHCDRO c1cc2c(s1)CC[N@@H+](Cc1ccc(N3CCCC3)cc1)C2 ZINC001204327816 1133437757 /nfs/dbraw/zinc/43/77/57/1133437757.db2.gz JHHSMFPUZQLQHL-UHFFFAOYSA-N 1 0 298.455 3.907 20 10 CHCDRO Cc1ccc(C[N@@H+]2CC[C@@H](Cc3ccc(F)cc3)C2)c(O)c1 ZINC001204347842 1133437789 /nfs/dbraw/zinc/43/77/89/1133437789.db2.gz MIALCTZDMSJLGG-INIZCTEOSA-N 1 0 299.389 3.904 20 10 CHCDRO c1cc(N2CCCC2)ccc1C[NH+]1CC2CCC(CC2)C1 ZINC001204328781 1133438642 /nfs/dbraw/zinc/43/86/42/1133438642.db2.gz MRRWAPZSLPYUPR-UHFFFAOYSA-N 1 0 284.447 3.909 20 10 CHCDRO CC[C@H](C)[C@H]1CCCC[N@@H+]1Cc1cc(OC)ccc1O ZINC001204690694 1133476875 /nfs/dbraw/zinc/47/68/75/1133476875.db2.gz XKLNVBRAKLMMFC-XJKSGUPXSA-N 1 0 277.408 3.801 20 10 CHCDRO Cc1cc(N(C)C)ccc1C[NH2+]CC1CC(C)(C)C1 ZINC001205433748 1133576614 /nfs/dbraw/zinc/57/66/14/1133576614.db2.gz ARJYGFRFQIIWRX-UHFFFAOYSA-N 1 0 260.425 3.587 20 10 CHCDRO Cc1ccc([C@H](O)C[NH2+]Cc2cc(C(C)C)ccc2O)cc1 ZINC001205554622 1133586661 /nfs/dbraw/zinc/58/66/61/1133586661.db2.gz IFHFTBPKSKXIGN-LJQANCHMSA-N 1 0 299.414 3.647 20 10 CHCDRO CC(C)c1ccc(O)c(C[N@@H+]2CCO[C@](C)(C3CC3)C2)c1 ZINC001206645014 1133731043 /nfs/dbraw/zinc/73/10/43/1133731043.db2.gz KUVAPHZRNAIEAR-SFHVURJKSA-N 1 0 289.419 3.517 20 10 CHCDRO CCC1(CC)[C@H](OC)C[C@@H]1[NH2+][C@@H](C)c1ccccc1O ZINC001207160051 1133773818 /nfs/dbraw/zinc/77/38/18/1133773818.db2.gz NKBBZSUPYLATIM-VBNZEHGJSA-N 1 0 277.408 3.637 20 10 CHCDRO Oc1cccc2c1C[N@H+](CCCC1CCCC1)CC2 ZINC001208094657 1133877570 /nfs/dbraw/zinc/87/75/70/1133877570.db2.gz OKXCNRUSCCIXHA-UHFFFAOYSA-N 1 0 259.393 3.721 20 10 CHCDRO CC1=C[C@@H](C)[C@H](C[N@H+](C)Cc2ccccc2O)CC1 ZINC001208179755 1133899616 /nfs/dbraw/zinc/89/96/16/1133899616.db2.gz BZTRLSXBPHQPQB-CABCVRRESA-N 1 0 259.393 3.816 20 10 CHCDRO CC1=C[C@H](C)[C@@H](C[N@@H+]2CCc3cccc(O)c3C2)CC1 ZINC001208184006 1133900754 /nfs/dbraw/zinc/90/07/54/1133900754.db2.gz ZMQNCEMLDDXNEK-GOEBONIOSA-N 1 0 271.404 3.743 20 10 CHCDRO CC[NH+](CC)Cc1ccc(Nc2cccc(O)c2O)cc1 ZINC001209824311 1134071500 /nfs/dbraw/zinc/07/15/00/1134071500.db2.gz RZQLYMGMJRSCMA-UHFFFAOYSA-N 1 0 286.375 3.683 20 10 CHCDRO Cc1ccc(Nc2c[nH+]cn2C)c(C(=O)c2ccccc2)c1 ZINC001211252677 1134399536 /nfs/dbraw/zinc/39/95/36/1134399536.db2.gz UHRDSOUNIGMHIO-UHFFFAOYSA-N 1 0 291.354 3.703 20 10 CHCDRO CC(C)O[C@H]1CCC[N@H+](Cc2c(O)ccc3ccccc32)C1 ZINC000404593849 1134947891 /nfs/dbraw/zinc/94/78/91/1134947891.db2.gz ZHOCXHRHMXBAQA-INIZCTEOSA-N 1 0 299.414 3.935 20 10 CHCDRO O=C1C=CC(=NNc2ccccc2)C(O[C@@H]2CC[NH2+]C2)=C1 ZINC001218038338 1135047980 /nfs/dbraw/zinc/04/79/80/1135047980.db2.gz GOVBNLQOGRYUFM-IWHJNQCMSA-N 1 0 283.331 3.548 20 10 CHCDRO CCC[C@@H](Oc1ccc(N2CC[NH2+]CC2)cc1)C(C)(C)C ZINC001218294023 1135079819 /nfs/dbraw/zinc/07/98/19/1135079819.db2.gz RDWJAZMTSULVSH-QGZVFWFLSA-N 1 0 290.451 3.690 20 10 CHCDRO C[C@H]1[NH2+]C[C@H]1Oc1ccc(/N=N/c2ccccc2)cc1 ZINC001218389374 1135096980 /nfs/dbraw/zinc/09/69/80/1135096980.db2.gz VIFKTUNXHJFNLO-GODDWODMSA-N 1 0 267.332 3.841 20 10 CHCDRO C[C@H]1[NH2+]C[C@@H]1Oc1ccccc1NN=C1C=CC=CC1=O ZINC001218388353 1135097239 /nfs/dbraw/zinc/09/72/39/1135097239.db2.gz SDAIORATIJLINL-RPWNSFOZSA-N 1 0 283.331 3.547 20 10 CHCDRO C[C@H]1[NH2+]C[C@@H]1OC1=CC(=O)C=CC1=NNc1ccccc1 ZINC001218394507 1135098575 /nfs/dbraw/zinc/09/85/75/1135098575.db2.gz YGNUQSIOTLQSOH-RPWNSFOZSA-N 1 0 283.331 3.547 20 10 CHCDRO CCN(CC)c1ccc(C[NH2+]CCC2(OC)CCC2)cc1 ZINC000315252166 1135152359 /nfs/dbraw/zinc/15/23/59/1135152359.db2.gz RYIBZMDHMPQETD-UHFFFAOYSA-N 1 0 290.451 3.582 20 10 CHCDRO CSC[C@@H](C)[NH2+]Cc1ccc(N2CCCCC2)cc1 ZINC000076769196 260166497 /nfs/dbraw/zinc/16/64/97/260166497.db2.gz ZENYBCLENQMAGG-CQSZACIVSA-N 1 0 278.465 3.518 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)CC(C)(C)OC)c1ccccc1O ZINC000156052603 261112436 /nfs/dbraw/zinc/11/24/36/261112436.db2.gz SMOLYRDZQXHDDK-OCCSQVGLSA-N 1 0 265.397 3.637 20 10 CHCDRO CC[C@H]([NH2+][C@@H](C)c1cccnc1)c1ccccc1O ZINC000020127750 171013914 /nfs/dbraw/zinc/01/39/14/171013914.db2.gz JXOUXQKIEHEHMX-WFASDCNBSA-N 1 0 256.349 3.589 20 10 CHCDRO Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+][C@@H](C)c1cccnc1 ZINC000020127810 171014015 /nfs/dbraw/zinc/01/40/15/171014015.db2.gz CURACHQIEXDXDQ-KCQAQPDRSA-N 1 0 282.387 3.995 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1ccc(F)c(F)c1 ZINC000020146092 171031638 /nfs/dbraw/zinc/03/16/38/171031638.db2.gz DOHUBUUOGCSIPL-GFCCVEGCSA-N 1 0 290.357 3.882 20 10 CHCDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C)cc2)cc1 ZINC000020146033 171032066 /nfs/dbraw/zinc/03/20/66/171032066.db2.gz NAGVPFLPHBOMSF-HNNXBMFYSA-N 1 0 268.404 3.912 20 10 CHCDRO C[C@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cccc(F)c1 ZINC000020147751 171035625 /nfs/dbraw/zinc/03/56/25/171035625.db2.gz LYXSJJMRVPINHT-ZDUSSCGKSA-N 1 0 272.367 3.743 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCCc3occc32)c1 ZINC000020204534 171069355 /nfs/dbraw/zinc/06/93/55/171069355.db2.gz IPDRUEJVNGDUIK-XHDPSFHLSA-N 1 0 287.359 3.722 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2CCC[C@@H](C)C2)c1 ZINC000037254115 173065455 /nfs/dbraw/zinc/06/54/55/173065455.db2.gz NRIDADHARZCPOW-AGIUHOORSA-N 1 0 263.381 3.630 20 10 CHCDRO CC(C)(C)CC(C)(C)[NH2+]Cc1ccc2c(c1)CCO2 ZINC000037363449 173152982 /nfs/dbraw/zinc/15/29/82/173152982.db2.gz MOLOILCPXNIJJU-UHFFFAOYSA-N 1 0 261.409 3.926 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2cc(C)ccc2O)s1 ZINC000071408384 176156841 /nfs/dbraw/zinc/15/68/41/176156841.db2.gz VMNSVQRAZPZJPM-GFCCVEGCSA-N 1 0 261.390 3.921 20 10 CHCDRO COc1cccc([C@H](C)[NH2+]Cc2ccc(OC)c(C)c2)c1 ZINC000037771475 260116254 /nfs/dbraw/zinc/11/62/54/260116254.db2.gz XVLDDEODCRHLQH-AWEZNQCLSA-N 1 0 285.387 3.863 20 10 CHCDRO CC[C@@H]([NH2+]Cc1ccc(C)cc1OC)c1ccccc1O ZINC000156337293 261120489 /nfs/dbraw/zinc/12/04/89/261120489.db2.gz AEINYWRGINQKFB-MRXNPFEDSA-N 1 0 285.387 3.950 20 10 CHCDRO Cc1cccc(C[NH2+]C2(c3ccccc3)CCC2)c1O ZINC000181327285 261894130 /nfs/dbraw/zinc/89/41/30/261894130.db2.gz FXMLMVSJSGGVAG-UHFFFAOYSA-N 1 0 267.372 3.870 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)ccc1O)c1cccnc1 ZINC000184882961 262032220 /nfs/dbraw/zinc/03/22/20/262032220.db2.gz ZQOOGRWAMSNWJC-MNOVXSKESA-N 1 0 276.767 3.852 20 10 CHCDRO COc1cccc(C[NH2+][C@@H](C)c2cc(Cl)ccc2O)c1 ZINC000184884029 262032702 /nfs/dbraw/zinc/03/27/02/262032702.db2.gz GAXGKLWVKNRMLU-NSHDSACASA-N 1 0 291.778 3.905 20 10 CHCDRO Cc1ccc(O)c([C@@H](C)[NH2+]CCCOC2CCCC2)c1 ZINC000185240506 262047776 /nfs/dbraw/zinc/04/77/76/262047776.db2.gz YRPVUANDBRPCAP-CQSZACIVSA-N 1 0 277.408 3.701 20 10 CHCDRO CCc1noc(CC)c1C[NH2+][C@@H](C)c1ccc(C)cc1O ZINC000185678677 262066150 /nfs/dbraw/zinc/06/61/50/262066150.db2.gz ATUNJCHCDVAUPX-LBPRGKRZSA-N 1 0 288.391 3.664 20 10 CHCDRO COc1cc(C)cc(C[NH2+][C@H](C)c2cc(F)ccc2O)c1 ZINC000186156447 262081863 /nfs/dbraw/zinc/08/18/63/262081863.db2.gz JZDKYPJJFOGDDD-GFCCVEGCSA-N 1 0 289.350 3.699 20 10 CHCDRO C/C=C/C[C@@H](CO)[NH2+][C@@H](C)c1ccc2ccccc2c1O ZINC000186519388 262096376 /nfs/dbraw/zinc/09/63/76/262096376.db2.gz QSZKQLBNYLOJNH-CSDYLXSXSA-N 1 0 285.387 3.523 20 10 CHCDRO CSCCCCC[NH2+][C@@H](C)c1cc(F)ccc1O ZINC000186775344 262109170 /nfs/dbraw/zinc/10/91/70/262109170.db2.gz DOSLVOFCKMMVIV-NSHDSACASA-N 1 0 271.401 3.715 20 10 CHCDRO COc1ccc(O)c([C@H](C)[NH2+][C@H]2CCC[C@H](SC)C2)c1 ZINC000185483885 262304357 /nfs/dbraw/zinc/30/43/57/262304357.db2.gz QHIBNKLCLCGPRY-OBJOEFQTSA-N 1 0 295.448 3.726 20 10 CHCDRO CCCOc1ccc(C[NH2+]C[C@H]2CCC(F)(F)C2)c(O)c1 ZINC000280412320 263061440 /nfs/dbraw/zinc/06/14/40/263061440.db2.gz BCHWWIONSLDALJ-LBPRGKRZSA-N 1 0 299.361 3.706 20 10 CHCDRO CC[C@H]([NH2+]CC1(c2ccccn2)CCC1)c1ccccc1O ZINC000367604278 267104506 /nfs/dbraw/zinc/10/45/06/267104506.db2.gz ALOLYOGARFBMQF-INIZCTEOSA-N 1 0 296.414 3.950 20 10 CHCDRO COC[C@@H]([NH2+][C@H](C)c1cc(C)ccc1O)c1ccc(C)o1 ZINC000185630236 327841741 /nfs/dbraw/zinc/84/17/41/327841741.db2.gz XAZXRGUITUJXOT-UKRRQHHQSA-N 1 0 289.375 3.640 20 10 CHCDRO COc1ccc(C[NH2+][C@@H]2CCOC3(CCCC3)C2)cc1C ZINC000268959944 328187382 /nfs/dbraw/zinc/18/73/82/328187382.db2.gz ICQQPDYYESOCAM-MRXNPFEDSA-N 1 0 289.419 3.585 20 10 CHCDRO Cc1ccoc1C[NH2+][C@@H](C)c1ccc(C)c(C)c1O ZINC000293756120 328277520 /nfs/dbraw/zinc/27/75/20/328277520.db2.gz RRTVVDKRSKMYCW-ZDUSSCGKSA-N 1 0 259.349 3.761 20 10 CHCDRO Cc1ccoc1C[NH2+][C@H](C)c1ccc(C)c(C)c1O ZINC000293756119 328277610 /nfs/dbraw/zinc/27/76/10/328277610.db2.gz RRTVVDKRSKMYCW-CYBMUJFWSA-N 1 0 259.349 3.761 20 10 CHCDRO C[C@H]([NH2+][C@@H](c1ccccn1)C1CCC1)c1ccccc1O ZINC000527969831 330301607 /nfs/dbraw/zinc/30/16/07/330301607.db2.gz RUWQXENOIGXSBL-SCLBCKFNSA-N 1 0 282.387 3.979 20 10 CHCDRO CCC[C@](C)(O)C[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000230661824 333320003 /nfs/dbraw/zinc/32/00/03/333320003.db2.gz ZGBPQDYBECLOPU-ACJLOTCBSA-N 1 0 287.403 3.747 20 10 CHCDRO Oc1ccc(F)cc1C[NH2+][C@H](c1ccccn1)C1CCC1 ZINC000529644991 333503242 /nfs/dbraw/zinc/50/32/42/333503242.db2.gz RUIQQZOHUFVMJQ-KRWDZBQOSA-N 1 0 286.350 3.557 20 10 CHCDRO CCC1(C[NH2+][C@@H](C)c2ccc(C)cc2O)CCOCC1 ZINC000273559423 334767143 /nfs/dbraw/zinc/76/71/43/334767143.db2.gz HRGUTXCIQMGDKO-AWEZNQCLSA-N 1 0 277.408 3.558 20 10 CHCDRO CCC[N@H+](CCC(F)(F)F)Cc1ccccc1O ZINC000265800116 521630264 /nfs/dbraw/zinc/63/02/64/521630264.db2.gz BVKFASINRZXRKV-UHFFFAOYSA-N 1 0 261.287 3.557 20 10 CHCDRO CCCN(Cc1csc(CC)n1)c1ccc(C[NH3+])cc1 ZINC000278110181 521693224 /nfs/dbraw/zinc/69/32/24/521693224.db2.gz ABCOPOYNMTUADP-UHFFFAOYSA-N 1 0 289.448 3.581 20 10 CHCDRO CCOCCCC[NH2+][C@@H](CC)c1ccc(C)cc1O ZINC000279930644 521703337 /nfs/dbraw/zinc/70/33/37/521703337.db2.gz ARNSQFFZYDFONO-HNNXBMFYSA-N 1 0 265.397 3.558 20 10 CHCDRO CC[C@H]([NH2+][C@H](C)[C@@H]1CCCCO1)c1ccc(C)cc1O ZINC000280276148 522735528 /nfs/dbraw/zinc/73/55/28/522735528.db2.gz YFHPSYOGWGQRQU-KMFMINBZSA-N 1 0 277.408 3.699 20 10 CHCDRO CC[C@H]([NH2+][C@H]1CCO[C@@H](C(C)C)C1)c1ccc(C)cc1O ZINC000279977637 522756716 /nfs/dbraw/zinc/75/67/16/522756716.db2.gz DIQNVQYNVFHRMH-QILLFSRXSA-N 1 0 291.435 3.945 20 10 CHCDRO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1cc(C)ccc1O ZINC000071407390 523858927 /nfs/dbraw/zinc/85/89/27/523858927.db2.gz IUQIHBMVDAUUDJ-AWEZNQCLSA-N 1 0 285.387 3.868 20 10 CHCDRO C[C@@H](CCO)CC[NH2+][C@H](C)c1ccc2ccccc2c1O ZINC000297411100 524503557 /nfs/dbraw/zinc/50/35/57/524503557.db2.gz UAZAZFQHMHOCTK-ZIAGYGMSSA-N 1 0 287.403 3.605 20 10 CHCDRO COc1ccccc1[C@H](C)[NH2+][C@H](C)c1cc(F)ccc1O ZINC000094616807 524782956 /nfs/dbraw/zinc/78/29/56/524782956.db2.gz HBECQTMPITVVQH-NWDGAFQWSA-N 1 0 289.350 3.952 20 10 CHCDRO C[C@H]1C[C@@H]1c1ccc(C[NH2+]Cc2ccc(N(C)C)cc2)o1 ZINC000020146019 524860763 /nfs/dbraw/zinc/86/07/63/524860763.db2.gz ZEONXEUHLVAUEL-GUYCJALGSA-N 1 0 284.403 3.759 20 10 CHCDRO Cc1ccc(O)c(C[NH2+][C@@H]2CCCc3ccccc32)c1 ZINC000071406522 525353583 /nfs/dbraw/zinc/35/35/83/525353583.db2.gz XRKMCKLCZSOTES-QGZVFWFLSA-N 1 0 267.372 3.868 20 10 CHCDRO C[C@H]([NH2+]C[C@H]1CCCCO1)c1ccc2ccccc2c1O ZINC000042812038 525413350 /nfs/dbraw/zinc/41/33/50/525413350.db2.gz RRPOGFUDVOIKIR-DZGCQCFKSA-N 1 0 285.387 3.765 20 10 CHCDRO C[C@@H]([NH2+]C[C@@H]1C[C@H]1c1ccccc1)c1ccccc1O ZINC000291233985 525487681 /nfs/dbraw/zinc/48/76/81/525487681.db2.gz UKWFVBPAEDYNPA-KMFMINBZSA-N 1 0 267.372 3.847 20 10 CHCDRO C[C@@H]([NH2+]Cc1ccc(N(C)C)cc1)c1cccc([N+](=O)[O-])c1 ZINC000070869296 525525400 /nfs/dbraw/zinc/52/54/00/525525400.db2.gz ZXJVUBAKBTXNTP-CYBMUJFWSA-N 1 0 299.374 3.512 20 10 CHCDRO C[C@@H]([NH2+][C@@H](C)Cc1cccs1)c1ccccc1O ZINC000036993104 525598160 /nfs/dbraw/zinc/59/81/60/525598160.db2.gz MTBDAUBWCHPXFY-NWDGAFQWSA-N 1 0 261.390 3.736 20 10 CHCDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc3c(n2)CCCC3)c(O)c1 ZINC000278454418 525734900 /nfs/dbraw/zinc/73/49/00/525734900.db2.gz LVWZEKAKSIZHRL-CQSZACIVSA-N 1 0 296.414 3.825 20 10 CHCDRO COc1cccc(C[NH2+]CC(C)(C)c2cccs2)c1O ZINC000083601788 526011889 /nfs/dbraw/zinc/01/18/89/526011889.db2.gz CJAQVQZPSVFNOQ-UHFFFAOYSA-N 1 0 291.416 3.530 20 10 CHCDRO COc1cccc(C[NH2+][C@@H](C)c2cc(C)ccc2O)c1 ZINC000037680360 526031112 /nfs/dbraw/zinc/03/11/12/526031112.db2.gz SICCFRDAAXWHPS-ZDUSSCGKSA-N 1 0 271.360 3.560 20 10 CHCDRO COc1cccc(C[NH2+][C@H](C)c2ccc(C)cc2O)c1 ZINC000037680268 526036619 /nfs/dbraw/zinc/03/66/19/526036619.db2.gz JTFXOWFCSVMHRE-CYBMUJFWSA-N 1 0 271.360 3.560 20 10 CHCDRO Oc1ccccc1C[NH2+][C@@H]1CCSc2ccc(F)cc21 ZINC000036968440 526374588 /nfs/dbraw/zinc/37/45/88/526374588.db2.gz NEORMOCJWRMCGI-CQSZACIVSA-N 1 0 289.375 3.858 20 10 CHCDRO