smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC(C)[C@@H](CC[NH+]1CCCCC1)c1cccc2ccccc21 ZINC000003611042 169901771 /nfs/dbraw/zinc/90/17/71/169901771.db2.gz WARVWELRDCRESP-LJQANCHMSA-N 1 0 295.470 5.455 10 0 CKAERO CCc1ccc(Nc2c3c([nH+]c4ccccc42)CCC3)cc1 ZINC000004923615 170041785 /nfs/dbraw/zinc/04/17/85/170041785.db2.gz JBSYNQYOPVZBEN-UHFFFAOYSA-N 1 0 288.394 5.030 10 0 CKAERO CC[C@@H](C)Nc1ccc([NH+]([C@@H](C)CC)[C@@H](C)CC)cc1 ZINC000005114960 170067333 /nfs/dbraw/zinc/06/73/33/170067333.db2.gz QPTPXMZPICHZRY-PMPSAXMXSA-N 1 0 276.468 5.300 10 0 CKAERO CC[C@@H](C)Nc1ccc([N@@H+]([C@H](C)CC)[C@@H](C)CC)cc1 ZINC000005114965 170067248 /nfs/dbraw/zinc/06/72/48/170067248.db2.gz QPTPXMZPICHZRY-OAGGEKHMSA-N 1 0 276.468 5.300 10 0 CKAERO CC[C@H](C)Nc1ccc([NH+]([C@@H](C)CC)[C@@H](C)CC)cc1 ZINC000005115061 170067177 /nfs/dbraw/zinc/06/71/77/170067177.db2.gz QPTPXMZPICHZRY-JYJNAYRXSA-N 1 0 276.468 5.300 10 0 CKAERO CC[C@@H](C)[N@H+](c1ccc(N[C@@H](C)CC)cc1)[C@@H](C)CC ZINC000005115067 170067182 /nfs/dbraw/zinc/06/71/82/170067182.db2.gz QPTPXMZPICHZRY-HRCADAONSA-N 1 0 276.468 5.300 10 0 CKAERO CC(C)[C@@H]([NH2+][C@H](c1ccccc1)C(C)C)c1ccccc1 ZINC000005284932 170082855 /nfs/dbraw/zinc/08/28/55/170082855.db2.gz UJKCCDIQRNMCBI-BGYRXZFFSA-N 1 0 281.443 5.371 10 0 CKAERO CC(C)[C@H]([NH2+][C@H](c1ccccc1)C(C)C)c1ccccc1 ZINC000005284933 170082868 /nfs/dbraw/zinc/08/28/68/170082868.db2.gz UJKCCDIQRNMCBI-PMACEKPBSA-N 1 0 281.443 5.371 10 0 CKAERO CC(C)[C@@H]([NH2+][C@@H](c1ccccc1)C(C)C)c1ccccc1 ZINC000005285090 170082943 /nfs/dbraw/zinc/08/29/43/170082943.db2.gz UJKCCDIQRNMCBI-WOJBJXKFSA-N 1 0 281.443 5.371 10 0 CKAERO CC(C)c1cc(-c2ccccc2)cc(C(C)C)[n+]1C(C)C ZINC000005285160 170082668 /nfs/dbraw/zinc/08/26/68/170082668.db2.gz DHAXHOPMJQRLJJ-UHFFFAOYSA-N 1 0 282.451 5.469 10 0 CKAERO CCCC[n+]1ccc(-c2ccccc2)cc1-c1ccccc1 ZINC000005310304 170084762 /nfs/dbraw/zinc/08/47/62/170084762.db2.gz ZJEMWHPCOPIBBG-UHFFFAOYSA-N 1 0 288.414 5.108 10 0 CKAERO CCC[n+]1c(C(C)C)cc(-c2ccccc2)cc1C(C)C ZINC000005311205 170084840 /nfs/dbraw/zinc/08/48/40/170084840.db2.gz ZMDWLTKRRRXELM-UHFFFAOYSA-N 1 0 282.451 5.298 10 0 CKAERO CC[C@@H](C)[n+]1c(C(C)C)cc(-c2ccccc2)cc1C(C)C ZINC000005336998 170086861 /nfs/dbraw/zinc/08/68/61/170086861.db2.gz MBQJMBSPQAETCD-QGZVFWFLSA-N 1 0 296.478 5.859 10 0 CKAERO CC[C@@H](C)[n+]1ccc(-c2ccccc2)cc1-c1ccccc1 ZINC000005337005 170087089 /nfs/dbraw/zinc/08/70/89/170087089.db2.gz PZVFHOIXPXZRDV-QGZVFWFLSA-N 1 0 288.414 5.279 10 0 CKAERO CC[C@H](C)[n+]1c(C(C)C)cc(-c2ccccc2)cc1C(C)C ZINC000005337369 170087100 /nfs/dbraw/zinc/08/71/00/170087100.db2.gz MBQJMBSPQAETCD-KRWDZBQOSA-N 1 0 296.478 5.859 10 0 CKAERO CC[C@H](C)[n+]1ccc(-c2ccccc2)cc1-c1ccccc1 ZINC000005337375 170087057 /nfs/dbraw/zinc/08/70/57/170087057.db2.gz PZVFHOIXPXZRDV-KRWDZBQOSA-N 1 0 288.414 5.279 10 0 CKAERO CC(C)(C)C1CCC(c2ccccc2)([NH+]2CCCCC2)CC1 ZINC000005434499 170098977 /nfs/dbraw/zinc/09/89/77/170098977.db2.gz LHYFVODMMVABLM-UHFFFAOYSA-N 1 0 299.502 5.604 10 0 CKAERO CC(C)(C)Nc1cc(-c2ccccc2)[nH+]c2ccccc12 ZINC000005950355 170161199 /nfs/dbraw/zinc/16/11/99/170161199.db2.gz FVPJOMUUSSQZKZ-UHFFFAOYSA-N 1 0 276.383 5.112 10 0 CKAERO CCc1ccc(C)[n+]([C@@H](C)CCC(C)(C)CC(C)(C)C)c1 ZINC000005956286 170162109 /nfs/dbraw/zinc/16/21/09/170162109.db2.gz BODONJWIOLVTEV-KRWDZBQOSA-N 1 0 290.515 5.649 10 0 CKAERO CCc1ccc(C)[n+]([C@H](C)CCC(C)(C)CC(C)(C)C)c1 ZINC000005956292 170162368 /nfs/dbraw/zinc/16/23/68/170162368.db2.gz BODONJWIOLVTEV-QGZVFWFLSA-N 1 0 290.515 5.649 10 0 CKAERO Cc1ccc(C(=[NH2+])c2cccc3ccccc32)c2c1CCC2 ZINC000006070746 170174192 /nfs/dbraw/zinc/17/41/92/170174192.db2.gz HNWKMRFXNDEZLF-UHFFFAOYSA-N 1 0 285.390 5.053 10 0 CKAERO c1ccc([C@@H](C[NH2+]C2CCCCC2)C2CCCCC2)cc1 ZINC000006116198 170176463 /nfs/dbraw/zinc/17/64/63/170176463.db2.gz GAFLDXPJRZTPPV-HXUWFJFHSA-N 1 0 285.475 5.273 10 0 CKAERO c1ccc([C@H](C[NH2+]C2CCCCC2)C2CCCCC2)cc1 ZINC000006116394 170177141 /nfs/dbraw/zinc/17/71/41/170177141.db2.gz GAFLDXPJRZTPPV-FQEVSTJZSA-N 1 0 285.475 5.273 10 0 CKAERO O=C1CCCC[C@H]1/C1=[NH+]\CCCCCCCCCCC1 ZINC000006691852 170226531 /nfs/dbraw/zinc/22/65/31/170226531.db2.gz MTODEPJZNVUEGQ-NCJSADBTSA-N 1 0 277.452 5.101 10 0 CKAERO O=C1CCCC[C@@H]1/C1=[NH+]\CCCCCCCCCCC1 ZINC000006691853 170226547 /nfs/dbraw/zinc/22/65/47/170226547.db2.gz MTODEPJZNVUEGQ-CWFNNOHCSA-N 1 0 277.452 5.101 10 0 CKAERO CCc1c(C[N@H+](Cc2ccccc2)C(C)C)csc1C ZINC000006895153 170254211 /nfs/dbraw/zinc/25/42/11/170254211.db2.gz XVWMZRRFADCQLL-UHFFFAOYSA-N 1 0 287.472 5.030 10 0 CKAERO [NH3+][C@@H](c1ccc(C2CCCCC2)cc1)C1CCCCC1 ZINC000009245958 170368279 /nfs/dbraw/zinc/36/82/79/170368279.db2.gz WLYFLFUCTCJHMT-LJQANCHMSA-N 1 0 271.448 5.314 10 0 CKAERO CCC[C@H]([NH2+]C/C=C/c1ccc(Cl)cc1)c1ccccc1 ZINC000010436302 170406961 /nfs/dbraw/zinc/40/69/61/170406961.db2.gz YOZOCTHQVLNTHW-FNQPIQQGSA-N 1 0 299.845 5.484 10 0 CKAERO CC(C)c1ccc(C[C@@H]([NH3+])c2ccc(C(C)C)cc2)cc1 ZINC000011604337 170426848 /nfs/dbraw/zinc/42/68/48/170426848.db2.gz NZSYFDUXYCLYEQ-HXUWFJFHSA-N 1 0 281.443 5.176 10 0 CKAERO CCC[NH2+]C1(c2cc3ccccc3s2)CCCCC1 ZINC000013732116 170583632 /nfs/dbraw/zinc/58/36/32/170583632.db2.gz ZTPIVFSAHJOUHQ-UHFFFAOYSA-N 1 0 273.445 5.060 10 0 CKAERO C[C@@H]([NH2+][C@@H](C)c1ccc(F)c(Cl)c1)c1cccc(F)c1 ZINC000019232182 327867758 /nfs/dbraw/zinc/86/77/58/327867758.db2.gz XBVPIOSTRHHCNC-MNOVXSKESA-N 1 0 295.760 5.030 10 0 CKAERO C[C@H]([NH2+][C@@H](C)c1ccc(F)c(Cl)c1)c1cccc(F)c1 ZINC000019232183 262049277 /nfs/dbraw/zinc/04/92/77/262049277.db2.gz XBVPIOSTRHHCNC-QWRGUYRKSA-N 1 0 295.760 5.030 10 0 CKAERO C[C@@H]([NH2+][C@H](C)c1ccc(F)c(Cl)c1)c1cccc(F)c1 ZINC000019232184 327867996 /nfs/dbraw/zinc/86/79/96/327867996.db2.gz XBVPIOSTRHHCNC-GHMZBOCLSA-N 1 0 295.760 5.030 10 0 CKAERO C[C@@H]([NH2+][C@@H](C)c1cccc(F)c1)c1ccc(F)c(Cl)c1 ZINC000019232185 327867990 /nfs/dbraw/zinc/86/79/90/327867990.db2.gz XBVPIOSTRHHCNC-WDEREUQCSA-N 1 0 295.760 5.030 10 0 CKAERO CC[C@@H]([NH2+][C@@H](C)c1cccc(Cl)c1)c1ccccc1 ZINC000019978815 170957805 /nfs/dbraw/zinc/95/78/05/170957805.db2.gz VHYSXVROSCBYNX-SUMWQHHRSA-N 1 0 273.807 5.142 10 0 CKAERO CCCc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@@H](C)[C@@H]2C)cc1 ZINC000019980301 170958894 /nfs/dbraw/zinc/95/88/94/170958894.db2.gz LNXHZUIOYRFOMY-PASDCYSWSA-N 1 0 273.464 5.114 10 0 CKAERO CC[C@@H](C)c1ccccc1Oc1ccccc1[C@H](C)[NH3+] ZINC000019981498 170959555 /nfs/dbraw/zinc/95/95/55/170959555.db2.gz HYZALUNVRPWONG-KGLIPLIRSA-N 1 0 269.388 5.012 10 0 CKAERO CC[C@H](C)c1ccccc1Oc1ccccc1[C@H](C)[NH3+] ZINC000019981502 170959438 /nfs/dbraw/zinc/95/94/38/170959438.db2.gz HYZALUNVRPWONG-KBPBESRZSA-N 1 0 269.388 5.012 10 0 CKAERO CC[C@@H]([NH2+][C@@H](C)c1cccc(F)c1)c1cccc(Cl)c1 ZINC000019984870 170960726 /nfs/dbraw/zinc/96/07/26/170960726.db2.gz GLSLMQUQYTVKHI-YVEFUNNKSA-N 1 0 291.797 5.281 10 0 CKAERO CC[C@H]([NH2+][C@H](C)c1cccc(F)c1)c1cccc(Cl)c1 ZINC000019984883 170960786 /nfs/dbraw/zinc/96/07/86/170960786.db2.gz GLSLMQUQYTVKHI-PXAZEXFGSA-N 1 0 291.797 5.281 10 0 CKAERO CC(C)Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2cccs2)cc1 ZINC000019985839 170961185 /nfs/dbraw/zinc/96/11/85/170961185.db2.gz XRFKZUOQWDGYMO-CABCVRRESA-N 1 0 287.472 5.358 10 0 CKAERO CC[C@@H]([NH2+][C@@H]1CCc2ccccc21)c1ccc(Cl)cc1 ZINC000019986610 262211469 /nfs/dbraw/zinc/21/14/69/262211469.db2.gz PXBXOQMRTUACRP-QZTJIDSGSA-N 1 0 285.818 5.068 10 0 CKAERO CC[C@H]([NH2+][C@@H]1CCc2ccccc21)c1ccc(Cl)cc1 ZINC000019986614 262211316 /nfs/dbraw/zinc/21/13/16/262211316.db2.gz PXBXOQMRTUACRP-ZWKOTPCHSA-N 1 0 285.818 5.068 10 0 CKAERO CC[C@@H]([NH2+][C@H]1CCc2ccccc21)c1ccc(Cl)cc1 ZINC000019986617 262211562 /nfs/dbraw/zinc/21/15/62/262211562.db2.gz PXBXOQMRTUACRP-MSOLQXFVSA-N 1 0 285.818 5.068 10 0 CKAERO CC[C@H]([NH2+][C@H]1CCc2ccccc21)c1ccc(Cl)cc1 ZINC000019986622 262211646 /nfs/dbraw/zinc/21/16/46/262211646.db2.gz PXBXOQMRTUACRP-ROUUACIJSA-N 1 0 285.818 5.068 10 0 CKAERO CC[C@@H]([NH2+][C@H](C)c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000019992429 170962834 /nfs/dbraw/zinc/96/28/34/170962834.db2.gz UPSBJODEUQLNSR-SJKOYZFVSA-N 1 0 291.797 5.281 10 0 CKAERO C[C@H]([NH2+][C@H]1C[C@@H](C)CC(C)(C)C1)c1ccccc1Cl ZINC000019993317 170962852 /nfs/dbraw/zinc/96/28/52/170962852.db2.gz SRHZNWWVMBSCOQ-RDBSUJKOSA-N 1 0 279.855 5.205 10 0 CKAERO CCCC[C@@H](CC)C[NH2+][C@@H](CCC)c1ccccc1 ZINC000019994260 170963368 /nfs/dbraw/zinc/96/33/68/170963368.db2.gz BRYIQJCPEKIUNG-AEFFLSMTSA-N 1 0 261.453 5.334 10 0 CKAERO CCCC[C@H](CC)C[NH2+][C@H](CCC)c1ccccc1 ZINC000019994269 170963398 /nfs/dbraw/zinc/96/33/98/170963398.db2.gz BRYIQJCPEKIUNG-FUHWJXTLSA-N 1 0 261.453 5.334 10 0 CKAERO C[C@H]([NH2+]Cc1cccc2ccccc21)c1cccc(Cl)c1 ZINC000019994922 170963797 /nfs/dbraw/zinc/96/37/97/170963797.db2.gz MORWNZKLRJATGH-AWEZNQCLSA-N 1 0 295.813 5.344 10 0 CKAERO CC(C)CCC[C@H](C)[NH2+][C@@H](C)c1ccc(Cl)cc1 ZINC000019999012 170965239 /nfs/dbraw/zinc/96/52/39/170965239.db2.gz FQLJJQLXLYFJFS-KBPBESRZSA-N 1 0 267.844 5.205 10 0 CKAERO CC(C)CCC[C@H](C)[NH2+][C@H](C)c1ccc(Cl)cc1 ZINC000019999016 170965368 /nfs/dbraw/zinc/96/53/68/170965368.db2.gz FQLJJQLXLYFJFS-UONOGXRCSA-N 1 0 267.844 5.205 10 0 CKAERO C[C@@H]([NH2+]C1CCCCC1)c1ccc(-c2ccccc2)cc1 ZINC000020000354 170965884 /nfs/dbraw/zinc/96/58/84/170965884.db2.gz KIOPDOWFYDCEHI-MRXNPFEDSA-N 1 0 279.427 5.337 10 0 CKAERO Cc1cc([C@@H](C)[NH2+][C@H](C)CCCC(C)C)c(C)s1 ZINC000020001484 170966184 /nfs/dbraw/zinc/96/61/84/170966184.db2.gz PJMTTWCDQNDSMJ-TZMCWYRMSA-N 1 0 267.482 5.230 10 0 CKAERO CCC(C)(C)c1ccc(Oc2ccc([C@H](C)[NH3+])cc2)cc1 ZINC000020004462 170967057 /nfs/dbraw/zinc/96/70/57/170967057.db2.gz AGDSNTAEPQYQPD-AWEZNQCLSA-N 1 0 283.415 5.186 10 0 CKAERO CC(C)CC[C@@H](C)[NH2+]C1c2ccccc2-c2ccccc21 ZINC000020005707 170967462 /nfs/dbraw/zinc/96/74/62/170967462.db2.gz VHXIQADNALJCNR-OAHLLOKOSA-N 1 0 279.427 5.171 10 0 CKAERO CC(C)CC[C@H](C)[NH2+]C1c2ccccc2-c2ccccc21 ZINC000020005710 170967329 /nfs/dbraw/zinc/96/73/29/170967329.db2.gz VHXIQADNALJCNR-HNNXBMFYSA-N 1 0 279.427 5.171 10 0 CKAERO CC[C@@H]([NH2+][C@@H](C)c1ccccc1)c1ccc(Cl)cc1 ZINC000020008164 170968138 /nfs/dbraw/zinc/96/81/38/170968138.db2.gz WKSXUIQLXADQOT-SUMWQHHRSA-N 1 0 273.807 5.142 10 0 CKAERO CC[C@H]([NH2+][C@@H](C)c1ccccc1)c1ccc(Cl)cc1 ZINC000020008167 170968129 /nfs/dbraw/zinc/96/81/29/170968129.db2.gz WKSXUIQLXADQOT-GUYCJALGSA-N 1 0 273.807 5.142 10 0 CKAERO CC(C)c1ccc([C@@H](C)[NH2+][C@H]2CCCC[C@@H]2C)cc1 ZINC000020012433 170969032 /nfs/dbraw/zinc/96/90/32/170969032.db2.gz BOYMCEYSEPCUSG-DAYGRLMNSA-N 1 0 259.437 5.039 10 0 CKAERO CC(C)C[C@@H](C)[NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000020012803 170969129 /nfs/dbraw/zinc/96/91/29/170969129.db2.gz KTKQGTYKYDDULG-MNOVXSKESA-N 1 0 274.235 5.079 10 0 CKAERO C[C@H]([NH2+]C1CCC(C)CC1)c1ccc2ccccc2c1 ZINC000020014936 170969752 /nfs/dbraw/zinc/96/97/52/170969752.db2.gz KCVDYEMWPYGNRT-HVEKOLDVSA-N 1 0 267.416 5.069 10 0 CKAERO C[C@@H]([NH2+]C1CCC(C)CC1)c1ccc2ccccc2c1 ZINC000020014939 170969995 /nfs/dbraw/zinc/96/99/95/170969995.db2.gz KCVDYEMWPYGNRT-XAUUPUKJSA-N 1 0 267.416 5.069 10 0 CKAERO CC(C)c1ccc([C@@H](C)[NH2+][C@@H]2CCC[C@@H](C)[C@@H]2C)cc1 ZINC000020015320 170970127 /nfs/dbraw/zinc/97/01/27/170970127.db2.gz VMLOQEADIAMPNM-YYAJDYIMSA-N 1 0 273.464 5.285 10 0 CKAERO CC(C)c1ccc([C@@H](C)[NH2+][C@H]2CCC[C@@H](C)[C@@H]2C)cc1 ZINC000020015326 170969821 /nfs/dbraw/zinc/96/98/21/170969821.db2.gz VMLOQEADIAMPNM-OLMMMNRUSA-N 1 0 273.464 5.285 10 0 CKAERO CCc1c2ccccc2oc1[C@@H](C)[NH2+][C@@H]1CCCC[C@@H]1C ZINC000020016501 170970252 /nfs/dbraw/zinc/97/02/52/170970252.db2.gz ZGSULGFGGVIMHH-JJRVBVJISA-N 1 0 285.431 5.225 10 0 CKAERO CCc1c2ccccc2oc1[C@H](C)[NH2+][C@@H]1CCCC[C@@H]1C ZINC000020016504 170970265 /nfs/dbraw/zinc/97/02/65/170970265.db2.gz ZGSULGFGGVIMHH-GRDNDAEWSA-N 1 0 285.431 5.225 10 0 CKAERO CCc1c2ccccc2oc1[C@@H](C)[NH2+][C@H]1CCCC[C@@H]1C ZINC000020016507 170970360 /nfs/dbraw/zinc/97/03/60/170970360.db2.gz ZGSULGFGGVIMHH-VBQJREDUSA-N 1 0 285.431 5.225 10 0 CKAERO C[C@@H]([NH2+]CC1CCCCC1)c1ccc(Cl)cc1Cl ZINC000020017886 170970582 /nfs/dbraw/zinc/97/05/82/170970582.db2.gz POGCLTGPXWTYBW-LLVKDONJSA-N 1 0 286.246 5.224 10 0 CKAERO C[C@H]([NH2+]CC1CCCCC1)c1ccc(Cl)cc1Cl ZINC000020017888 170970467 /nfs/dbraw/zinc/97/04/67/170970467.db2.gz POGCLTGPXWTYBW-NSHDSACASA-N 1 0 286.246 5.224 10 0 CKAERO C[C@@H]([NH2+]C1CCCCCCC1)c1ccccc1C(F)(F)F ZINC000020019659 170971353 /nfs/dbraw/zinc/97/13/53/170971353.db2.gz NBTBPDXFBYPFTN-CYBMUJFWSA-N 1 0 299.380 5.469 10 0 CKAERO C[C@H]([NH2+]C1CCCCCCC1)c1ccccc1C(F)(F)F ZINC000020019662 170971030 /nfs/dbraw/zinc/97/10/30/170971030.db2.gz NBTBPDXFBYPFTN-ZDUSSCGKSA-N 1 0 299.380 5.469 10 0 CKAERO C[C@H]([NH2+][C@H]1CCCC[C@@H]1C)c1ccc2ccccc2c1 ZINC000020021744 170971754 /nfs/dbraw/zinc/97/17/54/170971754.db2.gz AVJZDZXOHVRRPG-DOXZYTNZSA-N 1 0 267.416 5.069 10 0 CKAERO C[C@H]([NH2+][C@@H]1CCCC[C@@H]1C)c1ccc2ccccc2c1 ZINC000020021750 170971624 /nfs/dbraw/zinc/97/16/24/170971624.db2.gz AVJZDZXOHVRRPG-YZVOILCLSA-N 1 0 267.416 5.069 10 0 CKAERO C[C@@H]([NH2+][C@@H](C)c1cccs1)c1ccc(C(F)(F)F)cc1 ZINC000020148536 171036611 /nfs/dbraw/zinc/03/66/11/171036611.db2.gz ARRCJTKMLZLDJG-MNOVXSKESA-N 1 0 299.361 5.179 10 0 CKAERO C[C@@H]([NH2+][C@H](C)c1ccc(C(F)(F)F)cc1)c1cccs1 ZINC000020148538 171036813 /nfs/dbraw/zinc/03/68/13/171036813.db2.gz ARRCJTKMLZLDJG-GHMZBOCLSA-N 1 0 299.361 5.179 10 0 CKAERO CCCCCC[NH2+][C@@H](c1ccc(CC)cc1)C(C)C ZINC000020361912 171160309 /nfs/dbraw/zinc/16/03/09/171160309.db2.gz BEVVEUABKJEENA-GOSISDBHSA-N 1 0 261.453 5.116 10 0 CKAERO CCCCC1CCC([C@@H]([NH3+])c2ccc(Cl)s2)CC1 ZINC000020375030 171170717 /nfs/dbraw/zinc/17/07/17/171170717.db2.gz NDWORZJFWOGDTB-KOHJWAIASA-N 1 0 285.884 5.398 10 0 CKAERO CCCCC1CCC([C@H]([NH3+])c2ccc(Cl)s2)CC1 ZINC000020375033 171170735 /nfs/dbraw/zinc/17/07/35/171170735.db2.gz NDWORZJFWOGDTB-QOZQQMKHSA-N 1 0 285.884 5.398 10 0 CKAERO CCCCC[C@@H]([NH3+])c1ccc(C2CCCCC2)cc1 ZINC000020481377 171221651 /nfs/dbraw/zinc/22/16/51/171221651.db2.gz KAFVGJSMTQZSBZ-GOSISDBHSA-N 1 0 259.437 5.314 10 0 CKAERO CCCCC[C@H]([NH3+])c1ccc(C2CCCCC2)cc1 ZINC000020481380 171221783 /nfs/dbraw/zinc/22/17/83/171221783.db2.gz KAFVGJSMTQZSBZ-SFHVURJKSA-N 1 0 259.437 5.314 10 0 CKAERO CCCCC[C@@H]([NH3+])c1ccc(C(C)C)cc1C(C)C ZINC000020481395 171222277 /nfs/dbraw/zinc/22/22/77/171222277.db2.gz TVZSVRXQYRMPRD-GOSISDBHSA-N 1 0 261.453 5.514 10 0 CKAERO CCCCC[C@H]([NH3+])c1ccc(C(C)C)cc1C(C)C ZINC000020481397 171222164 /nfs/dbraw/zinc/22/21/64/171222164.db2.gz TVZSVRXQYRMPRD-SFHVURJKSA-N 1 0 261.453 5.514 10 0 CKAERO CCCC[C@@H](CC)[C@@H]([NH3+])c1ccc([C@@H](C)CC)cc1 ZINC000020482508 171222868 /nfs/dbraw/zinc/22/28/68/171222868.db2.gz WCFLMWHFSAJVOC-HDMKZQKVSA-N 1 0 261.453 5.416 10 0 CKAERO CCCC[C@H](CC)[C@@H]([NH3+])c1ccc([C@@H](C)CC)cc1 ZINC000020482510 171222788 /nfs/dbraw/zinc/22/27/88/171222788.db2.gz WCFLMWHFSAJVOC-RLFYNMQTSA-N 1 0 261.453 5.416 10 0 CKAERO CCCC[C@@H](CC)[C@H]([NH3+])c1ccc([C@@H](C)CC)cc1 ZINC000020482512 171222780 /nfs/dbraw/zinc/22/27/80/171222780.db2.gz WCFLMWHFSAJVOC-DAYGRLMNSA-N 1 0 261.453 5.416 10 0 CKAERO CCCC[C@H](CC)[C@H]([NH3+])c1ccc([C@@H](C)CC)cc1 ZINC000020482514 171222864 /nfs/dbraw/zinc/22/28/64/171222864.db2.gz WCFLMWHFSAJVOC-MPGHIAIKSA-N 1 0 261.453 5.416 10 0 CKAERO CCCC[C@@H](CC)[C@@H]([NH3+])c1ccc(C(C)(C)C)cc1 ZINC000020482516 171222885 /nfs/dbraw/zinc/22/28/85/171222885.db2.gz XYDKURWZNJIGRV-RHSMWYFYSA-N 1 0 261.453 5.200 10 0 CKAERO CCCC[C@H](CC)[C@@H]([NH3+])c1ccc(C(C)(C)C)cc1 ZINC000020482518 171223137 /nfs/dbraw/zinc/22/31/37/171223137.db2.gz XYDKURWZNJIGRV-WMLDXEAASA-N 1 0 261.453 5.200 10 0 CKAERO CCCC[C@@H](CC)[C@H]([NH3+])c1ccc(C(C)(C)C)cc1 ZINC000020482520 171223078 /nfs/dbraw/zinc/22/30/78/171223078.db2.gz XYDKURWZNJIGRV-PBHICJAKSA-N 1 0 261.453 5.200 10 0 CKAERO CCCC[C@H](CC)[C@H]([NH3+])c1ccc(C(C)(C)C)cc1 ZINC000020482522 171222756 /nfs/dbraw/zinc/22/27/56/171222756.db2.gz XYDKURWZNJIGRV-YOEHRIQHSA-N 1 0 261.453 5.200 10 0 CKAERO CCCCCC[C@@H](C)[NH2+][C@@H](C)c1ccc(Cl)cc1 ZINC000020520171 171234045 /nfs/dbraw/zinc/23/40/45/171234045.db2.gz VLSFSXXRFMHYIU-KGLIPLIRSA-N 1 0 267.844 5.350 10 0 CKAERO CCCCCC[C@@H](C)[NH2+][C@@H]1CCCc2ccccc21 ZINC000020520265 171233815 /nfs/dbraw/zinc/23/38/15/171233815.db2.gz IEJBBMMDKPVSTI-CRAIPNDOSA-N 1 0 259.437 5.013 10 0 CKAERO CCCCCC[C@H](C)[NH2+][C@@H]1CCCc2ccccc21 ZINC000020520266 171234135 /nfs/dbraw/zinc/23/41/35/171234135.db2.gz IEJBBMMDKPVSTI-MAUKXSAKSA-N 1 0 259.437 5.013 10 0 CKAERO CCCCCC[C@@H](C)[NH2+][C@H]1CCCc2ccccc21 ZINC000020520267 171234047 /nfs/dbraw/zinc/23/40/47/171234047.db2.gz IEJBBMMDKPVSTI-QAPCUYQASA-N 1 0 259.437 5.013 10 0 CKAERO CCCCCC[C@H](C)[NH2+][C@H]1CCCc2ccccc21 ZINC000020520268 171234121 /nfs/dbraw/zinc/23/41/21/171234121.db2.gz IEJBBMMDKPVSTI-YJBOKZPZSA-N 1 0 259.437 5.013 10 0 CKAERO Cc1ccc(C(C)(C)C)c(Oc2ccc([C@H](C)[NH3+])cc2)c1 ZINC000020523713 171237115 /nfs/dbraw/zinc/23/71/15/171237115.db2.gz JZFCJWGRHDWYDE-AWEZNQCLSA-N 1 0 283.415 5.105 10 0 CKAERO Cc1ccc(C(C)(C)C)c(Oc2ccccc2[C@H](C)[NH3+])c1 ZINC000020523715 171236762 /nfs/dbraw/zinc/23/67/62/171236762.db2.gz KSMVTSXEUXFMMS-AWEZNQCLSA-N 1 0 283.415 5.105 10 0 CKAERO C[C@@H]([NH2+][C@@H]1CCC(C)(C)c2ccccc21)c1ccccc1 ZINC000020525509 171238140 /nfs/dbraw/zinc/23/81/40/171238140.db2.gz HBGIYXIGRUZLHA-DNVCBOLYSA-N 1 0 279.427 5.150 10 0 CKAERO C[C@H]([NH2+][C@@H]1CCC(C)(C)c2ccccc21)c1ccccc1 ZINC000020525510 171238160 /nfs/dbraw/zinc/23/81/60/171238160.db2.gz HBGIYXIGRUZLHA-HNAYVOBHSA-N 1 0 279.427 5.150 10 0 CKAERO C[C@@H]([NH2+][C@H]1CCC(C)(C)c2ccccc21)c1ccccc1 ZINC000020525511 171238012 /nfs/dbraw/zinc/23/80/12/171238012.db2.gz HBGIYXIGRUZLHA-BEFAXECRSA-N 1 0 279.427 5.150 10 0 CKAERO C[C@H]([NH2+][C@H]1CCC(C)(C)c2ccccc21)c1ccccc1 ZINC000020525512 171238249 /nfs/dbraw/zinc/23/82/49/171238249.db2.gz HBGIYXIGRUZLHA-KXBFYZLASA-N 1 0 279.427 5.150 10 0 CKAERO C[C@@H]([NH2+][C@@H]1CCC(C)(C)c2ccccc21)c1cccs1 ZINC000020525750 171238540 /nfs/dbraw/zinc/23/85/40/171238540.db2.gz SDPWTNVHPWDHTR-CZUORRHYSA-N 1 0 285.456 5.211 10 0 CKAERO C[C@H]([NH2+][C@@H]1CCC(C)(C)c2ccccc21)c1cccs1 ZINC000020525751 171238693 /nfs/dbraw/zinc/23/86/93/171238693.db2.gz SDPWTNVHPWDHTR-XJKSGUPXSA-N 1 0 285.456 5.211 10 0 CKAERO C[C@@H]([NH2+][C@H]1CCC(C)(C)c2ccccc21)c1cccs1 ZINC000020525752 171238551 /nfs/dbraw/zinc/23/85/51/171238551.db2.gz SDPWTNVHPWDHTR-CJNGLKHVSA-N 1 0 285.456 5.211 10 0 CKAERO C[C@H]([NH2+][C@H]1CCC(C)(C)c2ccccc21)c1cccs1 ZINC000020525753 171238493 /nfs/dbraw/zinc/23/84/93/171238493.db2.gz SDPWTNVHPWDHTR-BBRMVZONSA-N 1 0 285.456 5.211 10 0 CKAERO CC[C@@H]([NH2+]C1CCCCCCC1)c1ccc(C)cc1 ZINC000020544535 171242878 /nfs/dbraw/zinc/24/28/78/171242878.db2.gz SEUAJGKBPXNWQP-GOSISDBHSA-N 1 0 259.437 5.149 10 0 CKAERO CC[C@H]([NH2+]C1CCCCCCC1)c1ccc(C)cc1 ZINC000020544537 171242861 /nfs/dbraw/zinc/24/28/61/171242861.db2.gz SEUAJGKBPXNWQP-SFHVURJKSA-N 1 0 259.437 5.149 10 0 CKAERO C[C@H]([NH2+][C@@H]1C[C@@H](C)CC(C)(C)C1)c1ccc(Cl)cc1 ZINC000020544561 171242965 /nfs/dbraw/zinc/24/29/65/171242965.db2.gz BLCIKLPWAZHRPG-DVOMOZLQSA-N 1 0 279.855 5.205 10 0 CKAERO C[C@H]([NH2+][C@@H]1C[C@H](C)CC(C)(C)C1)c1ccc(Cl)cc1 ZINC000020544563 171243205 /nfs/dbraw/zinc/24/32/05/171243205.db2.gz BLCIKLPWAZHRPG-HEHGZKQESA-N 1 0 279.855 5.205 10 0 CKAERO C[C@H]([NH2+][C@H]1C[C@@H](C)CC(C)(C)C1)c1ccc(Cl)cc1 ZINC000020544565 171242995 /nfs/dbraw/zinc/24/29/95/171242995.db2.gz BLCIKLPWAZHRPG-WWGRRREGSA-N 1 0 279.855 5.205 10 0 CKAERO C[C@H]([NH2+][C@H]1C[C@H](C)CC(C)(C)C1)c1ccc(Cl)cc1 ZINC000020544567 171243073 /nfs/dbraw/zinc/24/30/73/171243073.db2.gz BLCIKLPWAZHRPG-XEZPLFJOSA-N 1 0 279.855 5.205 10 0 CKAERO CCC(CC)[NH2+][C@@H](c1ccccc1)c1ccc(C)cc1C ZINC000020545032 171242972 /nfs/dbraw/zinc/24/29/72/171242972.db2.gz DRMBZUUNAFFHFB-FQEVSTJZSA-N 1 0 281.443 5.171 10 0 CKAERO CCC(CC)[NH2+][C@H](c1ccccc1)c1ccc(C)cc1C ZINC000020545033 171243152 /nfs/dbraw/zinc/24/31/52/171243152.db2.gz DRMBZUUNAFFHFB-HXUWFJFHSA-N 1 0 281.443 5.171 10 0 CKAERO CCC(CC)[NH2+][C@H](c1ccccc1)C1CCCCC1 ZINC000020545197 171243368 /nfs/dbraw/zinc/24/33/68/171243368.db2.gz CPDFZUVFZCMOBI-GOSISDBHSA-N 1 0 259.437 5.086 10 0 CKAERO CCC(CC)[NH2+][C@@H](c1ccccc1)C1CCCCC1 ZINC000020545198 171243348 /nfs/dbraw/zinc/24/33/48/171243348.db2.gz CPDFZUVFZCMOBI-SFHVURJKSA-N 1 0 259.437 5.086 10 0 CKAERO CC(C)c1ccc(Sc2cccc(F)c2[C@@H](C)[NH3+])cc1 ZINC000020545758 171243630 /nfs/dbraw/zinc/24/36/30/171243630.db2.gz VYBJVOFIAWVICP-GFCCVEGCSA-N 1 0 289.419 5.120 10 0 CKAERO CC(C)c1ccc(Sc2cccc(F)c2[C@H](C)[NH3+])cc1 ZINC000020545759 171243792 /nfs/dbraw/zinc/24/37/92/171243792.db2.gz VYBJVOFIAWVICP-LBPRGKRZSA-N 1 0 289.419 5.120 10 0 CKAERO C[C@H]([NH2+][C@@H]1CCC[C@@H](C)C1)c1ccc(Cl)c(Cl)c1 ZINC000020546190 171243995 /nfs/dbraw/zinc/24/39/95/171243995.db2.gz UJISXLRHZAPPPL-NTZNESFSSA-N 1 0 286.246 5.223 10 0 CKAERO C[C@H]([NH2+][C@H]1CCC[C@@H](C)C1)c1ccc(Cl)c(Cl)c1 ZINC000020546192 171243878 /nfs/dbraw/zinc/24/38/78/171243878.db2.gz UJISXLRHZAPPPL-MDZLAQPJSA-N 1 0 286.246 5.223 10 0 CKAERO CCC(C)(C)C1CCC([NH2+]Cc2ccc(Cl)cc2)CC1 ZINC000020546394 171244201 /nfs/dbraw/zinc/24/42/01/171244201.db2.gz OLAXAZHIPBTZHW-UHFFFAOYSA-N 1 0 293.882 5.425 10 0 CKAERO CCCC[C@@H]([NH2+][C@@H](C)c1ccccc1)c1ccc(F)cc1 ZINC000020546569 171244142 /nfs/dbraw/zinc/24/41/42/171244142.db2.gz BSJRZTOGRDXQPC-HNAYVOBHSA-N 1 0 285.406 5.408 10 0 CKAERO CCCC[C@H]([NH2+][C@@H](C)c1ccccc1)c1ccc(F)cc1 ZINC000020546570 171244121 /nfs/dbraw/zinc/24/41/21/171244121.db2.gz BSJRZTOGRDXQPC-KXBFYZLASA-N 1 0 285.406 5.408 10 0 CKAERO CCCC[C@@H]([NH2+][C@H](C)c1ccccc1)c1ccc(F)cc1 ZINC000020546571 171244059 /nfs/dbraw/zinc/24/40/59/171244059.db2.gz BSJRZTOGRDXQPC-DNVCBOLYSA-N 1 0 285.406 5.408 10 0 CKAERO CCCC[C@H]([NH2+][C@H](C)c1ccccc1)c1ccc(F)cc1 ZINC000020546573 171243947 /nfs/dbraw/zinc/24/39/47/171243947.db2.gz BSJRZTOGRDXQPC-BEFAXECRSA-N 1 0 285.406 5.408 10 0 CKAERO CC[C@@H]([NH2+][C@H](C)CCCC(C)C)c1cccs1 ZINC000020546686 171244449 /nfs/dbraw/zinc/24/44/49/171244449.db2.gz PQIBAJPBLOXMTH-ZIAGYGMSSA-N 1 0 253.455 5.004 10 0 CKAERO CC[C@H]([NH2+][C@H](C)CCCC(C)C)c1cccs1 ZINC000020546688 171244300 /nfs/dbraw/zinc/24/43/00/171244300.db2.gz PQIBAJPBLOXMTH-KGLIPLIRSA-N 1 0 253.455 5.004 10 0 CKAERO Cc1ccc([C@H](C)[NH2+][C@H](C)CCCC(C)C)c(C)c1 ZINC000020546852 171244452 /nfs/dbraw/zinc/24/44/52/171244452.db2.gz LCZAZDNDEBNXBF-SJORKVTESA-N 1 0 261.453 5.169 10 0 CKAERO Cc1ccc([C@H](C)[NH2+][C@@H](C)CCCC(C)C)c(C)c1 ZINC000020546853 171244622 /nfs/dbraw/zinc/24/46/22/171244622.db2.gz LCZAZDNDEBNXBF-IRXDYDNUSA-N 1 0 261.453 5.169 10 0 CKAERO Cc1ccc([C@@H](C)[NH2+][C@H](C)CCCC(C)C)c(C)c1 ZINC000020546854 171244676 /nfs/dbraw/zinc/24/46/76/171244676.db2.gz LCZAZDNDEBNXBF-IAGOWNOFSA-N 1 0 261.453 5.169 10 0 CKAERO Cc1ccc([C@@H](C)[NH2+][C@@H](C)CCCC(C)C)c(C)c1 ZINC000020546855 171244570 /nfs/dbraw/zinc/24/45/70/171244570.db2.gz LCZAZDNDEBNXBF-DLBZAZTESA-N 1 0 261.453 5.169 10 0 CKAERO CC[C@@H]([NH2+][C@@H](C)CCC(C)C)c1ccc(Cl)cc1 ZINC000020547126 171244379 /nfs/dbraw/zinc/24/43/79/171244379.db2.gz KQJVLTQYALHRNK-XJKSGUPXSA-N 1 0 267.844 5.205 10 0 CKAERO CC[C@H]([NH2+][C@@H](C)CCC(C)C)c1ccc(Cl)cc1 ZINC000020547127 171244392 /nfs/dbraw/zinc/24/43/92/171244392.db2.gz KQJVLTQYALHRNK-BBRMVZONSA-N 1 0 267.844 5.205 10 0 CKAERO CC[C@@H]([NH2+][C@H](C)CCC(C)C)c1ccc(Cl)cc1 ZINC000020547128 171244638 /nfs/dbraw/zinc/24/46/38/171244638.db2.gz KQJVLTQYALHRNK-CZUORRHYSA-N 1 0 267.844 5.205 10 0 CKAERO CC[C@H]([NH2+][C@H](C)CCC(C)C)c1ccc(Cl)cc1 ZINC000020547129 171244366 /nfs/dbraw/zinc/24/43/66/171244366.db2.gz KQJVLTQYALHRNK-CJNGLKHVSA-N 1 0 267.844 5.205 10 0 CKAERO CC[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1)c1cccs1 ZINC000020547172 171244575 /nfs/dbraw/zinc/24/45/75/171244575.db2.gz NQDAJIOHEKXPHI-SMDDNHRTSA-N 1 0 279.836 5.203 10 0 CKAERO CC[C@H]([NH2+][C@@H](C)c1ccc(Cl)cc1)c1cccs1 ZINC000020547174 171244288 /nfs/dbraw/zinc/24/42/88/171244288.db2.gz NQDAJIOHEKXPHI-FZMZJTMJSA-N 1 0 279.836 5.203 10 0 CKAERO CC[C@@H]([NH2+][C@H](C)c1ccc(Cl)cc1)c1cccs1 ZINC000020547176 171244599 /nfs/dbraw/zinc/24/45/99/171244599.db2.gz NQDAJIOHEKXPHI-BXUZGUMPSA-N 1 0 279.836 5.203 10 0 CKAERO CC[C@H]([NH2+][C@H](C)c1ccc(Cl)cc1)c1cccs1 ZINC000020547178 171244396 /nfs/dbraw/zinc/24/43/96/171244396.db2.gz NQDAJIOHEKXPHI-RISCZKNCSA-N 1 0 279.836 5.203 10 0 CKAERO Cc1cc(C)c([C@H](C)[NH2+][C@H](C)c2cccs2)c(C)c1 ZINC000020547380 171245095 /nfs/dbraw/zinc/24/50/95/171245095.db2.gz RJUAUGPZSATZLQ-CABCVRRESA-N 1 0 273.445 5.085 10 0 CKAERO Cc1cc(C)c([C@H](C)[NH2+][C@@H](C)c2cccs2)c(C)c1 ZINC000020547381 171244956 /nfs/dbraw/zinc/24/49/56/171244956.db2.gz RJUAUGPZSATZLQ-GJZGRUSLSA-N 1 0 273.445 5.085 10 0 CKAERO Cc1cc(C)c([C@@H](C)[NH2+][C@H](C)c2cccs2)c(C)c1 ZINC000020547382 171244901 /nfs/dbraw/zinc/24/49/01/171244901.db2.gz RJUAUGPZSATZLQ-HUUCEWRRSA-N 1 0 273.445 5.085 10 0 CKAERO Cc1cc(C)c([C@@H](C)[NH2+][C@@H](C)c2cccs2)c(C)c1 ZINC000020547384 171244927 /nfs/dbraw/zinc/24/49/27/171244927.db2.gz RJUAUGPZSATZLQ-LSDHHAIUSA-N 1 0 273.445 5.085 10 0 CKAERO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2)cc1C ZINC000020547458 171244990 /nfs/dbraw/zinc/24/49/90/171244990.db2.gz ROJLJGSQJJZTQA-CABCVRRESA-N 1 0 287.834 5.369 10 0 CKAERO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2)cc1C ZINC000020547459 171245147 /nfs/dbraw/zinc/24/51/47/171245147.db2.gz ROJLJGSQJJZTQA-GJZGRUSLSA-N 1 0 287.834 5.369 10 0 CKAERO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2)cc1C ZINC000020547460 171245024 /nfs/dbraw/zinc/24/50/24/171245024.db2.gz ROJLJGSQJJZTQA-HUUCEWRRSA-N 1 0 287.834 5.369 10 0 CKAERO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2)cc1C ZINC000020547462 171244962 /nfs/dbraw/zinc/24/49/62/171244962.db2.gz ROJLJGSQJJZTQA-LSDHHAIUSA-N 1 0 287.834 5.369 10 0 CKAERO C[C@@H]([NH2+]Cc1ccc2ccccc2c1)c1cccc(Cl)c1 ZINC000020547762 171244923 /nfs/dbraw/zinc/24/49/23/171244923.db2.gz AYDWIULPEGPJSP-CQSZACIVSA-N 1 0 295.813 5.344 10 0 CKAERO C[C@H]([NH2+]Cc1ccc2ccccc2c1)c1cccc(Cl)c1 ZINC000020547763 171244827 /nfs/dbraw/zinc/24/48/27/171244827.db2.gz AYDWIULPEGPJSP-AWEZNQCLSA-N 1 0 295.813 5.344 10 0 CKAERO C[C@@H]1C[C@@H]([NH2+]Cc2cccc(C(F)(F)F)c2)CC(C)(C)C1 ZINC000020548124 171245539 /nfs/dbraw/zinc/24/55/39/171245539.db2.gz YIQMTQOPXHOQEL-IUODEOHRSA-N 1 0 299.380 5.010 10 0 CKAERO C[C@H]1C[C@@H]([NH2+]Cc2cccc(C(F)(F)F)c2)CC(C)(C)C1 ZINC000020548125 171245621 /nfs/dbraw/zinc/24/56/21/171245621.db2.gz YIQMTQOPXHOQEL-SWLSCSKDSA-N 1 0 299.380 5.010 10 0 CKAERO C[C@@H]1C[C@H]([NH2+]Cc2cccc(C(F)(F)F)c2)CC(C)(C)C1 ZINC000020548126 171245543 /nfs/dbraw/zinc/24/55/43/171245543.db2.gz YIQMTQOPXHOQEL-DOMZBBRYSA-N 1 0 299.380 5.010 10 0 CKAERO C[C@H]1C[C@H]([NH2+]Cc2cccc(C(F)(F)F)c2)CC(C)(C)C1 ZINC000020548127 171245546 /nfs/dbraw/zinc/24/55/46/171245546.db2.gz YIQMTQOPXHOQEL-WFASDCNBSA-N 1 0 299.380 5.010 10 0 CKAERO CC(C)Oc1ccc([C@@H](C)[NH2+]C2CCCCCCC2)cc1 ZINC000020548385 171245312 /nfs/dbraw/zinc/24/53/12/171245312.db2.gz QEHYFNUTQDXQMR-MRXNPFEDSA-N 1 0 289.463 5.237 10 0 CKAERO CC(C)Oc1ccc([C@H](C)[NH2+]C2CCCCCCC2)cc1 ZINC000020548386 171245529 /nfs/dbraw/zinc/24/55/29/171245529.db2.gz QEHYFNUTQDXQMR-INIZCTEOSA-N 1 0 289.463 5.237 10 0 CKAERO CC(C)CC[NH2+][C@@H](C)c1ccc(-c2ccccc2)cc1 ZINC000020548428 171245512 /nfs/dbraw/zinc/24/55/12/171245512.db2.gz VADMIWJJBYSDOO-INIZCTEOSA-N 1 0 267.416 5.050 10 0 CKAERO CC(C)CC[NH2+][C@H](C)c1ccc(-c2ccccc2)cc1 ZINC000020548429 171245451 /nfs/dbraw/zinc/24/54/51/171245451.db2.gz VADMIWJJBYSDOO-MRXNPFEDSA-N 1 0 267.416 5.050 10 0 CKAERO CC(C)c1ccc([C@@H](C)[NH2+][C@@H](C)c2cccc(F)c2)cc1 ZINC000020548910 262249143 /nfs/dbraw/zinc/24/91/43/262249143.db2.gz VVSKNSVVGBYOGM-CABCVRRESA-N 1 0 285.406 5.361 10 0 CKAERO CC(C)c1ccc([C@H](C)[NH2+][C@@H](C)c2cccc(F)c2)cc1 ZINC000020548911 171245954 /nfs/dbraw/zinc/24/59/54/171245954.db2.gz VVSKNSVVGBYOGM-GJZGRUSLSA-N 1 0 285.406 5.361 10 0 CKAERO CC(C)c1ccc([C@@H](C)[NH2+][C@H](C)c2cccc(F)c2)cc1 ZINC000020548912 171245751 /nfs/dbraw/zinc/24/57/51/171245751.db2.gz VVSKNSVVGBYOGM-HUUCEWRRSA-N 1 0 285.406 5.361 10 0 CKAERO CC(C)c1ccc([C@H](C)[NH2+][C@H](C)c2cccc(F)c2)cc1 ZINC000020548913 171245728 /nfs/dbraw/zinc/24/57/28/171245728.db2.gz VVSKNSVVGBYOGM-LSDHHAIUSA-N 1 0 285.406 5.361 10 0 CKAERO CC(C)c1ccc([C@@H]([NH3+])CC(C)(C)C)c(C(C)C)c1 ZINC000020549145 171246446 /nfs/dbraw/zinc/24/64/46/171246446.db2.gz DVHUBILANNSZPN-KRWDZBQOSA-N 1 0 261.453 5.369 10 0 CKAERO CC(C)c1ccc([C@H]([NH3+])CC(C)(C)C)c(C(C)C)c1 ZINC000020549146 171246401 /nfs/dbraw/zinc/24/64/01/171246401.db2.gz DVHUBILANNSZPN-QGZVFWFLSA-N 1 0 261.453 5.369 10 0 CKAERO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(Cl)c(Cl)c2)o1 ZINC000020549180 262249079 /nfs/dbraw/zinc/24/90/79/262249079.db2.gz NGFPXSRMUNEUMA-MNOVXSKESA-N 1 0 298.213 5.307 10 0 CKAERO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(Cl)c(Cl)c2)o1 ZINC000020549181 262249220 /nfs/dbraw/zinc/24/92/20/262249220.db2.gz NGFPXSRMUNEUMA-QWRGUYRKSA-N 1 0 298.213 5.307 10 0 CKAERO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(Cl)c(Cl)c2)o1 ZINC000020549182 262249390 /nfs/dbraw/zinc/24/93/90/262249390.db2.gz NGFPXSRMUNEUMA-GHMZBOCLSA-N 1 0 298.213 5.307 10 0 CKAERO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(Cl)c(Cl)c2)o1 ZINC000020549183 262249099 /nfs/dbraw/zinc/24/90/99/262249099.db2.gz NGFPXSRMUNEUMA-WDEREUQCSA-N 1 0 298.213 5.307 10 0 CKAERO Cc1cc(C)c([C@H](C)[NH2+][C@H](C)c2cccs2)cc1C ZINC000020549385 171246126 /nfs/dbraw/zinc/24/61/26/171246126.db2.gz FLPIXNZDCSYIQN-LSDHHAIUSA-N 1 0 273.445 5.085 10 0 CKAERO Cc1cc(C)c([C@H](C)[NH2+][C@@H](C)c2cccs2)cc1C ZINC000020549386 171246460 /nfs/dbraw/zinc/24/64/60/171246460.db2.gz FLPIXNZDCSYIQN-GJZGRUSLSA-N 1 0 273.445 5.085 10 0 CKAERO Cc1cc(C)c([C@@H](C)[NH2+][C@H](C)c2cccs2)cc1C ZINC000020549387 171246405 /nfs/dbraw/zinc/24/64/05/171246405.db2.gz FLPIXNZDCSYIQN-HUUCEWRRSA-N 1 0 273.445 5.085 10 0 CKAERO Cc1cc(C)c([C@@H](C)[NH2+][C@@H](C)c2cccs2)cc1C ZINC000020549388 171246301 /nfs/dbraw/zinc/24/63/01/171246301.db2.gz FLPIXNZDCSYIQN-CABCVRRESA-N 1 0 273.445 5.085 10 0 CKAERO CC[C@@H]([NH2+]CCCc1ccccc1)c1ccc(Cl)cc1 ZINC000020549479 171246413 /nfs/dbraw/zinc/24/64/13/171246413.db2.gz JDUUKRWBHFOXDS-GOSISDBHSA-N 1 0 287.834 5.014 10 0 CKAERO CC[C@H]([NH2+]CCCc1ccccc1)c1ccc(Cl)cc1 ZINC000020549480 171246436 /nfs/dbraw/zinc/24/64/36/171246436.db2.gz JDUUKRWBHFOXDS-SFHVURJKSA-N 1 0 287.834 5.014 10 0 CKAERO C[C@@H]([NH2+]C1CCCCCCC1)c1ccccc1OC(F)F ZINC000020550383 171246896 /nfs/dbraw/zinc/24/68/96/171246896.db2.gz KYBSIRNPRBHSPU-CYBMUJFWSA-N 1 0 297.389 5.052 10 0 CKAERO C[C@H]([NH2+]C1CCCCCCC1)c1ccccc1OC(F)F ZINC000020550385 171246941 /nfs/dbraw/zinc/24/69/41/171246941.db2.gz KYBSIRNPRBHSPU-ZDUSSCGKSA-N 1 0 297.389 5.052 10 0 CKAERO Cc1cc(Oc2ccc([C@@H](C)[NH3+])cc2F)ccc1C(C)C ZINC000020551050 171247170 /nfs/dbraw/zinc/24/71/70/171247170.db2.gz FNZKGZWEMQUOAN-CYBMUJFWSA-N 1 0 287.378 5.070 10 0 CKAERO Cc1cc(Oc2ccc([C@H](C)[NH3+])cc2F)ccc1C(C)C ZINC000020551052 171247056 /nfs/dbraw/zinc/24/70/56/171247056.db2.gz FNZKGZWEMQUOAN-ZDUSSCGKSA-N 1 0 287.378 5.070 10 0 CKAERO CC[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1)c1cccc(Cl)c1 ZINC000020551070 171247036 /nfs/dbraw/zinc/24/70/36/171247036.db2.gz GOIQGTAUBGCGRZ-YVEFUNNKSA-N 1 0 291.797 5.281 10 0 CKAERO CC[C@H]([NH2+][C@@H](C)c1ccc(F)cc1)c1cccc(Cl)c1 ZINC000020551072 171247071 /nfs/dbraw/zinc/24/70/71/171247071.db2.gz GOIQGTAUBGCGRZ-SJCJKPOMSA-N 1 0 291.797 5.281 10 0 CKAERO CC[C@@H]([NH2+][C@H](C)c1ccc(F)cc1)c1cccc(Cl)c1 ZINC000020551075 171247004 /nfs/dbraw/zinc/24/70/04/171247004.db2.gz GOIQGTAUBGCGRZ-SJKOYZFVSA-N 1 0 291.797 5.281 10 0 CKAERO CC[C@H]([NH2+][C@H](C)c1ccc(F)cc1)c1cccc(Cl)c1 ZINC000020551077 171247053 /nfs/dbraw/zinc/24/70/53/171247053.db2.gz GOIQGTAUBGCGRZ-PXAZEXFGSA-N 1 0 291.797 5.281 10 0 CKAERO C[C@@H]([NH2+]C1CCCCCCCCCCC1)c1cccnc1 ZINC000020551324 171247016 /nfs/dbraw/zinc/24/70/16/171247016.db2.gz TZHRBCFVZZIFHH-QGZVFWFLSA-N 1 0 288.479 5.406 10 0 CKAERO C[C@H]([NH2+]C1CCCCCCCCCCC1)c1cccnc1 ZINC000020551326 171247110 /nfs/dbraw/zinc/24/71/10/171247110.db2.gz TZHRBCFVZZIFHH-KRWDZBQOSA-N 1 0 288.479 5.406 10 0 CKAERO CC(C)c1ccc(C[NH2+][C@@H](C)c2ccc(Cl)cc2)cc1 ZINC000020551834 171247449 /nfs/dbraw/zinc/24/74/49/171247449.db2.gz NXCVJUMXCQSWSB-AWEZNQCLSA-N 1 0 287.834 5.314 10 0 CKAERO CC(C)c1ccc(C[NH2+][C@H](C)c2ccc(Cl)cc2)cc1 ZINC000020551835 171247378 /nfs/dbraw/zinc/24/73/78/171247378.db2.gz NXCVJUMXCQSWSB-CQSZACIVSA-N 1 0 287.834 5.314 10 0 CKAERO CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1[NH2+][C@@H](C)c1cccc(Cl)c1 ZINC000020552012 171247265 /nfs/dbraw/zinc/24/72/65/171247265.db2.gz MFZYKPZHVAMVIK-BODMPHMZSA-N 1 0 293.882 5.451 10 0 CKAERO CC(C)[C@@H]1CC[C@H](C)C[C@@H]1[NH2+][C@@H](C)c1cccc(Cl)c1 ZINC000020552013 171247583 /nfs/dbraw/zinc/24/75/83/171247583.db2.gz MFZYKPZHVAMVIK-USJZOSNVSA-N 1 0 293.882 5.451 10 0 CKAERO CC(C)[C@H]1CC[C@@H](C)C[C@@H]1[NH2+][C@@H](C)c1cccc(Cl)c1 ZINC000020552014 171247259 /nfs/dbraw/zinc/24/72/59/171247259.db2.gz MFZYKPZHVAMVIK-NONVJHHQSA-N 1 0 293.882 5.451 10 0 CKAERO CC(C)[C@H]1CC[C@H](C)C[C@@H]1[NH2+][C@@H](C)c1cccc(Cl)c1 ZINC000020552015 171247509 /nfs/dbraw/zinc/24/75/09/171247509.db2.gz MFZYKPZHVAMVIK-ZZCKCESHSA-N 1 0 293.882 5.451 10 0 CKAERO CCC[C@@H]([NH2+][C@@H](C)c1cccs1)c1ccc(Cl)cc1 ZINC000020552019 171247384 /nfs/dbraw/zinc/24/73/84/171247384.db2.gz JUZPAVHGXRVHBA-SWLSCSKDSA-N 1 0 293.863 5.594 10 0 CKAERO CCC[C@H]([NH2+][C@@H](C)c1cccs1)c1ccc(Cl)cc1 ZINC000020552020 171247283 /nfs/dbraw/zinc/24/72/83/171247283.db2.gz JUZPAVHGXRVHBA-WFASDCNBSA-N 1 0 293.863 5.594 10 0 CKAERO CCC[C@@H]([NH2+][C@H](C)c1cccs1)c1ccc(Cl)cc1 ZINC000020552021 171247452 /nfs/dbraw/zinc/24/74/52/171247452.db2.gz JUZPAVHGXRVHBA-IUODEOHRSA-N 1 0 293.863 5.594 10 0 CKAERO CCC[C@H]([NH2+][C@H](C)c1cccs1)c1ccc(Cl)cc1 ZINC000020552022 171247285 /nfs/dbraw/zinc/24/72/85/171247285.db2.gz JUZPAVHGXRVHBA-DOMZBBRYSA-N 1 0 293.863 5.594 10 0 CKAERO CCCOc1ccc(C[NH2+]CCCCCCC(C)C)cc1 ZINC000020552027 171247474 /nfs/dbraw/zinc/24/74/74/171247474.db2.gz CTLGAXPFPDIJTL-UHFFFAOYSA-N 1 0 291.479 5.172 10 0 CKAERO CC(C)c1ccc(C[NH2+][C@@H](C)c2ccccc2Cl)cc1 ZINC000020552034 171247261 /nfs/dbraw/zinc/24/72/61/171247261.db2.gz CDHIKCLEKWOXQZ-AWEZNQCLSA-N 1 0 287.834 5.314 10 0 CKAERO CC(C)c1ccc(C[NH2+][C@H](C)c2ccccc2Cl)cc1 ZINC000020552035 171247579 /nfs/dbraw/zinc/24/75/79/171247579.db2.gz CDHIKCLEKWOXQZ-CQSZACIVSA-N 1 0 287.834 5.314 10 0 CKAERO CCCC1CCC([NH2+][C@@H](C)c2ccccc2Cl)CC1 ZINC000020552189 171247556 /nfs/dbraw/zinc/24/75/56/171247556.db2.gz LUOGAEZTZNDSJH-NFOMZHRRSA-N 1 0 279.855 5.350 10 0 CKAERO CCCC1CCC([NH2+][C@H](C)c2ccccc2Cl)CC1 ZINC000020552190 171247412 /nfs/dbraw/zinc/24/74/12/171247412.db2.gz LUOGAEZTZNDSJH-WLYUNCDWSA-N 1 0 279.855 5.350 10 0 CKAERO CC[C@@H](C)C[C@@H](CC)[NH2+]Cc1cccc(C(F)(F)F)c1 ZINC000020552422 171247651 /nfs/dbraw/zinc/24/76/51/171247651.db2.gz QIMUJWWKZGPGKX-IUODEOHRSA-N 1 0 287.369 5.010 10 0 CKAERO CC[C@H](C[C@@H](C)CC)[NH2+]Cc1cccc(C(F)(F)F)c1 ZINC000020552423 171247815 /nfs/dbraw/zinc/24/78/15/171247815.db2.gz QIMUJWWKZGPGKX-SWLSCSKDSA-N 1 0 287.369 5.010 10 0 CKAERO CC[C@@H](C)C[C@H](CC)[NH2+]Cc1cccc(C(F)(F)F)c1 ZINC000020552424 171247802 /nfs/dbraw/zinc/24/78/02/171247802.db2.gz QIMUJWWKZGPGKX-DOMZBBRYSA-N 1 0 287.369 5.010 10 0 CKAERO CC[C@H](C)C[C@H](CC)[NH2+]Cc1cccc(C(F)(F)F)c1 ZINC000020552425 171247768 /nfs/dbraw/zinc/24/77/68/171247768.db2.gz QIMUJWWKZGPGKX-WFASDCNBSA-N 1 0 287.369 5.010 10 0 CKAERO CCCC[C@@H](CC)C[NH2+][C@@H](C)c1ccc(CC)cc1 ZINC000020552675 171248014 /nfs/dbraw/zinc/24/80/14/171248014.db2.gz APCVRISYRCNBIH-DOTOQJQBSA-N 1 0 261.453 5.116 10 0 CKAERO CCCC[C@H](CC)C[NH2+][C@@H](C)c1ccc(CC)cc1 ZINC000020552676 171248240 /nfs/dbraw/zinc/24/82/40/171248240.db2.gz APCVRISYRCNBIH-RDJZCZTQSA-N 1 0 261.453 5.116 10 0 CKAERO CCCC[C@@H](CC)C[NH2+][C@H](C)c1ccc(CC)cc1 ZINC000020552677 171248424 /nfs/dbraw/zinc/24/84/24/171248424.db2.gz APCVRISYRCNBIH-NVXWUHKLSA-N 1 0 261.453 5.116 10 0 CKAERO CCCC[C@H](CC)C[NH2+][C@H](C)c1ccc(CC)cc1 ZINC000020552678 171248389 /nfs/dbraw/zinc/24/83/89/171248389.db2.gz APCVRISYRCNBIH-WBVHZDCISA-N 1 0 261.453 5.116 10 0 CKAERO C[C@@H]([NH2+]C1CCCCCCC1)c1nc2ccccc2s1 ZINC000020552753 171248219 /nfs/dbraw/zinc/24/82/19/171248219.db2.gz ITDPTYCCCWVTAJ-CYBMUJFWSA-N 1 0 288.460 5.060 10 0 CKAERO C[C@H]([NH2+]C1CCCCCCC1)c1nc2ccccc2s1 ZINC000020552754 171248417 /nfs/dbraw/zinc/24/84/17/171248417.db2.gz ITDPTYCCCWVTAJ-ZDUSSCGKSA-N 1 0 288.460 5.060 10 0 CKAERO CC(C)(C)[C@@H]1CCCC[C@@H]1[NH2+]C1CCCCCCC1 ZINC000020553005 171248297 /nfs/dbraw/zinc/24/82/97/171248297.db2.gz IFIICXYVVNBKND-SJORKVTESA-N 1 0 265.485 5.294 10 0 CKAERO CC(C)(C)[C@H]1CCCC[C@@H]1[NH2+]C1CCCCCCC1 ZINC000020553006 171248330 /nfs/dbraw/zinc/24/83/30/171248330.db2.gz IFIICXYVVNBKND-IRXDYDNUSA-N 1 0 265.485 5.294 10 0 CKAERO CC(C)(C)[C@@H]1CCCC[C@H]1[NH2+]C1CCCCCCC1 ZINC000020553007 171248103 /nfs/dbraw/zinc/24/81/03/171248103.db2.gz IFIICXYVVNBKND-IAGOWNOFSA-N 1 0 265.485 5.294 10 0 CKAERO CC(C)(C)[C@H]1CCCC[C@H]1[NH2+]C1CCCCCCC1 ZINC000020553008 171248248 /nfs/dbraw/zinc/24/82/48/171248248.db2.gz IFIICXYVVNBKND-DLBZAZTESA-N 1 0 265.485 5.294 10 0 CKAERO Cc1cc(C)c([C@H](C)[NH2+][C@H](C)c2ccc(F)cc2)cc1C ZINC000020553838 171249348 /nfs/dbraw/zinc/24/93/48/171249348.db2.gz GBXDIWNOTLGFHH-CVEARBPZSA-N 1 0 285.406 5.163 10 0 CKAERO Cc1cc(C)c([C@H](C)[NH2+][C@@H](C)c2ccc(F)cc2)cc1C ZINC000020553840 171249116 /nfs/dbraw/zinc/24/91/16/171249116.db2.gz GBXDIWNOTLGFHH-HOTGVXAUSA-N 1 0 285.406 5.163 10 0 CKAERO Cc1cc(C)c([C@@H](C)[NH2+][C@H](C)c2ccc(F)cc2)cc1C ZINC000020553842 171249371 /nfs/dbraw/zinc/24/93/71/171249371.db2.gz GBXDIWNOTLGFHH-HZPDHXFCSA-N 1 0 285.406 5.163 10 0 CKAERO Cc1cc(C)c([C@@H](C)[NH2+][C@@H](C)c2ccc(F)cc2)cc1C ZINC000020553844 171249363 /nfs/dbraw/zinc/24/93/63/171249363.db2.gz GBXDIWNOTLGFHH-JKSUJKDBSA-N 1 0 285.406 5.163 10 0 CKAERO CC(C)(C)C1CCC([NH2+]Cc2ccc(Cl)cc2)CC1 ZINC000020555773 171249896 /nfs/dbraw/zinc/24/98/96/171249896.db2.gz PVXYQXVUJAWYQM-UHFFFAOYSA-N 1 0 279.855 5.035 10 0 CKAERO CCCC1CCC([NH2+][C@@H](C)c2ccc(Cl)cc2)CC1 ZINC000020556026 171250056 /nfs/dbraw/zinc/25/00/56/171250056.db2.gz AKWYCZNVBHJXAA-CBCUQQMYSA-N 1 0 279.855 5.350 10 0 CKAERO CCCC1CCC([NH2+][C@H](C)c2ccc(Cl)cc2)CC1 ZINC000020556028 171250012 /nfs/dbraw/zinc/25/00/12/171250012.db2.gz AKWYCZNVBHJXAA-TUBUQKNSSA-N 1 0 279.855 5.350 10 0 CKAERO Cc1ccccc1[C@@H](C)[NH2+]C1CCC(C(C)(C)C)CC1 ZINC000020556042 171250090 /nfs/dbraw/zinc/25/00/90/171250090.db2.gz SESZCYNUCAIBPT-KLAILNCOSA-N 1 0 273.464 5.251 10 0 CKAERO Cc1ccccc1[C@H](C)[NH2+]C1CCC(C(C)(C)C)CC1 ZINC000020556044 171250055 /nfs/dbraw/zinc/25/00/55/171250055.db2.gz SESZCYNUCAIBPT-GTPINHCMSA-N 1 0 273.464 5.251 10 0 CKAERO C[C@@H]([NH2+]Cc1ccccc1Cl)c1ccc2ccccc2c1 ZINC000020556143 171249887 /nfs/dbraw/zinc/24/98/87/171249887.db2.gz XJKQCCOKBLYWPX-CQSZACIVSA-N 1 0 295.813 5.344 10 0 CKAERO C[C@H]([NH2+]Cc1ccccc1Cl)c1ccc2ccccc2c1 ZINC000020556144 171249985 /nfs/dbraw/zinc/24/99/85/171249985.db2.gz XJKQCCOKBLYWPX-AWEZNQCLSA-N 1 0 295.813 5.344 10 0 CKAERO C[C@@H]([NH2+]C1CCC(C(C)(C)C)CC1)c1cccc(Cl)c1 ZINC000020556209 171249886 /nfs/dbraw/zinc/24/98/86/171249886.db2.gz MVVRCASIDFKFFE-BZOOQXSSSA-N 1 0 293.882 5.596 10 0 CKAERO C[C@H]([NH2+]C1CCC(C(C)(C)C)CC1)c1cccc(Cl)c1 ZINC000020556211 171249821 /nfs/dbraw/zinc/24/98/21/171249821.db2.gz MVVRCASIDFKFFE-KTAKPFMOSA-N 1 0 293.882 5.596 10 0 CKAERO CCC[C@@H](C)[NH2+][C@@H](C)c1ccc(-c2ccccc2)cc1 ZINC000020556235 171249809 /nfs/dbraw/zinc/24/98/09/171249809.db2.gz VZKMTQAJJCMTPP-CVEARBPZSA-N 1 0 267.416 5.193 10 0 CKAERO CCC[C@H](C)[NH2+][C@@H](C)c1ccc(-c2ccccc2)cc1 ZINC000020556237 171249781 /nfs/dbraw/zinc/24/97/81/171249781.db2.gz VZKMTQAJJCMTPP-HOTGVXAUSA-N 1 0 267.416 5.193 10 0 CKAERO CCC[C@@H](C)[NH2+][C@H](C)c1ccc(-c2ccccc2)cc1 ZINC000020556239 171249963 /nfs/dbraw/zinc/24/99/63/171249963.db2.gz VZKMTQAJJCMTPP-HZPDHXFCSA-N 1 0 267.416 5.193 10 0 CKAERO CCC[C@H](C)[NH2+][C@H](C)c1ccc(-c2ccccc2)cc1 ZINC000020556241 171249847 /nfs/dbraw/zinc/24/98/47/171249847.db2.gz VZKMTQAJJCMTPP-JKSUJKDBSA-N 1 0 267.416 5.193 10 0 CKAERO C[C@@H]([NH2+][C@@H]1CCCC[C@@H]1C(C)(C)C)c1ccc(Cl)cc1 ZINC000020556359 171249748 /nfs/dbraw/zinc/24/97/48/171249748.db2.gz CLXLUCGAYXODQF-XOKHGSTOSA-N 1 0 293.882 5.596 10 0 CKAERO C[C@H]([NH2+][C@@H]1CCCC[C@@H]1C(C)(C)C)c1ccc(Cl)cc1 ZINC000020556360 171250076 /nfs/dbraw/zinc/25/00/76/171250076.db2.gz CLXLUCGAYXODQF-RRQGHBQHSA-N 1 0 293.882 5.596 10 0 CKAERO C[C@@H]([NH2+][C@H]1CCCC[C@@H]1C(C)(C)C)c1ccc(Cl)cc1 ZINC000020556361 171250031 /nfs/dbraw/zinc/25/00/31/171250031.db2.gz CLXLUCGAYXODQF-COXVUDFISA-N 1 0 293.882 5.596 10 0 CKAERO C[C@H]([NH2+][C@H]1CCCC[C@@H]1C(C)(C)C)c1ccc(Cl)cc1 ZINC000020556362 171249749 /nfs/dbraw/zinc/24/97/49/171249749.db2.gz CLXLUCGAYXODQF-JQFCIGGWSA-N 1 0 293.882 5.596 10 0 CKAERO C[C@@H]([NH2+][C@@H](C)c1cccc(Cl)c1)c1cccc(Cl)c1 ZINC000020556809 171250511 /nfs/dbraw/zinc/25/05/11/171250511.db2.gz OQMLTIYVCDUHJF-TXEJJXNPSA-N 1 0 294.225 5.405 10 0 CKAERO C[C@H]([NH2+][C@@H](C)c1cccc(Cl)c1)c1cccc(Cl)c1 ZINC000020556811 171250351 /nfs/dbraw/zinc/25/03/51/171250351.db2.gz OQMLTIYVCDUHJF-RYUDHWBXSA-N 1 0 294.225 5.405 10 0 CKAERO C[C@@H]([NH2+][C@H](C)c1cccc(Cl)c1)c1cccc(Cl)c1 ZINC000020556813 171250300 /nfs/dbraw/zinc/25/03/00/171250300.db2.gz OQMLTIYVCDUHJF-VXGBXAGGSA-N 1 0 294.225 5.405 10 0 CKAERO CC(C)CCC[C@@H](C)[NH2+]Cc1cccc(C(F)(F)F)c1 ZINC000020557207 171250418 /nfs/dbraw/zinc/25/04/18/171250418.db2.gz ODAAQQYTGOMMDG-CYBMUJFWSA-N 1 0 287.369 5.010 10 0 CKAERO CC(C)CCC[C@H](C)[NH2+]Cc1cccc(C(F)(F)F)c1 ZINC000020557208 171250138 /nfs/dbraw/zinc/25/01/38/171250138.db2.gz ODAAQQYTGOMMDG-ZDUSSCGKSA-N 1 0 287.369 5.010 10 0 CKAERO C[C@@H]([NH2+]C[C@H]1CC=CCC1)c1ccc(Cl)c(Cl)c1 ZINC000020558195 171250726 /nfs/dbraw/zinc/25/07/26/171250726.db2.gz ABXRXRPQIBRVBQ-NEPJUHHUSA-N 1 0 284.230 5.000 10 0 CKAERO C[C@H]([NH2+]C[C@H]1CC=CCC1)c1ccc(Cl)c(Cl)c1 ZINC000020558197 171250711 /nfs/dbraw/zinc/25/07/11/171250711.db2.gz ABXRXRPQIBRVBQ-RYUDHWBXSA-N 1 0 284.230 5.000 10 0 CKAERO C[C@@H]([NH2+]C[C@@H]1CC=CCC1)c1ccc(Cl)c(Cl)c1 ZINC000020558199 171250872 /nfs/dbraw/zinc/25/08/72/171250872.db2.gz ABXRXRPQIBRVBQ-VXGBXAGGSA-N 1 0 284.230 5.000 10 0 CKAERO CCCCCC[NH2+][C@@H](CCC)c1ccc(Cl)cc1 ZINC000020558242 171250698 /nfs/dbraw/zinc/25/06/98/171250698.db2.gz CGQHIGBFIVTMRK-INIZCTEOSA-N 1 0 267.844 5.351 10 0 CKAERO CCCCCC[NH2+][C@H](CCC)c1ccc(Cl)cc1 ZINC000020558244 171250642 /nfs/dbraw/zinc/25/06/42/171250642.db2.gz CGQHIGBFIVTMRK-MRXNPFEDSA-N 1 0 267.844 5.351 10 0 CKAERO CCCC[C@@H](CC)C[NH2+]C(CC(C)C)CC(C)C ZINC000020559135 171251231 /nfs/dbraw/zinc/25/12/31/171251231.db2.gz FKEUYLCTLQBSTJ-MRXNPFEDSA-N 1 0 255.490 5.253 10 0 CKAERO CCCC[C@H](CC)C[NH2+]C(CC(C)C)CC(C)C ZINC000020559137 171250992 /nfs/dbraw/zinc/25/09/92/171250992.db2.gz FKEUYLCTLQBSTJ-INIZCTEOSA-N 1 0 255.490 5.253 10 0 CKAERO CCC[C@@H]([NH2+]C1CCCCC1)c1ccc(Cl)cc1 ZINC000020559197 171250982 /nfs/dbraw/zinc/25/09/82/171250982.db2.gz WMPQMHNZVOZDMB-MRXNPFEDSA-N 1 0 265.828 5.104 10 0 CKAERO CCC[C@H]([NH2+]C1CCCCC1)c1ccc(Cl)cc1 ZINC000020559199 171251261 /nfs/dbraw/zinc/25/12/61/171251261.db2.gz WMPQMHNZVOZDMB-INIZCTEOSA-N 1 0 265.828 5.104 10 0 CKAERO C[C@@H]([NH2+]C1CCC(C(C)(C)C)CC1)c1ccc(F)cc1 ZINC000020559270 171251212 /nfs/dbraw/zinc/25/12/12/171251212.db2.gz BUEVQADBLNRORV-BZOOQXSSSA-N 1 0 277.427 5.081 10 0 CKAERO C[C@H]([NH2+]C1CCC(C(C)(C)C)CC1)c1ccc(F)cc1 ZINC000020559272 171250920 /nfs/dbraw/zinc/25/09/20/171250920.db2.gz BUEVQADBLNRORV-KTAKPFMOSA-N 1 0 277.427 5.081 10 0 CKAERO CC(C)CC[C@@H]([NH3+])c1ccc(C(C)C)cc1C(C)C ZINC000020560166 171251583 /nfs/dbraw/zinc/25/15/83/171251583.db2.gz LOVHSFSENNYJIA-GOSISDBHSA-N 1 0 261.453 5.369 10 0 CKAERO CC(C)CC[C@H]([NH3+])c1ccc(C(C)C)cc1C(C)C ZINC000020560167 171251379 /nfs/dbraw/zinc/25/13/79/171251379.db2.gz LOVHSFSENNYJIA-SFHVURJKSA-N 1 0 261.453 5.369 10 0 CKAERO Cc1ccc(C)c([C@@H](C)[NH2+]C2CCCCCCC2)c1 ZINC000020560775 171251927 /nfs/dbraw/zinc/25/19/27/171251927.db2.gz DEWZVYDALHUUGN-MRXNPFEDSA-N 1 0 259.437 5.067 10 0 CKAERO Cc1ccc(C)c([C@H](C)[NH2+]C2CCCCCCC2)c1 ZINC000020560777 171251771 /nfs/dbraw/zinc/25/17/71/171251771.db2.gz DEWZVYDALHUUGN-INIZCTEOSA-N 1 0 259.437 5.067 10 0 CKAERO c1csc(CC[NH2+]C2CCCCCCCCCCC2)c1 ZINC000020560905 171251777 /nfs/dbraw/zinc/25/17/77/171251777.db2.gz JFXDFAIWOZIGSZ-UHFFFAOYSA-N 1 0 293.520 5.554 10 0 CKAERO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccccc2Cl)c(C)c1 ZINC000020561496 171251928 /nfs/dbraw/zinc/25/19/28/171251928.db2.gz GRYBURYBFYHCBT-CABCVRRESA-N 1 0 287.834 5.369 10 0 CKAERO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccccc2Cl)c(C)c1 ZINC000020561499 171252061 /nfs/dbraw/zinc/25/20/61/171252061.db2.gz GRYBURYBFYHCBT-GJZGRUSLSA-N 1 0 287.834 5.369 10 0 CKAERO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccccc2Cl)c(C)c1 ZINC000020561502 171251807 /nfs/dbraw/zinc/25/18/07/171251807.db2.gz GRYBURYBFYHCBT-HUUCEWRRSA-N 1 0 287.834 5.369 10 0 CKAERO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccccc2Cl)c(C)c1 ZINC000020561505 171251969 /nfs/dbraw/zinc/25/19/69/171251969.db2.gz GRYBURYBFYHCBT-LSDHHAIUSA-N 1 0 287.834 5.369 10 0 CKAERO CC(C)Cc1ccc([C@@H](C)[NH2+]C2CCC(C)CC2)cc1 ZINC000020561958 171252489 /nfs/dbraw/zinc/25/24/89/171252489.db2.gz XJXNPTOGOPYFIE-KOHRHEQBSA-N 1 0 273.464 5.114 10 0 CKAERO CC(C)Cc1ccc([C@H](C)[NH2+]C2CCC(C)CC2)cc1 ZINC000020561961 171252271 /nfs/dbraw/zinc/25/22/71/171252271.db2.gz XJXNPTOGOPYFIE-WUJZJPHMSA-N 1 0 273.464 5.114 10 0 CKAERO CCCc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccccc2C)cc1 ZINC000020562812 171252608 /nfs/dbraw/zinc/25/26/08/171252608.db2.gz ISFWBTWRORLDBU-SJORKVTESA-N 1 0 281.443 5.359 10 0 CKAERO CCCc1ccc([C@H](C)[NH2+][C@@H](C)c2ccccc2C)cc1 ZINC000020562814 171252688 /nfs/dbraw/zinc/25/26/88/171252688.db2.gz ISFWBTWRORLDBU-IRXDYDNUSA-N 1 0 281.443 5.359 10 0 CKAERO CCCc1ccc([C@@H](C)[NH2+][C@H](C)c2ccccc2C)cc1 ZINC000020562816 171252568 /nfs/dbraw/zinc/25/25/68/171252568.db2.gz ISFWBTWRORLDBU-IAGOWNOFSA-N 1 0 281.443 5.359 10 0 CKAERO Cc1ccc(C(C)C)c(Oc2ccc(F)cc2[C@@H](C)[NH3+])c1 ZINC000020562819 171252729 /nfs/dbraw/zinc/25/27/29/171252729.db2.gz ZUBJEYIRDUKDJK-CYBMUJFWSA-N 1 0 287.378 5.070 10 0 CKAERO Cc1ccc(C(C)C)c(Oc2ccc(F)cc2[C@H](C)[NH3+])c1 ZINC000020562821 171252731 /nfs/dbraw/zinc/25/27/31/171252731.db2.gz ZUBJEYIRDUKDJK-ZDUSSCGKSA-N 1 0 287.378 5.070 10 0 CKAERO CCC(C)(C)C1CCC([NH2+]CCC2=CCCCC2)CC1 ZINC000020562954 171252629 /nfs/dbraw/zinc/25/26/29/171252629.db2.gz CEXDWZRZDIICDW-UHFFFAOYSA-N 1 0 277.496 5.462 10 0 CKAERO C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)CCC2)c1ccc(Cl)cc1 ZINC000020562977 171252538 /nfs/dbraw/zinc/25/25/38/171252538.db2.gz QYGMEYJVTBYTAA-KGLIPLIRSA-N 1 0 299.845 5.241 10 0 CKAERO C[C@H]([NH2+][C@@H](C)c1ccc2c(c1)CCC2)c1ccc(Cl)cc1 ZINC000020562980 171252587 /nfs/dbraw/zinc/25/25/87/171252587.db2.gz QYGMEYJVTBYTAA-KBPBESRZSA-N 1 0 299.845 5.241 10 0 CKAERO C[C@@H]([NH2+][C@H](C)c1ccc2c(c1)CCC2)c1ccc(Cl)cc1 ZINC000020562982 171252759 /nfs/dbraw/zinc/25/27/59/171252759.db2.gz QYGMEYJVTBYTAA-ZIAGYGMSSA-N 1 0 299.845 5.241 10 0 CKAERO C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1)c1ccc2c(c1)CCC2 ZINC000020562985 171252721 /nfs/dbraw/zinc/25/27/21/171252721.db2.gz QYGMEYJVTBYTAA-UONOGXRCSA-N 1 0 299.845 5.241 10 0 CKAERO CCC[C@@H](C)[NH2+][C@@H](c1ccccc1)c1cc(C)ccc1C ZINC000020563750 171253075 /nfs/dbraw/zinc/25/30/75/171253075.db2.gz UIRFAJZOOPZUEJ-XLIONFOSSA-N 1 0 281.443 5.171 10 0 CKAERO CCC[C@H](C)[NH2+][C@@H](c1ccccc1)c1cc(C)ccc1C ZINC000020563752 171253054 /nfs/dbraw/zinc/25/30/54/171253054.db2.gz UIRFAJZOOPZUEJ-PXNSSMCTSA-N 1 0 281.443 5.171 10 0 CKAERO CCC[C@@H](C)[NH2+][C@H](c1ccccc1)c1cc(C)ccc1C ZINC000020563754 171253263 /nfs/dbraw/zinc/25/32/63/171253263.db2.gz UIRFAJZOOPZUEJ-YLJYHZDGSA-N 1 0 281.443 5.171 10 0 CKAERO CCC[C@H](C)[NH2+][C@H](c1ccccc1)c1cc(C)ccc1C ZINC000020563756 171252855 /nfs/dbraw/zinc/25/28/55/171252855.db2.gz UIRFAJZOOPZUEJ-FXAWDEMLSA-N 1 0 281.443 5.171 10 0 CKAERO C[C@@H]([NH2+]C1CCCCCC1)c1ccc(Cl)cc1Cl ZINC000020564253 171252983 /nfs/dbraw/zinc/25/29/83/171252983.db2.gz BCOOMZDLIUPFQL-LLVKDONJSA-N 1 0 286.246 5.367 10 0 CKAERO C[C@H]([NH2+]C1CCCCCC1)c1ccc(Cl)cc1Cl ZINC000020564255 171252825 /nfs/dbraw/zinc/25/28/25/171252825.db2.gz BCOOMZDLIUPFQL-NSHDSACASA-N 1 0 286.246 5.367 10 0 CKAERO CCCCCC[NH2+][C@@H](C)c1ccc(CC(C)C)cc1 ZINC000020564370 171253639 /nfs/dbraw/zinc/25/36/39/171253639.db2.gz SOCJYADZMQTYDS-INIZCTEOSA-N 1 0 261.453 5.116 10 0 CKAERO CCCCCC[NH2+][C@H](C)c1ccc(CC(C)C)cc1 ZINC000020564372 171253640 /nfs/dbraw/zinc/25/36/40/171253640.db2.gz SOCJYADZMQTYDS-MRXNPFEDSA-N 1 0 261.453 5.116 10 0 CKAERO Cc1cccc(C[NH2+][C@H](C)c2ccc(Cl)c(Cl)c2)c1 ZINC000020564573 171253658 /nfs/dbraw/zinc/25/36/58/171253658.db2.gz BWKCLQJITKZRMF-GFCCVEGCSA-N 1 0 294.225 5.153 10 0 CKAERO Cc1cccc(C[NH2+][C@@H](C)c2ccc(Cl)c(Cl)c2)c1 ZINC000020564574 171253504 /nfs/dbraw/zinc/25/35/04/171253504.db2.gz BWKCLQJITKZRMF-LBPRGKRZSA-N 1 0 294.225 5.153 10 0 CKAERO C[C@@H]([NH2+][C@@H](C)c1ccc(F)c(F)c1)c1ccc(Cl)cc1 ZINC000020564832 171253393 /nfs/dbraw/zinc/25/33/93/171253393.db2.gz FIXJODCPDNQTDB-MNOVXSKESA-N 1 0 295.760 5.030 10 0 CKAERO C[C@H]([NH2+][C@@H](C)c1ccc(F)c(F)c1)c1ccc(Cl)cc1 ZINC000020564834 171253488 /nfs/dbraw/zinc/25/34/88/171253488.db2.gz FIXJODCPDNQTDB-QWRGUYRKSA-N 1 0 295.760 5.030 10 0 CKAERO C[C@@H]([NH2+][C@H](C)c1ccc(F)c(F)c1)c1ccc(Cl)cc1 ZINC000020564836 171253526 /nfs/dbraw/zinc/25/35/26/171253526.db2.gz FIXJODCPDNQTDB-GHMZBOCLSA-N 1 0 295.760 5.030 10 0 CKAERO C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1)c1ccc(F)c(F)c1 ZINC000020564838 171253564 /nfs/dbraw/zinc/25/35/64/171253564.db2.gz FIXJODCPDNQTDB-WDEREUQCSA-N 1 0 295.760 5.030 10 0 CKAERO Cc1ccc(C[NH2+][C@H](C)c2cc(Cl)ccc2Cl)cc1 ZINC000020565559 171253854 /nfs/dbraw/zinc/25/38/54/171253854.db2.gz FWHVMGDNDBHEPZ-GFCCVEGCSA-N 1 0 294.225 5.153 10 0 CKAERO Cc1ccc(C[NH2+][C@@H](C)c2cc(Cl)ccc2Cl)cc1 ZINC000020565560 171254085 /nfs/dbraw/zinc/25/40/85/171254085.db2.gz FWHVMGDNDBHEPZ-LBPRGKRZSA-N 1 0 294.225 5.153 10 0 CKAERO C[C@@H]([NH2+]C1CCCCCCCCCCC1)c1ccccn1 ZINC000020565620 171253926 /nfs/dbraw/zinc/25/39/26/171253926.db2.gz JGOBAKADCUNQIB-QGZVFWFLSA-N 1 0 288.479 5.406 10 0 CKAERO C[C@H]([NH2+]C1CCCCCCCCCCC1)c1ccccn1 ZINC000020565621 171254094 /nfs/dbraw/zinc/25/40/94/171254094.db2.gz JGOBAKADCUNQIB-KRWDZBQOSA-N 1 0 288.479 5.406 10 0 CKAERO CCC[C@@H](C)[NH2+][C@@H](c1ccccc1)c1ccc(C)cc1C ZINC000020565895 171254273 /nfs/dbraw/zinc/25/42/73/171254273.db2.gz RWWULSFGAOGHSA-XLIONFOSSA-N 1 0 281.443 5.171 10 0 CKAERO CCC[C@H](C)[NH2+][C@@H](c1ccccc1)c1ccc(C)cc1C ZINC000020565896 171254549 /nfs/dbraw/zinc/25/45/49/171254549.db2.gz RWWULSFGAOGHSA-PXNSSMCTSA-N 1 0 281.443 5.171 10 0 CKAERO CCC[C@@H](C)[NH2+][C@H](c1ccccc1)c1ccc(C)cc1C ZINC000020565897 171254375 /nfs/dbraw/zinc/25/43/75/171254375.db2.gz RWWULSFGAOGHSA-YLJYHZDGSA-N 1 0 281.443 5.171 10 0 CKAERO CCC[C@H](C)[NH2+][C@H](c1ccccc1)c1ccc(C)cc1C ZINC000020565898 171254321 /nfs/dbraw/zinc/25/43/21/171254321.db2.gz RWWULSFGAOGHSA-FXAWDEMLSA-N 1 0 281.443 5.171 10 0 CKAERO C[C@H]([NH2+][C@@H]1C[C@@H](C)CC(C)(C)C1)c1cccc(Cl)c1 ZINC000020566020 171254361 /nfs/dbraw/zinc/25/43/61/171254361.db2.gz LBOUTSULMPTNSF-DVOMOZLQSA-N 1 0 279.855 5.205 10 0 CKAERO C[C@H]([NH2+][C@@H]1C[C@H](C)CC(C)(C)C1)c1cccc(Cl)c1 ZINC000020566021 171254500 /nfs/dbraw/zinc/25/45/00/171254500.db2.gz LBOUTSULMPTNSF-HEHGZKQESA-N 1 0 279.855 5.205 10 0 CKAERO C[C@H]([NH2+][C@H]1C[C@@H](C)CC(C)(C)C1)c1cccc(Cl)c1 ZINC000020566023 171254509 /nfs/dbraw/zinc/25/45/09/171254509.db2.gz LBOUTSULMPTNSF-WWGRRREGSA-N 1 0 279.855 5.205 10 0 CKAERO C[C@H]([NH2+][C@H]1C[C@H](C)CC(C)(C)C1)c1cccc(Cl)c1 ZINC000020566025 171254223 /nfs/dbraw/zinc/25/42/23/171254223.db2.gz LBOUTSULMPTNSF-XEZPLFJOSA-N 1 0 279.855 5.205 10 0 CKAERO C[C@@H]([NH2+][C@@H](C)c1cc(Cl)ccc1Cl)c1ccccc1 ZINC000020566933 171254650 /nfs/dbraw/zinc/25/46/50/171254650.db2.gz TVVCZOHXFCIZRU-NEPJUHHUSA-N 1 0 294.225 5.405 10 0 CKAERO C[C@H]([NH2+][C@@H](C)c1cc(Cl)ccc1Cl)c1ccccc1 ZINC000020566934 171254850 /nfs/dbraw/zinc/25/48/50/171254850.db2.gz TVVCZOHXFCIZRU-RYUDHWBXSA-N 1 0 294.225 5.405 10 0 CKAERO C[C@@H]([NH2+][C@H](C)c1cc(Cl)ccc1Cl)c1ccccc1 ZINC000020566935 171254928 /nfs/dbraw/zinc/25/49/28/171254928.db2.gz TVVCZOHXFCIZRU-VXGBXAGGSA-N 1 0 294.225 5.405 10 0 CKAERO C[C@@H]([NH2+][C@@H](C)c1ccccc1)c1cc(Cl)ccc1Cl ZINC000020566936 171254632 /nfs/dbraw/zinc/25/46/32/171254632.db2.gz TVVCZOHXFCIZRU-NWDGAFQWSA-N 1 0 294.225 5.405 10 0 CKAERO Cc1ccc([C@H](C)[NH2+][C@H](C)CCCC(C)C)cc1C ZINC000020567129 171255121 /nfs/dbraw/zinc/25/51/21/171255121.db2.gz NYQZAPJNXOKSDC-SJORKVTESA-N 1 0 261.453 5.169 10 0 CKAERO Cc1ccc([C@H](C)[NH2+][C@@H](C)CCCC(C)C)cc1C ZINC000020567131 171255076 /nfs/dbraw/zinc/25/50/76/171255076.db2.gz NYQZAPJNXOKSDC-IRXDYDNUSA-N 1 0 261.453 5.169 10 0 CKAERO Cc1ccc([C@@H](C)[NH2+][C@H](C)CCCC(C)C)cc1C ZINC000020567133 171255314 /nfs/dbraw/zinc/25/53/14/171255314.db2.gz NYQZAPJNXOKSDC-IAGOWNOFSA-N 1 0 261.453 5.169 10 0 CKAERO Cc1ccc([C@@H](C)[NH2+][C@@H](C)CCCC(C)C)cc1C ZINC000020567135 171255075 /nfs/dbraw/zinc/25/50/75/171255075.db2.gz NYQZAPJNXOKSDC-DLBZAZTESA-N 1 0 261.453 5.169 10 0 CKAERO CC(C)CCC[C@@H](C)[NH2+][C@H](C)c1nc2ccccc2s1 ZINC000020567156 171255325 /nfs/dbraw/zinc/25/53/25/171255325.db2.gz ZEJUCUQMBILBLV-ZIAGYGMSSA-N 1 0 290.476 5.162 10 0 CKAERO CC(C)CCC[C@H](C)[NH2+][C@H](C)c1nc2ccccc2s1 ZINC000020567158 171255205 /nfs/dbraw/zinc/25/52/05/171255205.db2.gz ZEJUCUQMBILBLV-UONOGXRCSA-N 1 0 290.476 5.162 10 0 CKAERO CCC(C)(C)C1CCC([NH2+][C@@H](C)c2ccccc2)CC1 ZINC000020567170 171255136 /nfs/dbraw/zinc/25/51/36/171255136.db2.gz RJEZUQFXJQBJSA-ZLPCBKJTSA-N 1 0 273.464 5.332 10 0 CKAERO CCC(C)(C)C1CCC([NH2+][C@H](C)c2ccccc2)CC1 ZINC000020567172 171255103 /nfs/dbraw/zinc/25/51/03/171255103.db2.gz RJEZUQFXJQBJSA-FAEJEUNOSA-N 1 0 273.464 5.332 10 0 CKAERO CC(C)c1ccc([C@@H]([NH3+])c2cc3cc(Cl)ccc3o2)cc1 ZINC000020592814 171261928 /nfs/dbraw/zinc/26/19/28/171261928.db2.gz AEDRVFYPLFERBA-GOSISDBHSA-N 1 0 299.801 5.258 10 0 CKAERO CC(C)c1ccc([C@H]([NH3+])c2cc3cc(Cl)ccc3o2)cc1 ZINC000020592815 171262192 /nfs/dbraw/zinc/26/21/92/171262192.db2.gz AEDRVFYPLFERBA-SFHVURJKSA-N 1 0 299.801 5.258 10 0 CKAERO CCCC[C@@H](CC)[C@@H]([NH3+])c1csc2ccccc21 ZINC000020596245 171265225 /nfs/dbraw/zinc/26/52/25/171265225.db2.gz XUIFFPMBYQUAFH-MLGOLLRUSA-N 1 0 261.434 5.118 10 0 CKAERO CCCC[C@H](CC)[C@@H]([NH3+])c1csc2ccccc21 ZINC000020596246 171265379 /nfs/dbraw/zinc/26/53/79/171265379.db2.gz XUIFFPMBYQUAFH-BLLLJJGKSA-N 1 0 261.434 5.118 10 0 CKAERO CCCC[C@@H](CC)[C@H]([NH3+])c1csc2ccccc21 ZINC000020596247 171264935 /nfs/dbraw/zinc/26/49/35/171264935.db2.gz XUIFFPMBYQUAFH-WBMJQRKESA-N 1 0 261.434 5.118 10 0 CKAERO CCCC[C@H](CC)[C@H]([NH3+])c1csc2ccccc21 ZINC000020596248 171265193 /nfs/dbraw/zinc/26/51/93/171265193.db2.gz XUIFFPMBYQUAFH-LRDDRELGSA-N 1 0 261.434 5.118 10 0 CKAERO Cc1cccc(C[NH2+][C@H](C)c2cc(Cl)ccc2Cl)c1 ZINC000021008136 327940323 /nfs/dbraw/zinc/94/03/23/327940323.db2.gz VLKMDSDNTKLGBG-GFCCVEGCSA-N 1 0 294.225 5.153 10 0 CKAERO Cc1cccc(C[NH2+][C@@H](C)c2cc(Cl)ccc2Cl)c1 ZINC000021008138 327940340 /nfs/dbraw/zinc/94/03/40/327940340.db2.gz VLKMDSDNTKLGBG-LBPRGKRZSA-N 1 0 294.225 5.153 10 0 CKAERO C[C@@H]([NH2+]Cc1cccs1)c1ccc(-c2ccccc2)cc1 ZINC000021008585 171285364 /nfs/dbraw/zinc/28/53/64/171285364.db2.gz GWLNWQGIJRPWRB-OAHLLOKOSA-N 1 0 293.435 5.266 10 0 CKAERO C[C@H]([NH2+]Cc1cccs1)c1ccc(-c2ccccc2)cc1 ZINC000021008586 171285505 /nfs/dbraw/zinc/28/55/05/171285505.db2.gz GWLNWQGIJRPWRB-HNNXBMFYSA-N 1 0 293.435 5.266 10 0 CKAERO CC(C)C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1)c1ccccc1 ZINC000021008598 171285389 /nfs/dbraw/zinc/28/53/89/171285389.db2.gz YLGCZBWOGYSBSS-HNAYVOBHSA-N 1 0 285.406 5.264 10 0 CKAERO CC(C)C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1)c1ccccc1 ZINC000021008599 171285608 /nfs/dbraw/zinc/28/56/08/171285608.db2.gz YLGCZBWOGYSBSS-KXBFYZLASA-N 1 0 285.406 5.264 10 0 CKAERO CC(C)C[C@@H]([NH2+][C@H](C)c1ccc(F)cc1)c1ccccc1 ZINC000021008600 171285617 /nfs/dbraw/zinc/28/56/17/171285617.db2.gz YLGCZBWOGYSBSS-DNVCBOLYSA-N 1 0 285.406 5.264 10 0 CKAERO CC(C)C[C@H]([NH2+][C@H](C)c1ccc(F)cc1)c1ccccc1 ZINC000021008601 171285646 /nfs/dbraw/zinc/28/56/46/171285646.db2.gz YLGCZBWOGYSBSS-BEFAXECRSA-N 1 0 285.406 5.264 10 0 CKAERO CC(C)Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccccc2)cc1 ZINC000021008604 171285416 /nfs/dbraw/zinc/28/54/16/171285416.db2.gz FEHSJRNXIPXOKL-DLBZAZTESA-N 1 0 281.443 5.297 10 0 CKAERO CC(C)Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccccc2)cc1 ZINC000021008605 171285464 /nfs/dbraw/zinc/28/54/64/171285464.db2.gz FEHSJRNXIPXOKL-IRXDYDNUSA-N 1 0 281.443 5.297 10 0 CKAERO CC(C)Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccccc2)cc1 ZINC000021008606 171285634 /nfs/dbraw/zinc/28/56/34/171285634.db2.gz FEHSJRNXIPXOKL-IAGOWNOFSA-N 1 0 281.443 5.297 10 0 CKAERO CC(C)Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccccc2)cc1 ZINC000021008607 171285546 /nfs/dbraw/zinc/28/55/46/171285546.db2.gz FEHSJRNXIPXOKL-SJORKVTESA-N 1 0 281.443 5.297 10 0 CKAERO CCCC(CCC)[NH2+]CCc1ccc(Cl)cc1Cl ZINC000021008691 171285687 /nfs/dbraw/zinc/28/56/87/171285687.db2.gz APJPOABTEMVPEK-UHFFFAOYSA-N 1 0 288.262 5.094 10 0 CKAERO C[C@@H]([NH2+]CCC1=CCCCC1)c1ccc(F)c(Cl)c1 ZINC000021008972 171285640 /nfs/dbraw/zinc/28/56/40/171285640.db2.gz LBVSENJWQVXKKG-GFCCVEGCSA-N 1 0 281.802 5.020 10 0 CKAERO C[C@H]([NH2+]CCC1=CCCCC1)c1ccc(F)c(Cl)c1 ZINC000021008973 171285384 /nfs/dbraw/zinc/28/53/84/171285384.db2.gz LBVSENJWQVXKKG-LBPRGKRZSA-N 1 0 281.802 5.020 10 0 CKAERO CC(C)c1ccc(Sc2ccc([C@@H](C)[NH3+])cc2F)cc1 ZINC000021008992 171285820 /nfs/dbraw/zinc/28/58/20/171285820.db2.gz LHOHZSZRCRCQTN-GFCCVEGCSA-N 1 0 289.419 5.120 10 0 CKAERO CC(C)c1ccc(Sc2ccc([C@H](C)[NH3+])cc2F)cc1 ZINC000021008993 171285992 /nfs/dbraw/zinc/28/59/92/171285992.db2.gz LHOHZSZRCRCQTN-LBPRGKRZSA-N 1 0 289.419 5.120 10 0 CKAERO CCC[C@@H]([NH2+][C@@H](C)CCC(C)C)c1ccc(Cl)cc1 ZINC000021009065 171285848 /nfs/dbraw/zinc/28/58/48/171285848.db2.gz YZSBSAZGCOQPDX-WMLDXEAASA-N 1 0 281.871 5.596 10 0 CKAERO CCC[C@H]([NH2+][C@@H](C)CCC(C)C)c1ccc(Cl)cc1 ZINC000021009066 171285977 /nfs/dbraw/zinc/28/59/77/171285977.db2.gz YZSBSAZGCOQPDX-YOEHRIQHSA-N 1 0 281.871 5.596 10 0 CKAERO CCC[C@@H]([NH2+][C@H](C)CCC(C)C)c1ccc(Cl)cc1 ZINC000021009067 171286117 /nfs/dbraw/zinc/28/61/17/171286117.db2.gz YZSBSAZGCOQPDX-RHSMWYFYSA-N 1 0 281.871 5.596 10 0 CKAERO CCC[C@H]([NH2+][C@H](C)CCC(C)C)c1ccc(Cl)cc1 ZINC000021009068 171286045 /nfs/dbraw/zinc/28/60/45/171286045.db2.gz YZSBSAZGCOQPDX-PBHICJAKSA-N 1 0 281.871 5.596 10 0 CKAERO CC(C)Cc1ccc([C@@H](C)[NH2+][C@@H]2CCC[C@@H](C)[C@@H]2C)cc1 ZINC000021009178 171286086 /nfs/dbraw/zinc/28/60/86/171286086.db2.gz VPGICOWCNSKLEE-AXVVYFOYSA-N 1 0 287.491 5.360 10 0 CKAERO CC(C)Cc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@@H](C)[C@@H]2C)cc1 ZINC000021009179 171285824 /nfs/dbraw/zinc/28/58/24/171285824.db2.gz VPGICOWCNSKLEE-NHAYFPRASA-N 1 0 287.491 5.360 10 0 CKAERO CC(C)Cc1ccc([C@@H](C)[NH2+][C@H]2CCC[C@@H](C)[C@@H]2C)cc1 ZINC000021009180 171285910 /nfs/dbraw/zinc/28/59/10/171285910.db2.gz VPGICOWCNSKLEE-YZLZLFLDSA-N 1 0 287.491 5.360 10 0 CKAERO CC(C)Cc1ccc([C@H](C)[NH2+][C@H]2CCC[C@@H](C)[C@@H]2C)cc1 ZINC000021009181 171285886 /nfs/dbraw/zinc/28/58/86/171285886.db2.gz VPGICOWCNSKLEE-YLAKUSLOSA-N 1 0 287.491 5.360 10 0 CKAERO CC[C@@H]([NH2+][C@@H](C)c1ccccc1Cl)c1ccc(F)cc1 ZINC000021009313 171285771 /nfs/dbraw/zinc/28/57/71/171285771.db2.gz KAMADIXYLRNTGK-YVEFUNNKSA-N 1 0 291.797 5.281 10 0 CKAERO CC[C@H]([NH2+][C@@H](C)c1ccccc1Cl)c1ccc(F)cc1 ZINC000021009314 171285879 /nfs/dbraw/zinc/28/58/79/171285879.db2.gz KAMADIXYLRNTGK-SJCJKPOMSA-N 1 0 291.797 5.281 10 0 CKAERO CC[C@@H]([NH2+][C@H](C)c1ccccc1Cl)c1ccc(F)cc1 ZINC000021009315 171286136 /nfs/dbraw/zinc/28/61/36/171286136.db2.gz KAMADIXYLRNTGK-SJKOYZFVSA-N 1 0 291.797 5.281 10 0 CKAERO CC[C@H]([NH2+][C@H](C)c1ccccc1Cl)c1ccc(F)cc1 ZINC000021009316 171285825 /nfs/dbraw/zinc/28/58/25/171285825.db2.gz KAMADIXYLRNTGK-PXAZEXFGSA-N 1 0 291.797 5.281 10 0 CKAERO C1CCC([NH2+]C2CCCCCCCCCCC2)CC1 ZINC000021009591 171286206 /nfs/dbraw/zinc/28/62/06/171286206.db2.gz XPPDRSHLJVZXRX-UHFFFAOYSA-N 1 0 265.485 5.582 10 0 CKAERO CC(C)CCCCCC[NH2+]C1[C@@H](C)CCC[C@@H]1C ZINC000021009947 171286442 /nfs/dbraw/zinc/28/64/42/171286442.db2.gz VSANOYKLEPUEDA-HOTGVXAUSA-N 1 0 253.474 5.007 10 0 CKAERO CC(C)CCCCCC[NH2+]C1[C@H](C)CCC[C@@H]1C ZINC000021009948 171286405 /nfs/dbraw/zinc/28/64/05/171286405.db2.gz VSANOYKLEPUEDA-SJPCQFCGSA-N 1 0 253.474 5.007 10 0 CKAERO CC(C)CCCCCC[NH2+]C1[C@H](C)CCC[C@H]1C ZINC000021009951 171286295 /nfs/dbraw/zinc/28/62/95/171286295.db2.gz VSANOYKLEPUEDA-HZPDHXFCSA-N 1 0 253.474 5.007 10 0 CKAERO CC(C)(C)C[C@@H]([NH3+])c1ccc(C2CCCCC2)cc1 ZINC000021009993 171286493 /nfs/dbraw/zinc/28/64/93/171286493.db2.gz CHQUEIHZUKEYGU-QGZVFWFLSA-N 1 0 259.437 5.170 10 0 CKAERO CC(C)(C)C[C@H]([NH3+])c1ccc(C2CCCCC2)cc1 ZINC000021009995 171286450 /nfs/dbraw/zinc/28/64/50/171286450.db2.gz CHQUEIHZUKEYGU-KRWDZBQOSA-N 1 0 259.437 5.170 10 0 CKAERO C[C@@H]([NH2+]Cc1ccc(Cl)cc1)c1ccc2c(c1)CCCC2 ZINC000021010772 171286818 /nfs/dbraw/zinc/28/68/18/171286818.db2.gz PJRIOMFUHWDGDK-CQSZACIVSA-N 1 0 299.845 5.070 10 0 CKAERO C[C@H]([NH2+]Cc1ccc(Cl)cc1)c1ccc2c(c1)CCCC2 ZINC000021010773 171286829 /nfs/dbraw/zinc/28/68/29/171286829.db2.gz PJRIOMFUHWDGDK-AWEZNQCLSA-N 1 0 299.845 5.070 10 0 CKAERO Cc1ccccc1C[NH2+][C@H](C)c1ccc(Cl)cc1Cl ZINC000021010948 171286832 /nfs/dbraw/zinc/28/68/32/171286832.db2.gz QJVDJHXFLSUBTJ-GFCCVEGCSA-N 1 0 294.225 5.153 10 0 CKAERO Cc1ccccc1C[NH2+][C@@H](C)c1ccc(Cl)cc1Cl ZINC000021010949 171286845 /nfs/dbraw/zinc/28/68/45/171286845.db2.gz QJVDJHXFLSUBTJ-LBPRGKRZSA-N 1 0 294.225 5.153 10 0 CKAERO Cc1ccccc1[C@@H](C)[NH2+][C@@H]1CCCC[C@@H]1C(C)(C)C ZINC000021011160 171287242 /nfs/dbraw/zinc/28/72/42/171287242.db2.gz NVPZSXDECHGIQM-BPQIPLTHSA-N 1 0 273.464 5.251 10 0 CKAERO Cc1ccccc1[C@H](C)[NH2+][C@@H]1CCCC[C@@H]1C(C)(C)C ZINC000021011162 171287276 /nfs/dbraw/zinc/28/72/76/171287276.db2.gz NVPZSXDECHGIQM-RYQLBKOJSA-N 1 0 273.464 5.251 10 0 CKAERO Cc1ccccc1[C@@H](C)[NH2+][C@H]1CCCC[C@@H]1C(C)(C)C ZINC000021011164 171287203 /nfs/dbraw/zinc/28/72/03/171287203.db2.gz NVPZSXDECHGIQM-NJAFHUGGSA-N 1 0 273.464 5.251 10 0 CKAERO Cc1ccccc1[C@H](C)[NH2+][C@H]1CCCC[C@@H]1C(C)(C)C ZINC000021011166 171287224 /nfs/dbraw/zinc/28/72/24/171287224.db2.gz NVPZSXDECHGIQM-SZMVWBNQSA-N 1 0 273.464 5.251 10 0 CKAERO CC(C)CCOc1ccc(C[NH2+][C@@H](C)CCC(C)C)cc1 ZINC000021011194 171287006 /nfs/dbraw/zinc/28/70/06/171287006.db2.gz AMDAIKLTQMKOEE-KRWDZBQOSA-N 1 0 291.479 5.026 10 0 CKAERO CC(C)CCOc1ccc(C[NH2+][C@H](C)CCC(C)C)cc1 ZINC000021011196 171287243 /nfs/dbraw/zinc/28/72/43/171287243.db2.gz AMDAIKLTQMKOEE-QGZVFWFLSA-N 1 0 291.479 5.026 10 0 CKAERO CCCC[C@@H]([NH2+][C@@H](C)c1cccs1)c1ccc(F)cc1 ZINC000021011570 171287302 /nfs/dbraw/zinc/28/73/02/171287302.db2.gz YKOKJPJCXLIMRK-XJKSGUPXSA-N 1 0 291.435 5.469 10 0 CKAERO CCCC[C@H]([NH2+][C@@H](C)c1cccs1)c1ccc(F)cc1 ZINC000021011572 171287350 /nfs/dbraw/zinc/28/73/50/171287350.db2.gz YKOKJPJCXLIMRK-BBRMVZONSA-N 1 0 291.435 5.469 10 0 CKAERO CCCC[C@@H]([NH2+][C@H](C)c1cccs1)c1ccc(F)cc1 ZINC000021011574 171287184 /nfs/dbraw/zinc/28/71/84/171287184.db2.gz YKOKJPJCXLIMRK-CZUORRHYSA-N 1 0 291.435 5.469 10 0 CKAERO CCCC[C@H]([NH2+][C@H](C)c1cccs1)c1ccc(F)cc1 ZINC000021011576 171287149 /nfs/dbraw/zinc/28/71/49/171287149.db2.gz YKOKJPJCXLIMRK-CJNGLKHVSA-N 1 0 291.435 5.469 10 0 CKAERO CCC(C)(C)C1CCC([NH2+][C@@H](C)c2cccc(F)c2)CC1 ZINC000021011580 171287279 /nfs/dbraw/zinc/28/72/79/171287279.db2.gz YINWWDYJUNBWIC-NXVRBGIVSA-N 1 0 291.454 5.471 10 0 CKAERO CCC(C)(C)C1CCC([NH2+][C@H](C)c2cccc(F)c2)CC1 ZINC000021011582 171287098 /nfs/dbraw/zinc/28/70/98/171287098.db2.gz YINWWDYJUNBWIC-MXWWQKGMSA-N 1 0 291.454 5.471 10 0 CKAERO CC(C)CC[C@@H](C)[NH2+][C@@H](C)C12CC3CC(CC(C3)C1)C2 ZINC000021011717 171287248 /nfs/dbraw/zinc/28/72/48/171287248.db2.gz FTKGTBONFQEKKP-IZNXWIIVSA-N 1 0 277.496 5.006 10 0 CKAERO CC(C)CC[C@H](C)[NH2+][C@@H](C)C12CC3CC(CC(C3)C1)C2 ZINC000021011719 171287153 /nfs/dbraw/zinc/28/71/53/171287153.db2.gz FTKGTBONFQEKKP-XJPGRJHWSA-N 1 0 277.496 5.006 10 0 CKAERO CC(C)CC[C@@H](C)[NH2+][C@H](C)C12CC3CC(CC(C3)C1)C2 ZINC000021011721 171287250 /nfs/dbraw/zinc/28/72/50/171287250.db2.gz FTKGTBONFQEKKP-NTIGLHRHSA-N 1 0 277.496 5.006 10 0 CKAERO CC(C)CC[C@H](C)[NH2+][C@H](C)C12CC3CC(CC(C3)C1)C2 ZINC000021011723 171287328 /nfs/dbraw/zinc/28/73/28/171287328.db2.gz FTKGTBONFQEKKP-CENPTBCRSA-N 1 0 277.496 5.006 10 0 CKAERO CCC(C)(C)C1CCC([NH2+][C@@H]2CCC[C@@H](C)[C@@H]2C)CC1 ZINC000021011895 171287574 /nfs/dbraw/zinc/28/75/74/171287574.db2.gz XYABHTDCKGRZDC-YFVGIKETSA-N 1 0 279.512 5.396 10 0 CKAERO CCC(C)(C)C1CCC([NH2+][C@H]2CCC[C@@H](C)[C@@H]2C)CC1 ZINC000021011896 171287447 /nfs/dbraw/zinc/28/74/47/171287447.db2.gz XYABHTDCKGRZDC-VGAKTEPXSA-N 1 0 279.512 5.396 10 0 CKAERO CCC(C)(C)C1CCC([NH2+][C@@H]2CCC[C@H](C)[C@@H]2C)CC1 ZINC000021011897 171287565 /nfs/dbraw/zinc/28/75/65/171287565.db2.gz XYABHTDCKGRZDC-NRNWYNIKSA-N 1 0 279.512 5.396 10 0 CKAERO CCC(C)(C)C1CCC([NH2+][C@H]2CCC[C@H](C)[C@@H]2C)CC1 ZINC000021011898 171287575 /nfs/dbraw/zinc/28/75/75/171287575.db2.gz XYABHTDCKGRZDC-QOCJCZBQSA-N 1 0 279.512 5.396 10 0 CKAERO CC(C)c1ccc([C@@H](C)[NH2+]C2CCCCCCC2)cc1 ZINC000021012100 171287773 /nfs/dbraw/zinc/28/77/73/171287773.db2.gz XRLWHVHGJQMCEY-MRXNPFEDSA-N 1 0 273.464 5.574 10 0 CKAERO CC(C)c1ccc([C@H](C)[NH2+]C2CCCCCCC2)cc1 ZINC000021012101 171287495 /nfs/dbraw/zinc/28/74/95/171287495.db2.gz XRLWHVHGJQMCEY-INIZCTEOSA-N 1 0 273.464 5.574 10 0 CKAERO CCCC1CCC([NH2+]Cc2cccc(C(F)(F)F)c2)CC1 ZINC000021012478 171288062 /nfs/dbraw/zinc/28/80/62/171288062.db2.gz SPJPGPKIKQJUHK-UHFFFAOYSA-N 1 0 299.380 5.154 10 0 CKAERO CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1[NH2+][C@@H](C)c1ccc(Cl)cc1 ZINC000021012557 171288022 /nfs/dbraw/zinc/28/80/22/171288022.db2.gz PYDPSONNQJLFAY-BODMPHMZSA-N 1 0 293.882 5.451 10 0 CKAERO CC(C)[C@@H]1CC[C@H](C)C[C@@H]1[NH2+][C@@H](C)c1ccc(Cl)cc1 ZINC000021012558 171287988 /nfs/dbraw/zinc/28/79/88/171287988.db2.gz PYDPSONNQJLFAY-USJZOSNVSA-N 1 0 293.882 5.451 10 0 CKAERO CC(C)[C@H]1CC[C@@H](C)C[C@@H]1[NH2+][C@@H](C)c1ccc(Cl)cc1 ZINC000021012559 171288032 /nfs/dbraw/zinc/28/80/32/171288032.db2.gz PYDPSONNQJLFAY-NONVJHHQSA-N 1 0 293.882 5.451 10 0 CKAERO CC(C)[C@H]1CC[C@H](C)C[C@@H]1[NH2+][C@@H](C)c1ccc(Cl)cc1 ZINC000021012560 171287879 /nfs/dbraw/zinc/28/78/79/171287879.db2.gz PYDPSONNQJLFAY-ZZCKCESHSA-N 1 0 293.882 5.451 10 0 CKAERO CC[C@@H]([NH2+][C@@H](C)c1ccccc1C)c1cccc(Cl)c1 ZINC000021012772 171288476 /nfs/dbraw/zinc/28/84/76/171288476.db2.gz PNGWHHRZPSRLAN-KBXCAEBGSA-N 1 0 287.834 5.450 10 0 CKAERO CC[C@H]([NH2+][C@@H](C)c1ccccc1C)c1cccc(Cl)c1 ZINC000021012773 171288299 /nfs/dbraw/zinc/28/82/99/171288299.db2.gz PNGWHHRZPSRLAN-KSSFIOAISA-N 1 0 287.834 5.450 10 0 CKAERO CC[C@@H]([NH2+][C@H](C)c1ccccc1C)c1cccc(Cl)c1 ZINC000021012774 171288513 /nfs/dbraw/zinc/28/85/13/171288513.db2.gz PNGWHHRZPSRLAN-RDTXWAMCSA-N 1 0 287.834 5.450 10 0 CKAERO CC[C@H]([NH2+][C@H](C)c1ccccc1C)c1cccc(Cl)c1 ZINC000021012775 171288529 /nfs/dbraw/zinc/28/85/29/171288529.db2.gz PNGWHHRZPSRLAN-KDOFPFPSSA-N 1 0 287.834 5.450 10 0 CKAERO C[C@H]([NH2+][C@@H](C)c1ccc(F)c(F)c1)c1cccc(Cl)c1 ZINC000021012861 171288557 /nfs/dbraw/zinc/28/85/57/171288557.db2.gz OGLMHJYDAORKLE-QWRGUYRKSA-N 1 0 295.760 5.030 10 0 CKAERO C[C@@H]([NH2+][C@@H](C)c1cccc(Cl)c1)c1ccc(F)c(F)c1 ZINC000021012863 171288506 /nfs/dbraw/zinc/28/85/06/171288506.db2.gz OGLMHJYDAORKLE-WDEREUQCSA-N 1 0 295.760 5.030 10 0 CKAERO CCC1CCC([NH2+][C@@H](C)c2cccc3ccccc32)CC1 ZINC000021013784 171289019 /nfs/dbraw/zinc/28/90/19/171289019.db2.gz YFQWCKGUOVYUEW-HJOIGYKYSA-N 1 0 281.443 5.459 10 0 CKAERO CCC1CCC([NH2+][C@H](C)c2cccc3ccccc32)CC1 ZINC000021013785 171288924 /nfs/dbraw/zinc/28/89/24/171288924.db2.gz YFQWCKGUOVYUEW-KLHKWILBSA-N 1 0 281.443 5.459 10 0 CKAERO CCc1ccc([C@@H]([NH2+]CC2CCCCC2)C(C)C)cc1 ZINC000021013872 171288907 /nfs/dbraw/zinc/28/89/07/171288907.db2.gz YHRAXXNUKWNJKW-IBGZPJMESA-N 1 0 273.464 5.116 10 0 CKAERO CCc1ccc([C@H]([NH2+]CC2CCCCC2)C(C)C)cc1 ZINC000021013873 171288829 /nfs/dbraw/zinc/28/88/29/171288829.db2.gz YHRAXXNUKWNJKW-LJQANCHMSA-N 1 0 273.464 5.116 10 0 CKAERO CC(C)CC[NH2+]C1CCCCCCCCCCC1 ZINC000021013949 171288864 /nfs/dbraw/zinc/28/88/64/171288864.db2.gz OLORSAKWVARUSR-UHFFFAOYSA-N 1 0 253.474 5.295 10 0 CKAERO C[C@H]([NH2+][C@H]1CCCC[C@@H]1C)c1ccc(Cl)c(Cl)c1 ZINC000021013959 171288763 /nfs/dbraw/zinc/28/87/63/171288763.db2.gz ZRKJGJRVQMIKBB-PGUXBMHVSA-N 1 0 286.246 5.223 10 0 CKAERO C[C@H]([NH2+][C@@H]1CCCC[C@@H]1C)c1ccc(Cl)c(Cl)c1 ZINC000021013961 171288932 /nfs/dbraw/zinc/28/89/32/171288932.db2.gz ZRKJGJRVQMIKBB-ZIBATOQPSA-N 1 0 286.246 5.223 10 0 CKAERO CC(C)CC[C@@H](C)[NH2+][C@@H](C)c1cc(Cl)ccc1Cl ZINC000021014106 171288925 /nfs/dbraw/zinc/28/89/25/171288925.db2.gz XDZUBLFKSOBAIE-NEPJUHHUSA-N 1 0 288.262 5.469 10 0 CKAERO CC(C)CC[C@H](C)[NH2+][C@@H](C)c1cc(Cl)ccc1Cl ZINC000021014108 171289050 /nfs/dbraw/zinc/28/90/50/171289050.db2.gz XDZUBLFKSOBAIE-RYUDHWBXSA-N 1 0 288.262 5.469 10 0 CKAERO CC(C)CC[C@@H](C)[NH2+][C@H](C)c1cc(Cl)ccc1Cl ZINC000021014110 171288729 /nfs/dbraw/zinc/28/87/29/171288729.db2.gz XDZUBLFKSOBAIE-VXGBXAGGSA-N 1 0 288.262 5.469 10 0 CKAERO CC(C)CC[C@H](C)[NH2+][C@H](C)c1cc(Cl)ccc1Cl ZINC000021014112 171288712 /nfs/dbraw/zinc/28/87/12/171288712.db2.gz XDZUBLFKSOBAIE-NWDGAFQWSA-N 1 0 288.262 5.469 10 0 CKAERO C[C@@H]([NH2+]C1CCCCCC1)c1cc(Cl)ccc1Cl ZINC000021014875 171289263 /nfs/dbraw/zinc/28/92/63/171289263.db2.gz ZFJSTUGTPPRRQO-LLVKDONJSA-N 1 0 286.246 5.367 10 0 CKAERO C[C@H]([NH2+]C1CCCCCC1)c1cc(Cl)ccc1Cl ZINC000021014877 171289098 /nfs/dbraw/zinc/28/90/98/171289098.db2.gz ZFJSTUGTPPRRQO-NSHDSACASA-N 1 0 286.246 5.367 10 0 CKAERO C[C@@H]([NH3+])c1ccc(Sc2cc(Cl)ccc2Cl)cc1 ZINC000021015071 171289134 /nfs/dbraw/zinc/28/91/34/171289134.db2.gz QHCYQRQVFMJCOL-SECBINFHSA-N 1 0 298.238 5.164 10 0 CKAERO C[C@H]([NH3+])c1ccc(Sc2cc(Cl)ccc2Cl)cc1 ZINC000021015073 171289137 /nfs/dbraw/zinc/28/91/37/171289137.db2.gz QHCYQRQVFMJCOL-VIFPVBQESA-N 1 0 298.238 5.164 10 0 CKAERO CC[C@@H](C)[C@@H](C)[NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000021016490 171289773 /nfs/dbraw/zinc/28/97/73/171289773.db2.gz LZFNRFSNIJTTFW-MXWKQRLJSA-N 1 0 274.235 5.079 10 0 CKAERO CC[C@H](C)[C@@H](C)[NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000021016494 171289692 /nfs/dbraw/zinc/28/96/92/171289692.db2.gz LZFNRFSNIJTTFW-AXFHLTTASA-N 1 0 274.235 5.079 10 0 CKAERO CC[C@@H](C)[C@H](C)[NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000021016498 171289717 /nfs/dbraw/zinc/28/97/17/171289717.db2.gz LZFNRFSNIJTTFW-VWYCJHECSA-N 1 0 274.235 5.079 10 0 CKAERO CC[C@H](C)[C@H](C)[NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000021016502 171289856 /nfs/dbraw/zinc/28/98/56/171289856.db2.gz LZFNRFSNIJTTFW-DCAQKATOSA-N 1 0 274.235 5.079 10 0 CKAERO CCC(C)(C)C1CCC([NH2+]C2CCC(C)CC2)CC1 ZINC000021016768 171289934 /nfs/dbraw/zinc/28/99/34/171289934.db2.gz GHCHGHMSUAEGJA-UHFFFAOYSA-N 1 0 265.485 5.150 10 0 CKAERO CC(C)(C)[C@H]1CCCC[C@@H]1[NH2+]CCc1ccc(Cl)cc1 ZINC000021017695 184535965 /nfs/dbraw/zinc/53/59/65/184535965.db2.gz ZEAKKVAJBSUVRZ-IRXDYDNUSA-N 1 0 293.882 5.077 10 0 CKAERO CC(C)(C)[C@@H]1CCCC[C@H]1[NH2+]CCc1ccc(Cl)cc1 ZINC000021017699 184535994 /nfs/dbraw/zinc/53/59/94/184535994.db2.gz ZEAKKVAJBSUVRZ-IAGOWNOFSA-N 1 0 293.882 5.077 10 0 CKAERO C[C@@H]([NH2+]C1CCCCCCC1)c1cccc(Cl)c1 ZINC000021018614 171290425 /nfs/dbraw/zinc/29/04/25/171290425.db2.gz FTXWNHPLRYJGSI-CYBMUJFWSA-N 1 0 265.828 5.104 10 0 CKAERO C[C@H]([NH2+]C1CCCCCCC1)c1cccc(Cl)c1 ZINC000021018618 171290181 /nfs/dbraw/zinc/29/01/81/171290181.db2.gz FTXWNHPLRYJGSI-ZDUSSCGKSA-N 1 0 265.828 5.104 10 0 CKAERO Cc1cc(C)c([C@H](C)[NH2+][C@H](C)c2cccc(F)c2)cc1C ZINC000021018630 171290228 /nfs/dbraw/zinc/29/02/28/171290228.db2.gz FGKKXBUAGIENHJ-CVEARBPZSA-N 1 0 285.406 5.163 10 0 CKAERO Cc1cc(C)c([C@H](C)[NH2+][C@@H](C)c2cccc(F)c2)cc1C ZINC000021018634 171290128 /nfs/dbraw/zinc/29/01/28/171290128.db2.gz FGKKXBUAGIENHJ-HOTGVXAUSA-N 1 0 285.406 5.163 10 0 CKAERO Cc1cc(C)c([C@@H](C)[NH2+][C@H](C)c2cccc(F)c2)cc1C ZINC000021018638 171290319 /nfs/dbraw/zinc/29/03/19/171290319.db2.gz FGKKXBUAGIENHJ-HZPDHXFCSA-N 1 0 285.406 5.163 10 0 CKAERO Cc1cc(C)c([C@@H](C)[NH2+][C@@H](C)c2cccc(F)c2)cc1C ZINC000021018643 171290115 /nfs/dbraw/zinc/29/01/15/171290115.db2.gz FGKKXBUAGIENHJ-JKSUJKDBSA-N 1 0 285.406 5.163 10 0 CKAERO CCC(C)(C)C1CCC([NH2+]C2CCCCCC2)CC1 ZINC000021019215 171290393 /nfs/dbraw/zinc/29/03/93/171290393.db2.gz MIEOWACRXVWUBG-UHFFFAOYSA-N 1 0 265.485 5.294 10 0 CKAERO CC[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1)c1ccc(F)cc1 ZINC000021019475 171290366 /nfs/dbraw/zinc/29/03/66/171290366.db2.gz ARHURMNUOXWBTN-YVEFUNNKSA-N 1 0 291.797 5.281 10 0 CKAERO CC[C@H]([NH2+][C@@H](C)c1ccc(Cl)cc1)c1ccc(F)cc1 ZINC000021019477 171290384 /nfs/dbraw/zinc/29/03/84/171290384.db2.gz ARHURMNUOXWBTN-SJCJKPOMSA-N 1 0 291.797 5.281 10 0 CKAERO CC[C@@H]([NH2+][C@H](C)c1ccc(Cl)cc1)c1ccc(F)cc1 ZINC000021019480 171290167 /nfs/dbraw/zinc/29/01/67/171290167.db2.gz ARHURMNUOXWBTN-SJKOYZFVSA-N 1 0 291.797 5.281 10 0 CKAERO CC[C@H]([NH2+][C@H](C)c1ccc(Cl)cc1)c1ccc(F)cc1 ZINC000021019484 171290332 /nfs/dbraw/zinc/29/03/32/171290332.db2.gz ARHURMNUOXWBTN-PXAZEXFGSA-N 1 0 291.797 5.281 10 0 CKAERO C[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(-c2ccccc2)cc1 ZINC000021019949 171290473 /nfs/dbraw/zinc/29/04/73/171290473.db2.gz CCUMLKTVCSIQPP-UZLBHIALSA-N 1 0 279.427 5.022 10 0 CKAERO C[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(-c2ccccc2)cc1 ZINC000021019952 171290538 /nfs/dbraw/zinc/29/05/38/171290538.db2.gz CCUMLKTVCSIQPP-JXFKEZNVSA-N 1 0 279.427 5.022 10 0 CKAERO C[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(-c2ccccc2)cc1 ZINC000021019955 171290554 /nfs/dbraw/zinc/29/05/54/171290554.db2.gz CCUMLKTVCSIQPP-OXQOHEQNSA-N 1 0 279.427 5.022 10 0 CKAERO C[C@H]1CCCC[C@H]1[NH2+]Cc1ccc(-c2ccccc2)cc1 ZINC000021019958 171290526 /nfs/dbraw/zinc/29/05/26/171290526.db2.gz CCUMLKTVCSIQPP-OXJNMPFZSA-N 1 0 279.427 5.022 10 0 CKAERO C[C@@H]([NH2+]Cc1cccc2ccccc21)c1ccc(Cl)cc1 ZINC000021019997 171290486 /nfs/dbraw/zinc/29/04/86/171290486.db2.gz IBDBPVCRNBMTJM-CQSZACIVSA-N 1 0 295.813 5.344 10 0 CKAERO C[C@H]([NH2+]Cc1cccc2ccccc21)c1ccc(Cl)cc1 ZINC000021020001 171290579 /nfs/dbraw/zinc/29/05/79/171290579.db2.gz IBDBPVCRNBMTJM-AWEZNQCLSA-N 1 0 295.813 5.344 10 0 CKAERO C[C@@H]([NH2+][C@@H]1CCCCc2ccccc21)c1ccc(Cl)cc1 ZINC000021020253 171290535 /nfs/dbraw/zinc/29/05/35/171290535.db2.gz LDKZFIKZDYFRGZ-AUUYWEPGSA-N 1 0 299.845 5.458 10 0 CKAERO C[C@H]([NH2+][C@@H]1CCCCc2ccccc21)c1ccc(Cl)cc1 ZINC000021020257 171290494 /nfs/dbraw/zinc/29/04/94/171290494.db2.gz LDKZFIKZDYFRGZ-IFXJQAMLSA-N 1 0 299.845 5.458 10 0 CKAERO C[C@@H]([NH2+][C@H]1CCCCc2ccccc21)c1ccc(Cl)cc1 ZINC000021020260 171290531 /nfs/dbraw/zinc/29/05/31/171290531.db2.gz LDKZFIKZDYFRGZ-KUHUBIRLSA-N 1 0 299.845 5.458 10 0 CKAERO C[C@H]([NH2+][C@H]1CCCCc2ccccc21)c1ccc(Cl)cc1 ZINC000021020263 171290502 /nfs/dbraw/zinc/29/05/02/171290502.db2.gz LDKZFIKZDYFRGZ-LIRRHRJNSA-N 1 0 299.845 5.458 10 0 CKAERO C[C@@H]([NH2+]C1CCCCCCC1)c1ccc(Cl)cc1 ZINC000021022780 171290728 /nfs/dbraw/zinc/29/07/28/171290728.db2.gz OFOMXJGGFKRAHW-CYBMUJFWSA-N 1 0 265.828 5.104 10 0 CKAERO C[C@H]([NH2+]C1CCCCCCC1)c1ccc(Cl)cc1 ZINC000021022788 171290727 /nfs/dbraw/zinc/29/07/27/171290727.db2.gz OFOMXJGGFKRAHW-ZDUSSCGKSA-N 1 0 265.828 5.104 10 0 CKAERO C[C@H]([NH2+]C1[C@H](C)CCC[C@@H]1C)c1cccc2ccccc21 ZINC000021023991 171290836 /nfs/dbraw/zinc/29/08/36/171290836.db2.gz LXGRXRIRYFEQKL-BITNSZHFSA-N 1 0 281.443 5.315 10 0 CKAERO C[C@H]([NH2+]C1[C@@H](C)CCC[C@@H]1C)c1cccc2ccccc21 ZINC000021024001 171290917 /nfs/dbraw/zinc/29/09/17/171290917.db2.gz LXGRXRIRYFEQKL-JYJNAYRXSA-N 1 0 281.443 5.315 10 0 CKAERO Cc1cc([C@H](C)[NH2+][C@H](C)c2ccccc2Cl)c(C)s1 ZINC000021024389 171290930 /nfs/dbraw/zinc/29/09/30/171290930.db2.gz QCOIDGSZMDYOFO-NEPJUHHUSA-N 1 0 293.863 5.430 10 0 CKAERO Cc1cc([C@H](C)[NH2+][C@@H](C)c2ccccc2Cl)c(C)s1 ZINC000021024395 171290691 /nfs/dbraw/zinc/29/06/91/171290691.db2.gz QCOIDGSZMDYOFO-RYUDHWBXSA-N 1 0 293.863 5.430 10 0 CKAERO Cc1cc([C@@H](C)[NH2+][C@H](C)c2ccccc2Cl)c(C)s1 ZINC000021024402 171290893 /nfs/dbraw/zinc/29/08/93/171290893.db2.gz QCOIDGSZMDYOFO-VXGBXAGGSA-N 1 0 293.863 5.430 10 0 CKAERO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2ccccc2Cl)c(C)s1 ZINC000021024409 171290924 /nfs/dbraw/zinc/29/09/24/171290924.db2.gz QCOIDGSZMDYOFO-NWDGAFQWSA-N 1 0 293.863 5.430 10 0 CKAERO CCC(C)(C)C1CCC([NH2+]Cc2ccc(C)cc2)CC1 ZINC000021025746 171291326 /nfs/dbraw/zinc/29/13/26/171291326.db2.gz KTHPSASLZRVURM-UHFFFAOYSA-N 1 0 273.464 5.080 10 0 CKAERO Cc1cc(Oc2cccc(F)c2[C@@H](C)[NH3+])ccc1C(C)C ZINC000021027464 171291072 /nfs/dbraw/zinc/29/10/72/171291072.db2.gz NAKSHTYADPMDHQ-CYBMUJFWSA-N 1 0 287.378 5.070 10 0 CKAERO Cc1cc(Oc2cccc(F)c2[C@H](C)[NH3+])ccc1C(C)C ZINC000021027469 171291513 /nfs/dbraw/zinc/29/15/13/171291513.db2.gz NAKSHTYADPMDHQ-ZDUSSCGKSA-N 1 0 287.378 5.070 10 0 CKAERO CC[C@@H]([NH2+][C@@H](C)c1cccc(Cl)c1)c1ccc(F)cc1 ZINC000021028016 171291472 /nfs/dbraw/zinc/29/14/72/171291472.db2.gz UNVFOUMXISRPNO-YVEFUNNKSA-N 1 0 291.797 5.281 10 0 CKAERO CC[C@H]([NH2+][C@@H](C)c1cccc(Cl)c1)c1ccc(F)cc1 ZINC000021028024 171291682 /nfs/dbraw/zinc/29/16/82/171291682.db2.gz UNVFOUMXISRPNO-SJCJKPOMSA-N 1 0 291.797 5.281 10 0 CKAERO CC[C@@H]([NH2+][C@H](C)c1cccc(Cl)c1)c1ccc(F)cc1 ZINC000021028031 171291601 /nfs/dbraw/zinc/29/16/01/171291601.db2.gz UNVFOUMXISRPNO-SJKOYZFVSA-N 1 0 291.797 5.281 10 0 CKAERO CC[C@H]([NH2+][C@H](C)c1cccc(Cl)c1)c1ccc(F)cc1 ZINC000021028039 171291626 /nfs/dbraw/zinc/29/16/26/171291626.db2.gz UNVFOUMXISRPNO-PXAZEXFGSA-N 1 0 291.797 5.281 10 0 CKAERO CC(C)(C)[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccccc1Cl ZINC000021028808 171291512 /nfs/dbraw/zinc/29/15/12/171291512.db2.gz GRUHXUKSVTVSGF-ZBFHGGJFSA-N 1 0 279.855 5.035 10 0 CKAERO CC(C)(C)[C@H]1CCCC[C@@H]1[NH2+]Cc1ccccc1Cl ZINC000021028813 171291520 /nfs/dbraw/zinc/29/15/20/171291520.db2.gz GRUHXUKSVTVSGF-HOCLYGCPSA-N 1 0 279.855 5.035 10 0 CKAERO CC(C)(C)[C@@H]1CCCC[C@H]1[NH2+]Cc1ccccc1Cl ZINC000021028819 171291557 /nfs/dbraw/zinc/29/15/57/171291557.db2.gz GRUHXUKSVTVSGF-GDBMZVCRSA-N 1 0 279.855 5.035 10 0 CKAERO CC(C)(C)[C@H]1CCCC[C@H]1[NH2+]Cc1ccccc1Cl ZINC000021028826 171291754 /nfs/dbraw/zinc/29/17/54/171291754.db2.gz GRUHXUKSVTVSGF-GOEBONIOSA-N 1 0 279.855 5.035 10 0 CKAERO C[C@H]([NH2+][C@@H]1CCC[C@@H](C)C1)c1ccc(Cl)cc1Cl ZINC000021029660 171291686 /nfs/dbraw/zinc/29/16/86/171291686.db2.gz ZHQYUJIBDKUYLI-NTZNESFSSA-N 1 0 286.246 5.223 10 0 CKAERO C[C@H]([NH2+][C@H]1CCC[C@@H](C)C1)c1ccc(Cl)cc1Cl ZINC000021029673 171291519 /nfs/dbraw/zinc/29/15/19/171291519.db2.gz ZHQYUJIBDKUYLI-MDZLAQPJSA-N 1 0 286.246 5.223 10 0 CKAERO Cc1ccccc1[C@H](C)[NH2+][C@@H](C)c1cccc(Cl)c1 ZINC000021030547 171291641 /nfs/dbraw/zinc/29/16/41/171291641.db2.gz FREHKEOEXWAXDY-KBPBESRZSA-N 1 0 273.807 5.060 10 0 CKAERO Cc1ccccc1[C@@H](C)[NH2+][C@@H](C)c1cccc(Cl)c1 ZINC000021030562 171291667 /nfs/dbraw/zinc/29/16/67/171291667.db2.gz FREHKEOEXWAXDY-UONOGXRCSA-N 1 0 273.807 5.060 10 0 CKAERO Cc1ccccc1[C@H](C)[NH2+][C@H](C)c1ccc(C(C)C)cc1 ZINC000021031600 171291802 /nfs/dbraw/zinc/29/18/02/171291802.db2.gz GJBCRUNTDIDVDT-SJORKVTESA-N 1 0 281.443 5.530 10 0 CKAERO Cc1ccccc1[C@H](C)[NH2+][C@@H](C)c1ccc(C(C)C)cc1 ZINC000021031607 171291990 /nfs/dbraw/zinc/29/19/90/171291990.db2.gz GJBCRUNTDIDVDT-IRXDYDNUSA-N 1 0 281.443 5.530 10 0 CKAERO Cc1ccccc1[C@@H](C)[NH2+][C@H](C)c1ccc(C(C)C)cc1 ZINC000021031615 171291919 /nfs/dbraw/zinc/29/19/19/171291919.db2.gz GJBCRUNTDIDVDT-IAGOWNOFSA-N 1 0 281.443 5.530 10 0 CKAERO Cc1ccccc1[C@@H](C)[NH2+][C@@H](C)c1ccc(C(C)C)cc1 ZINC000021031621 171291833 /nfs/dbraw/zinc/29/18/33/171291833.db2.gz GJBCRUNTDIDVDT-DLBZAZTESA-N 1 0 281.443 5.530 10 0 CKAERO CC[C@@H](C)C[C@@H](CC)[NH2+][C@@H](C)c1ccc(Cl)cc1 ZINC000021032083 171291796 /nfs/dbraw/zinc/29/17/96/171291796.db2.gz KWZYGFXNKILHGE-DVOMOZLQSA-N 1 0 267.844 5.205 10 0 CKAERO CC[C@H](C[C@@H](C)CC)[NH2+][C@@H](C)c1ccc(Cl)cc1 ZINC000021032089 171291922 /nfs/dbraw/zinc/29/19/22/171291922.db2.gz KWZYGFXNKILHGE-HEHGZKQESA-N 1 0 267.844 5.205 10 0 CKAERO CC[C@@H](C)C[C@H](CC)[NH2+][C@@H](C)c1ccc(Cl)cc1 ZINC000021032096 171291819 /nfs/dbraw/zinc/29/18/19/171291819.db2.gz KWZYGFXNKILHGE-WWGRRREGSA-N 1 0 267.844 5.205 10 0 CKAERO CC[C@H](C)C[C@H](CC)[NH2+][C@@H](C)c1ccc(Cl)cc1 ZINC000021032102 171291885 /nfs/dbraw/zinc/29/18/85/171291885.db2.gz KWZYGFXNKILHGE-XEZPLFJOSA-N 1 0 267.844 5.205 10 0 CKAERO CC(C)c1ccc([C@@H](C)[NH2+]C[C@@H](C)c2ccccc2)cc1 ZINC000021032798 171291846 /nfs/dbraw/zinc/29/18/46/171291846.db2.gz FHWNESZALSHHMH-IAGOWNOFSA-N 1 0 281.443 5.264 10 0 CKAERO CC(C)c1ccc([C@H](C)[NH2+]C[C@@H](C)c2ccccc2)cc1 ZINC000021032805 171292072 /nfs/dbraw/zinc/29/20/72/171292072.db2.gz FHWNESZALSHHMH-SJORKVTESA-N 1 0 281.443 5.264 10 0 CKAERO CC(C)c1ccc([C@@H](C)[NH2+]C[C@H](C)c2ccccc2)cc1 ZINC000021032812 171291851 /nfs/dbraw/zinc/29/18/51/171291851.db2.gz FHWNESZALSHHMH-DLBZAZTESA-N 1 0 281.443 5.264 10 0 CKAERO CC(C)c1ccc([C@H](C)[NH2+]C[C@H](C)c2ccccc2)cc1 ZINC000021032819 171291980 /nfs/dbraw/zinc/29/19/80/171291980.db2.gz FHWNESZALSHHMH-IRXDYDNUSA-N 1 0 281.443 5.264 10 0 CKAERO C[C@@H]([NH2+]C1CCCCCCCCCCC1)c1ccncc1 ZINC000021033274 171291961 /nfs/dbraw/zinc/29/19/61/171291961.db2.gz OJSLEHVPRYAWSC-QGZVFWFLSA-N 1 0 288.479 5.406 10 0 CKAERO C[C@H]([NH2+]C1CCCCCCCCCCC1)c1ccncc1 ZINC000021033280 171292007 /nfs/dbraw/zinc/29/20/07/171292007.db2.gz OJSLEHVPRYAWSC-KRWDZBQOSA-N 1 0 288.479 5.406 10 0 CKAERO CC[C@@H]([NH2+][C@@H](C)CCC(C)C)c1cccc(Cl)c1 ZINC000021033286 171291811 /nfs/dbraw/zinc/29/18/11/171291811.db2.gz ONFQABISLQEWFS-XJKSGUPXSA-N 1 0 267.844 5.205 10 0 CKAERO CC[C@H]([NH2+][C@@H](C)CCC(C)C)c1cccc(Cl)c1 ZINC000021033293 171291936 /nfs/dbraw/zinc/29/19/36/171291936.db2.gz ONFQABISLQEWFS-BBRMVZONSA-N 1 0 267.844 5.205 10 0 CKAERO CC[C@@H]([NH2+][C@H](C)CCC(C)C)c1cccc(Cl)c1 ZINC000021033299 171292099 /nfs/dbraw/zinc/29/20/99/171292099.db2.gz ONFQABISLQEWFS-CZUORRHYSA-N 1 0 267.844 5.205 10 0 CKAERO CC[C@H]([NH2+][C@H](C)CCC(C)C)c1cccc(Cl)c1 ZINC000021033305 171292122 /nfs/dbraw/zinc/29/21/22/171292122.db2.gz ONFQABISLQEWFS-CJNGLKHVSA-N 1 0 267.844 5.205 10 0 CKAERO CC[C@@H]([NH2+][C@@H]1CCc2ccccc21)c1cccc(Cl)c1 ZINC000021033928 262374406 /nfs/dbraw/zinc/37/44/06/262374406.db2.gz ZQGPSXZBHYWPRN-QZTJIDSGSA-N 1 0 285.818 5.068 10 0 CKAERO CC[C@H]([NH2+][C@@H]1CCc2ccccc21)c1cccc(Cl)c1 ZINC000021033935 262374366 /nfs/dbraw/zinc/37/43/66/262374366.db2.gz ZQGPSXZBHYWPRN-ZWKOTPCHSA-N 1 0 285.818 5.068 10 0 CKAERO CC[C@@H]([NH2+][C@H]1CCc2ccccc21)c1cccc(Cl)c1 ZINC000021033941 262374495 /nfs/dbraw/zinc/37/44/95/262374495.db2.gz ZQGPSXZBHYWPRN-MSOLQXFVSA-N 1 0 285.818 5.068 10 0 CKAERO CC[C@H]([NH2+][C@H]1CCc2ccccc21)c1cccc(Cl)c1 ZINC000021033948 262374349 /nfs/dbraw/zinc/37/43/49/262374349.db2.gz ZQGPSXZBHYWPRN-ROUUACIJSA-N 1 0 285.818 5.068 10 0 CKAERO C[C@H]([NH2+]C1CCC(C)CC1)c1ccc(Cl)cc1Cl ZINC000021034676 171292428 /nfs/dbraw/zinc/29/24/28/171292428.db2.gz NFKFFLBOXVYDRN-AKJDGMEZSA-N 1 0 286.246 5.223 10 0 CKAERO C[C@@H]([NH2+]C1CCC(C)CC1)c1ccc(Cl)cc1Cl ZINC000021034683 171292459 /nfs/dbraw/zinc/29/24/59/171292459.db2.gz NFKFFLBOXVYDRN-QWKFWESOSA-N 1 0 286.246 5.223 10 0 CKAERO CC(C)c1ccc([C@@H](C)[NH2+]CCCc2ccccc2)cc1 ZINC000021035692 171292411 /nfs/dbraw/zinc/29/24/11/171292411.db2.gz ZEHWWOUOCNZPRW-QGZVFWFLSA-N 1 0 281.443 5.093 10 0 CKAERO CCCOc1ccc([C@@H](C)[NH2+]C2CCCCCCC2)cc1 ZINC000021035940 171292519 /nfs/dbraw/zinc/29/25/19/171292519.db2.gz PCWWSIQMHWBOBH-MRXNPFEDSA-N 1 0 289.463 5.239 10 0 CKAERO CCCOc1ccc([C@H](C)[NH2+]C2CCCCCCC2)cc1 ZINC000021035946 171292502 /nfs/dbraw/zinc/29/25/02/171292502.db2.gz PCWWSIQMHWBOBH-INIZCTEOSA-N 1 0 289.463 5.239 10 0 CKAERO CC[C@@H]([NH2+][C@@H]1CCC[C@@H](C)[C@@H]1C)c1ccc(Cl)cc1 ZINC000021036813 171292828 /nfs/dbraw/zinc/29/28/28/171292828.db2.gz XYNRKKFLCBIARQ-DLTLXFJOSA-N 1 0 279.855 5.205 10 0 CKAERO CC[C@H]([NH2+][C@@H]1CCC[C@@H](C)[C@@H]1C)c1ccc(Cl)cc1 ZINC000021036819 171293134 /nfs/dbraw/zinc/29/31/34/171293134.db2.gz XYNRKKFLCBIARQ-OSRSDYAFSA-N 1 0 279.855 5.205 10 0 CKAERO CC[C@@H]([NH2+][C@H]1CCC[C@@H](C)[C@@H]1C)c1ccc(Cl)cc1 ZINC000021036825 171292634 /nfs/dbraw/zinc/29/26/34/171292634.db2.gz XYNRKKFLCBIARQ-GFOFROLCSA-N 1 0 279.855 5.205 10 0 CKAERO CC[C@H]([NH2+][C@H]1CCC[C@@H](C)[C@@H]1C)c1ccc(Cl)cc1 ZINC000021036832 171292800 /nfs/dbraw/zinc/29/28/00/171292800.db2.gz XYNRKKFLCBIARQ-OQUILHJVSA-N 1 0 279.855 5.205 10 0 CKAERO c1ccc(CC[NH2+]C2CCCCCCCCCCC2)cc1 ZINC000021041297 171293383 /nfs/dbraw/zinc/29/33/83/171293383.db2.gz JMFURBKSXXDPNW-UHFFFAOYSA-N 1 0 287.491 5.492 10 0 CKAERO CCCc1ccc([C@@H](C)[NH2+]C2CCCCCCC2)cc1 ZINC000021042176 171293946 /nfs/dbraw/zinc/29/39/46/171293946.db2.gz RJRIEMUCQGOABG-MRXNPFEDSA-N 1 0 273.464 5.403 10 0 CKAERO CCCc1ccc([C@H](C)[NH2+]C2CCCCCCC2)cc1 ZINC000021042181 171293906 /nfs/dbraw/zinc/29/39/06/171293906.db2.gz RJRIEMUCQGOABG-INIZCTEOSA-N 1 0 273.464 5.403 10 0 CKAERO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccccc2Cl)cc1C ZINC000021043150 171293682 /nfs/dbraw/zinc/29/36/82/171293682.db2.gz JFYMBFIJGJUXIH-CABCVRRESA-N 1 0 287.834 5.369 10 0 CKAERO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccccc2Cl)cc1C ZINC000021043156 171293938 /nfs/dbraw/zinc/29/39/38/171293938.db2.gz JFYMBFIJGJUXIH-GJZGRUSLSA-N 1 0 287.834 5.369 10 0 CKAERO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccccc2Cl)cc1C ZINC000021043162 171293659 /nfs/dbraw/zinc/29/36/59/171293659.db2.gz JFYMBFIJGJUXIH-HUUCEWRRSA-N 1 0 287.834 5.369 10 0 CKAERO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccccc2Cl)cc1C ZINC000021043168 171293780 /nfs/dbraw/zinc/29/37/80/171293780.db2.gz JFYMBFIJGJUXIH-LSDHHAIUSA-N 1 0 287.834 5.369 10 0 CKAERO CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1[NH2+][C@@H]1CCCc2ccccc21 ZINC000021043208 171293899 /nfs/dbraw/zinc/29/38/99/171293899.db2.gz PIAAOQIQOUSSBM-VUBSUSDNSA-N 1 0 285.475 5.114 10 0 CKAERO CC(C)[C@@H]1CC[C@H](C)C[C@@H]1[NH2+][C@@H]1CCCc2ccccc21 ZINC000021043214 171293917 /nfs/dbraw/zinc/29/39/17/171293917.db2.gz PIAAOQIQOUSSBM-UUXHPUJUSA-N 1 0 285.475 5.114 10 0 CKAERO CC(C)[C@H]1CC[C@@H](C)C[C@@H]1[NH2+][C@@H]1CCCc2ccccc21 ZINC000021043219 171293940 /nfs/dbraw/zinc/29/39/40/171293940.db2.gz PIAAOQIQOUSSBM-QOJCHSLYSA-N 1 0 285.475 5.114 10 0 CKAERO CC(C)[C@H]1CC[C@H](C)C[C@@H]1[NH2+][C@@H]1CCCc2ccccc21 ZINC000021043224 171293847 /nfs/dbraw/zinc/29/38/47/171293847.db2.gz PIAAOQIQOUSSBM-ZSXHRAQDSA-N 1 0 285.475 5.114 10 0 CKAERO c1ccc(C([NH2+]C2CCCCCC2)c2ccccc2)cc1 ZINC000021044209 171293982 /nfs/dbraw/zinc/29/39/82/171293982.db2.gz RUOUKCUKCKUUCF-UHFFFAOYSA-N 1 0 279.427 5.088 10 0 CKAERO C[C@@H]1CCC[C@@H]([NH2+]C2CCC(c3ccccc3)CC2)[C@@H]1C ZINC000021044275 171294176 /nfs/dbraw/zinc/29/41/76/171294176.db2.gz DYQDRZYZFBZESD-QDLKPRKASA-N 1 0 285.475 5.127 10 0 CKAERO C[C@H]1[C@H]([NH2+]C2CCC(c3ccccc3)CC2)CCC[C@@H]1C ZINC000021044280 171294167 /nfs/dbraw/zinc/29/41/67/171294167.db2.gz DYQDRZYZFBZESD-XJQHKJILSA-N 1 0 285.475 5.127 10 0 CKAERO C[C@@H]1CCC[C@H]([NH2+]C2CCC(c3ccccc3)CC2)[C@@H]1C ZINC000021044284 171294182 /nfs/dbraw/zinc/29/41/82/171294182.db2.gz DYQDRZYZFBZESD-XVFGAMNESA-N 1 0 285.475 5.127 10 0 CKAERO C[C@@H]1[C@@H](C)CCC[C@@H]1[NH2+]C1CCC(c2ccccc2)CC1 ZINC000021044290 171294197 /nfs/dbraw/zinc/29/41/97/171294197.db2.gz DYQDRZYZFBZESD-XKKVZHMUSA-N 1 0 285.475 5.127 10 0 CKAERO CCC(CC)C[NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000021044808 171294194 /nfs/dbraw/zinc/29/41/94/171294194.db2.gz VMVLXYDZHSTVSZ-JTQLQIEISA-N 1 0 274.235 5.080 10 0 CKAERO CCC(CC)C[NH2+][C@H](C)c1ccc(Cl)c(Cl)c1 ZINC000021044814 171294086 /nfs/dbraw/zinc/29/40/86/171294086.db2.gz VMVLXYDZHSTVSZ-SNVBAGLBSA-N 1 0 274.235 5.080 10 0 CKAERO CCCC[C@@H](CC)C[NH2+]C1CCC(CCC)CC1 ZINC000021045317 171294139 /nfs/dbraw/zinc/29/41/39/171294139.db2.gz JNNRGGXEKCGAJY-KLAILNCOSA-N 1 0 253.474 5.151 10 0 CKAERO CCCC[C@H](CC)C[NH2+]C1CCC(CCC)CC1 ZINC000021045323 171294267 /nfs/dbraw/zinc/29/42/67/171294267.db2.gz JNNRGGXEKCGAJY-GTPINHCMSA-N 1 0 253.474 5.151 10 0 CKAERO CC(C)CCC[C@@H](C)[NH2+][C@@H]1C[C@@H](C)CC[C@@H]1C(C)C ZINC000021045459 171294088 /nfs/dbraw/zinc/29/40/88/171294088.db2.gz FHMBFYGVGBMPLH-BSDSXHPESA-N 1 0 267.501 5.252 10 0 CKAERO CC(C)CCC[C@H](C)[NH2+][C@@H]1C[C@@H](C)CC[C@@H]1C(C)C ZINC000021045464 171294071 /nfs/dbraw/zinc/29/40/71/171294071.db2.gz FHMBFYGVGBMPLH-WNRNVDISSA-N 1 0 267.501 5.252 10 0 CKAERO CC(C)CCC[C@@H](C)[NH2+][C@H]1C[C@@H](C)CC[C@@H]1C(C)C ZINC000021045469 171294247 /nfs/dbraw/zinc/29/42/47/171294247.db2.gz FHMBFYGVGBMPLH-MLHJIOFPSA-N 1 0 267.501 5.252 10 0 CKAERO CC(C)CCC[C@H](C)[NH2+][C@H]1C[C@@H](C)CC[C@@H]1C(C)C ZINC000021045475 171294170 /nfs/dbraw/zinc/29/41/70/171294170.db2.gz FHMBFYGVGBMPLH-FJIDUMEYSA-N 1 0 267.501 5.252 10 0 CKAERO CC(C)COCCC[NH2+]C1CCCCCCCCCCC1 ZINC000021047391 171294647 /nfs/dbraw/zinc/29/46/47/171294647.db2.gz PFDDGKUTQTVJCQ-UHFFFAOYSA-N 1 0 297.527 5.312 10 0 CKAERO CCCC[C@@H](CC)C[NH2+][C@@H]1C[C@@H](C)CC(C)(C)C1 ZINC000021049407 171294858 /nfs/dbraw/zinc/29/48/58/171294858.db2.gz KAWFNSSNMKVKDP-BZUAXINKSA-N 1 0 253.474 5.007 10 0 CKAERO CCCC[C@H](CC)C[NH2+][C@@H]1C[C@@H](C)CC(C)(C)C1 ZINC000021049411 171294983 /nfs/dbraw/zinc/29/49/83/171294983.db2.gz KAWFNSSNMKVKDP-OWCLPIDISA-N 1 0 253.474 5.007 10 0 CKAERO CCCC[C@@H](CC)C[NH2+][C@H]1C[C@@H](C)CC(C)(C)C1 ZINC000021049416 171294786 /nfs/dbraw/zinc/29/47/86/171294786.db2.gz KAWFNSSNMKVKDP-OAGGEKHMSA-N 1 0 253.474 5.007 10 0 CKAERO CCCC[C@H](CC)C[NH2+][C@H]1C[C@@H](C)CC(C)(C)C1 ZINC000021049422 171294787 /nfs/dbraw/zinc/29/47/87/171294787.db2.gz KAWFNSSNMKVKDP-PMPSAXMXSA-N 1 0 253.474 5.007 10 0 CKAERO CCCc1ccc([C@H](C)[NH2+][C@@H](C)c2cccc(F)c2)cc1 ZINC000021052497 171295242 /nfs/dbraw/zinc/29/52/42/171295242.db2.gz NSMXOUXEIYIOKY-GJZGRUSLSA-N 1 0 285.406 5.190 10 0 CKAERO CCCc1ccc([C@@H](C)[NH2+][C@H](C)c2cccc(F)c2)cc1 ZINC000021052505 171295065 /nfs/dbraw/zinc/29/50/65/171295065.db2.gz NSMXOUXEIYIOKY-HUUCEWRRSA-N 1 0 285.406 5.190 10 0 CKAERO CCCCCC[NH2+][C@@H](C)c1cccc2ccccc21 ZINC000021054599 171295633 /nfs/dbraw/zinc/29/56/33/171295633.db2.gz TUDXZQRHAVKYNY-HNNXBMFYSA-N 1 0 255.405 5.071 10 0 CKAERO CCCCCC[NH2+][C@H](C)c1cccc2ccccc21 ZINC000021054604 171295419 /nfs/dbraw/zinc/29/54/19/171295419.db2.gz TUDXZQRHAVKYNY-OAHLLOKOSA-N 1 0 255.405 5.071 10 0 CKAERO CC[C@@H]([NH2+][C@@H](C)CCCC(C)C)c1ccc(F)cc1 ZINC000021054634 171295399 /nfs/dbraw/zinc/29/53/99/171295399.db2.gz GERPDPWTVNKLJL-WMLDXEAASA-N 1 0 265.416 5.081 10 0 CKAERO CC[C@H]([NH2+][C@@H](C)CCCC(C)C)c1ccc(F)cc1 ZINC000021054640 171295562 /nfs/dbraw/zinc/29/55/62/171295562.db2.gz GERPDPWTVNKLJL-YOEHRIQHSA-N 1 0 265.416 5.081 10 0 CKAERO CC[C@@H]([NH2+][C@H](C)CCCC(C)C)c1ccc(F)cc1 ZINC000021054645 171295638 /nfs/dbraw/zinc/29/56/38/171295638.db2.gz GERPDPWTVNKLJL-RHSMWYFYSA-N 1 0 265.416 5.081 10 0 CKAERO CC[C@H]([NH2+][C@H](C)CCCC(C)C)c1ccc(F)cc1 ZINC000021054650 171295523 /nfs/dbraw/zinc/29/55/23/171295523.db2.gz GERPDPWTVNKLJL-PBHICJAKSA-N 1 0 265.416 5.081 10 0 CKAERO C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1Cl)c1ccccc1 ZINC000021055138 171295622 /nfs/dbraw/zinc/29/56/22/171295622.db2.gz AVIKFNMUFZWJQZ-NEPJUHHUSA-N 1 0 294.225 5.405 10 0 CKAERO C[C@H]([NH2+][C@@H](C)c1ccc(Cl)cc1Cl)c1ccccc1 ZINC000021055143 171295345 /nfs/dbraw/zinc/29/53/45/171295345.db2.gz AVIKFNMUFZWJQZ-RYUDHWBXSA-N 1 0 294.225 5.405 10 0 CKAERO C[C@@H]([NH2+][C@H](C)c1ccc(Cl)cc1Cl)c1ccccc1 ZINC000021055147 171295370 /nfs/dbraw/zinc/29/53/70/171295370.db2.gz AVIKFNMUFZWJQZ-VXGBXAGGSA-N 1 0 294.225 5.405 10 0 CKAERO C[C@@H]([NH2+][C@@H](C)c1ccccc1)c1ccc(Cl)cc1Cl ZINC000021055151 171295670 /nfs/dbraw/zinc/29/56/70/171295670.db2.gz AVIKFNMUFZWJQZ-NWDGAFQWSA-N 1 0 294.225 5.405 10 0 CKAERO CCCC1CCC([NH2+][C@@H](C)c2ccccc2C)CC1 ZINC000021055625 171295403 /nfs/dbraw/zinc/29/54/03/171295403.db2.gz UMMGEZUISOKHRE-GTPINHCMSA-N 1 0 259.437 5.005 10 0 CKAERO CCCC1CCC([NH2+][C@H](C)c2ccccc2C)CC1 ZINC000021055629 171295522 /nfs/dbraw/zinc/29/55/22/171295522.db2.gz UMMGEZUISOKHRE-KLAILNCOSA-N 1 0 259.437 5.005 10 0 CKAERO CCC(CC)C[NH2+][C@@H](C)c1ccc(Cl)cc1Cl ZINC000021056649 171295959 /nfs/dbraw/zinc/29/59/59/171295959.db2.gz AWEXLPSZKWNQEM-JTQLQIEISA-N 1 0 274.235 5.080 10 0 CKAERO CCC(CC)C[NH2+][C@H](C)c1ccc(Cl)cc1Cl ZINC000021056654 171296123 /nfs/dbraw/zinc/29/61/23/171296123.db2.gz AWEXLPSZKWNQEM-SNVBAGLBSA-N 1 0 274.235 5.080 10 0 CKAERO CCC(CC)[NH2+]C1CCCCCCCCCCC1 ZINC000021057309 171295916 /nfs/dbraw/zinc/29/59/16/171295916.db2.gz PGSQQHDKSSSBSQ-UHFFFAOYSA-N 1 0 253.474 5.438 10 0 CKAERO Cc1cc(C)c([C@H](C)[NH2+][C@H](C)c2ccccc2)c(C)c1 ZINC000021057549 171295952 /nfs/dbraw/zinc/29/59/52/171295952.db2.gz NMMJNAHZNSEFFF-SJORKVTESA-N 1 0 267.416 5.024 10 0 CKAERO Cc1cc(C)c([C@H](C)[NH2+][C@@H](C)c2ccccc2)c(C)c1 ZINC000021057553 171295985 /nfs/dbraw/zinc/29/59/85/171295985.db2.gz NMMJNAHZNSEFFF-IRXDYDNUSA-N 1 0 267.416 5.024 10 0 CKAERO Cc1cc(C)c([C@@H](C)[NH2+][C@H](C)c2ccccc2)c(C)c1 ZINC000021057556 171295878 /nfs/dbraw/zinc/29/58/78/171295878.db2.gz NMMJNAHZNSEFFF-IAGOWNOFSA-N 1 0 267.416 5.024 10 0 CKAERO Cc1cc(C)c([C@@H](C)[NH2+][C@@H](C)c2ccccc2)c(C)c1 ZINC000021057560 171295870 /nfs/dbraw/zinc/29/58/70/171295870.db2.gz NMMJNAHZNSEFFF-DLBZAZTESA-N 1 0 267.416 5.024 10 0 CKAERO CCC(C)(C)C1CCC([NH2+]C[C@@H](C)c2ccccc2)CC1 ZINC000021057943 171296476 /nfs/dbraw/zinc/29/64/76/171296476.db2.gz LEMDDVVFOFDOKP-IPJUCJBFSA-N 1 0 287.491 5.375 10 0 CKAERO CCC(C)(C)C1CCC([NH2+]C[C@H](C)c2ccccc2)CC1 ZINC000021057947 171296407 /nfs/dbraw/zinc/29/64/07/171296407.db2.gz LEMDDVVFOFDOKP-IVMQYODDSA-N 1 0 287.491 5.375 10 0 CKAERO CCCC[C@@H](CC)C[NH2+][C@@H]1CCSc2ccccc21 ZINC000021058054 171296504 /nfs/dbraw/zinc/29/65/04/171296504.db2.gz UIWWJUZRENFEMN-GDBMZVCRSA-N 1 0 277.477 5.030 10 0 CKAERO CCCC[C@H](CC)C[NH2+][C@@H]1CCSc2ccccc21 ZINC000021058058 171296525 /nfs/dbraw/zinc/29/65/25/171296525.db2.gz UIWWJUZRENFEMN-GOEBONIOSA-N 1 0 277.477 5.030 10 0 CKAERO CCCC[C@@H](CC)C[NH2+][C@H]1CCSc2ccccc21 ZINC000021058062 171296322 /nfs/dbraw/zinc/29/63/22/171296322.db2.gz UIWWJUZRENFEMN-ZBFHGGJFSA-N 1 0 277.477 5.030 10 0 CKAERO CCCC[C@H](CC)C[NH2+][C@H]1CCSc2ccccc21 ZINC000021058066 171296286 /nfs/dbraw/zinc/29/62/86/171296286.db2.gz UIWWJUZRENFEMN-HOCLYGCPSA-N 1 0 277.477 5.030 10 0 CKAERO Cc1cccc(C[NH2+][C@H](C)c2ccc(Cl)cc2Cl)c1 ZINC000021059036 171296532 /nfs/dbraw/zinc/29/65/32/171296532.db2.gz HPTPEBVPFLAKIX-GFCCVEGCSA-N 1 0 294.225 5.153 10 0 CKAERO Cc1cccc(C[NH2+][C@@H](C)c2ccc(Cl)cc2Cl)c1 ZINC000021059040 171296434 /nfs/dbraw/zinc/29/64/34/171296434.db2.gz HPTPEBVPFLAKIX-LBPRGKRZSA-N 1 0 294.225 5.153 10 0 CKAERO CCc1ccc([C@@H](C)[NH2+][C@@H](C)c2cccc(Cl)c2)cc1 ZINC000021060871 171297382 /nfs/dbraw/zinc/29/73/82/171297382.db2.gz URUUEKMWIZDSCF-KGLIPLIRSA-N 1 0 287.834 5.314 10 0 CKAERO CCc1ccc([C@H](C)[NH2+][C@@H](C)c2cccc(Cl)c2)cc1 ZINC000021060874 171297067 /nfs/dbraw/zinc/29/70/67/171297067.db2.gz URUUEKMWIZDSCF-KBPBESRZSA-N 1 0 287.834 5.314 10 0 CKAERO CCc1ccc([C@@H](C)[NH2+][C@H](C)c2cccc(Cl)c2)cc1 ZINC000021060878 171297187 /nfs/dbraw/zinc/29/71/87/171297187.db2.gz URUUEKMWIZDSCF-ZIAGYGMSSA-N 1 0 287.834 5.314 10 0 CKAERO CC[C@@H]([NH2+][C@@H](C)c1cccc(Cl)c1)c1ccc(C)cc1 ZINC000021061457 171297059 /nfs/dbraw/zinc/29/70/59/171297059.db2.gz ZFKBDLUWTFLJOH-KBXCAEBGSA-N 1 0 287.834 5.450 10 0 CKAERO CC[C@H]([NH2+][C@@H](C)c1cccc(Cl)c1)c1ccc(C)cc1 ZINC000021061460 171297158 /nfs/dbraw/zinc/29/71/58/171297158.db2.gz ZFKBDLUWTFLJOH-KSSFIOAISA-N 1 0 287.834 5.450 10 0 CKAERO CC[C@@H]([NH2+][C@H](C)c1cccc(Cl)c1)c1ccc(C)cc1 ZINC000021061464 171297242 /nfs/dbraw/zinc/29/72/42/171297242.db2.gz ZFKBDLUWTFLJOH-RDTXWAMCSA-N 1 0 287.834 5.450 10 0 CKAERO CC[C@H]([NH2+][C@H](C)c1cccc(Cl)c1)c1ccc(C)cc1 ZINC000021061468 171297136 /nfs/dbraw/zinc/29/71/36/171297136.db2.gz ZFKBDLUWTFLJOH-KDOFPFPSSA-N 1 0 287.834 5.450 10 0 CKAERO C[C@@H]([NH2+]C1CCCCCCC1)c1ccc(C(C)(C)C)cc1 ZINC000021062474 171297523 /nfs/dbraw/zinc/29/75/23/171297523.db2.gz LWQOZKDQBPCIJR-MRXNPFEDSA-N 1 0 287.491 5.748 10 0 CKAERO C[C@H]([NH2+]C1CCCCCCC1)c1ccc(C(C)(C)C)cc1 ZINC000021062478 171297471 /nfs/dbraw/zinc/29/74/71/171297471.db2.gz LWQOZKDQBPCIJR-INIZCTEOSA-N 1 0 287.491 5.748 10 0 CKAERO CCCCC[NH2+][C@@H](C)c1ccc(-c2ccccc2)cc1 ZINC000021499943 171304361 /nfs/dbraw/zinc/30/43/61/171304361.db2.gz XJXQLRLJOAUHHU-INIZCTEOSA-N 1 0 267.416 5.194 10 0 CKAERO CCCCC[NH2+][C@H](C)c1ccc(-c2ccccc2)cc1 ZINC000021499945 171304471 /nfs/dbraw/zinc/30/44/71/171304471.db2.gz XJXQLRLJOAUHHU-MRXNPFEDSA-N 1 0 267.416 5.194 10 0 CKAERO CC(C)c1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(F)cc2)cc1 ZINC000021499994 171304667 /nfs/dbraw/zinc/30/46/67/171304667.db2.gz QQFHRUYLQPRJMY-CABCVRRESA-N 1 0 285.406 5.361 10 0 CKAERO CC(C)c1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(F)cc2)cc1 ZINC000021499995 171304576 /nfs/dbraw/zinc/30/45/76/171304576.db2.gz QQFHRUYLQPRJMY-GJZGRUSLSA-N 1 0 285.406 5.361 10 0 CKAERO CC(C)c1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(F)cc2)cc1 ZINC000021499997 171304391 /nfs/dbraw/zinc/30/43/91/171304391.db2.gz QQFHRUYLQPRJMY-HUUCEWRRSA-N 1 0 285.406 5.361 10 0 CKAERO CC(C)c1ccc([C@H](C)[NH2+][C@H](C)c2ccc(F)cc2)cc1 ZINC000021499998 171304662 /nfs/dbraw/zinc/30/46/62/171304662.db2.gz QQFHRUYLQPRJMY-LSDHHAIUSA-N 1 0 285.406 5.361 10 0 CKAERO CC(C)CC[C@@H](C)[NH2+]Cc1ccc(-c2ccccc2)cc1 ZINC000021500020 171304574 /nfs/dbraw/zinc/30/45/74/171304574.db2.gz XOXPFNCZGKMANM-QGZVFWFLSA-N 1 0 281.443 5.268 10 0 CKAERO CC(C)CC[C@H](C)[NH2+]Cc1ccc(-c2ccccc2)cc1 ZINC000021500021 171305042 /nfs/dbraw/zinc/30/50/42/171305042.db2.gz XOXPFNCZGKMANM-KRWDZBQOSA-N 1 0 281.443 5.268 10 0 CKAERO Cc1cc(C)c(C[NH2+][C@H](C)c2ccc(Cl)cc2)c(C)c1 ZINC000021500099 171305176 /nfs/dbraw/zinc/30/51/76/171305176.db2.gz YNFLNWWJJASDNX-OAHLLOKOSA-N 1 0 287.834 5.116 10 0 CKAERO Cc1cc(C)c(C[NH2+][C@@H](C)c2ccc(Cl)cc2)c(C)c1 ZINC000021500101 171305012 /nfs/dbraw/zinc/30/50/12/171305012.db2.gz YNFLNWWJJASDNX-HNNXBMFYSA-N 1 0 287.834 5.116 10 0 CKAERO CC(C)CCC[C@@H](C)[NH2+]Cc1ccc2ccccc2c1 ZINC000021500188 171304911 /nfs/dbraw/zinc/30/49/11/171304911.db2.gz LHUPFSYDCBWGOR-MRXNPFEDSA-N 1 0 269.432 5.144 10 0 CKAERO CC(C)CCC[C@H](C)[NH2+]Cc1ccc2ccccc2c1 ZINC000021500190 171304976 /nfs/dbraw/zinc/30/49/76/171304976.db2.gz LHUPFSYDCBWGOR-INIZCTEOSA-N 1 0 269.432 5.144 10 0 CKAERO C[C@@H]([NH2+]Cc1cccc2ccccc21)c1ccccc1Cl ZINC000021500573 171304760 /nfs/dbraw/zinc/30/47/60/171304760.db2.gz FRCUGHHSTHDULS-CQSZACIVSA-N 1 0 295.813 5.344 10 0 CKAERO C[C@H]([NH2+]Cc1cccc2ccccc21)c1ccccc1Cl ZINC000021500575 171305093 /nfs/dbraw/zinc/30/50/93/171305093.db2.gz FRCUGHHSTHDULS-AWEZNQCLSA-N 1 0 295.813 5.344 10 0 CKAERO C[C@@H]([NH2+][C@H](c1ccccc1)C1CCCCC1)c1cccs1 ZINC000021500618 171304758 /nfs/dbraw/zinc/30/47/58/171304758.db2.gz JXYVOYXVJRVECM-DNVCBOLYSA-N 1 0 299.483 5.720 10 0 CKAERO C[C@H]([NH2+][C@H](c1ccccc1)C1CCCCC1)c1cccs1 ZINC000021500620 171304978 /nfs/dbraw/zinc/30/49/78/171304978.db2.gz JXYVOYXVJRVECM-HNAYVOBHSA-N 1 0 299.483 5.720 10 0 CKAERO C[C@@H]([NH2+][C@@H](c1ccccc1)C1CCCCC1)c1cccs1 ZINC000021500621 171304878 /nfs/dbraw/zinc/30/48/78/171304878.db2.gz JXYVOYXVJRVECM-BEFAXECRSA-N 1 0 299.483 5.720 10 0 CKAERO C[C@H]([NH2+][C@@H](c1ccccc1)C1CCCCC1)c1cccs1 ZINC000021500623 171304844 /nfs/dbraw/zinc/30/48/44/171304844.db2.gz JXYVOYXVJRVECM-KXBFYZLASA-N 1 0 299.483 5.720 10 0 CKAERO Cc1ccccc1[C@H](C)[NH2+][C@H](C)c1ccc(F)c(Cl)c1 ZINC000021501431 171305556 /nfs/dbraw/zinc/30/55/56/171305556.db2.gz CLSWTCVQAGXSGJ-OLZOCXBDSA-N 1 0 291.797 5.199 10 0 CKAERO Cc1ccccc1[C@H](C)[NH2+][C@@H](C)c1ccc(F)c(Cl)c1 ZINC000021501433 171305601 /nfs/dbraw/zinc/30/56/01/171305601.db2.gz CLSWTCVQAGXSGJ-STQMWFEESA-N 1 0 291.797 5.199 10 0 CKAERO Cc1ccccc1[C@@H](C)[NH2+][C@H](C)c1ccc(F)c(Cl)c1 ZINC000021501434 171305363 /nfs/dbraw/zinc/30/53/63/171305363.db2.gz CLSWTCVQAGXSGJ-CHWSQXEVSA-N 1 0 291.797 5.199 10 0 CKAERO Cc1ccccc1[C@@H](C)[NH2+][C@@H](C)c1ccc(F)c(Cl)c1 ZINC000021501436 171305504 /nfs/dbraw/zinc/30/55/04/171305504.db2.gz CLSWTCVQAGXSGJ-QWHCGFSZSA-N 1 0 291.797 5.199 10 0 CKAERO CCCC[C@@H](CC)C[NH2+]Cc1ccccc1C(F)(F)F ZINC000021501749 171306036 /nfs/dbraw/zinc/30/60/36/171306036.db2.gz ANBOGUMLSIZXGX-CYBMUJFWSA-N 1 0 287.369 5.011 10 0 CKAERO CCCC[C@H](CC)C[NH2+]Cc1ccccc1C(F)(F)F ZINC000021501750 171305684 /nfs/dbraw/zinc/30/56/84/171305684.db2.gz ANBOGUMLSIZXGX-ZDUSSCGKSA-N 1 0 287.369 5.011 10 0 CKAERO CC1CCC([NH2+]Cc2ccc(-c3ccccc3)cc2)CC1 ZINC000021502466 171306380 /nfs/dbraw/zinc/30/63/80/171306380.db2.gz WXHQKYQBFDTLLT-UHFFFAOYSA-N 1 0 279.427 5.022 10 0 CKAERO CCCCCC[NH2+][C@@H](C)c1ccc(-c2ccccc2)cc1 ZINC000021503142 171306450 /nfs/dbraw/zinc/30/64/50/171306450.db2.gz BFGVXZZTVNHAHM-KRWDZBQOSA-N 1 0 281.443 5.585 10 0 CKAERO Cc1ccccc1[C@H](C)[NH2+][C@H]1C[C@H](C)CC[C@@H]1C(C)C ZINC000021504209 171306993 /nfs/dbraw/zinc/30/69/93/171306993.db2.gz KWPYEKDGMMUGKN-XZKMEQPCSA-N 1 0 273.464 5.106 10 0 CKAERO Cc1ccccc1[C@H](C)[NH2+][C@H]1C[C@@H](C)CC[C@@H]1C(C)C ZINC000021504211 171307106 /nfs/dbraw/zinc/30/71/06/171307106.db2.gz KWPYEKDGMMUGKN-RMRDIRSESA-N 1 0 273.464 5.106 10 0 CKAERO CC[C@@H]([NH2+]C1CCCCCCC1)c1cccc(Cl)c1 ZINC000021504473 171307212 /nfs/dbraw/zinc/30/72/12/171307212.db2.gz BCTDJOXLKMKRKO-QGZVFWFLSA-N 1 0 279.855 5.494 10 0 CKAERO CC[C@H]([NH2+]C1CCCCCCC1)c1cccc(Cl)c1 ZINC000021504474 171307309 /nfs/dbraw/zinc/30/73/09/171307309.db2.gz BCTDJOXLKMKRKO-KRWDZBQOSA-N 1 0 279.855 5.494 10 0 CKAERO C[C@@H]([NH2+]CC1CCCCC1)c1cccc2ccccc21 ZINC000021505293 171307698 /nfs/dbraw/zinc/30/76/98/171307698.db2.gz KRAHQHZDASTDDK-OAHLLOKOSA-N 1 0 267.416 5.071 10 0 CKAERO C[C@H]([NH2+]CC1CCCCC1)c1cccc2ccccc21 ZINC000021505294 171307516 /nfs/dbraw/zinc/30/75/16/171307516.db2.gz KRAHQHZDASTDDK-HNNXBMFYSA-N 1 0 267.416 5.071 10 0 CKAERO CC[C@@H]([NH2+][C@@H](C)c1ccccc1C)c1ccc(C)cc1 ZINC000021505392 171307660 /nfs/dbraw/zinc/30/76/60/171307660.db2.gz ZPMWLEIFZYHTJZ-QFBILLFUSA-N 1 0 267.416 5.105 10 0 CKAERO CC[C@H]([NH2+][C@@H](C)c1ccccc1C)c1ccc(C)cc1 ZINC000021505393 171307636 /nfs/dbraw/zinc/30/76/36/171307636.db2.gz ZPMWLEIFZYHTJZ-LPHOPBHVSA-N 1 0 267.416 5.105 10 0 CKAERO CC[C@@H]([NH2+][C@H](C)c1ccccc1C)c1ccc(C)cc1 ZINC000021505395 171307491 /nfs/dbraw/zinc/30/74/91/171307491.db2.gz ZPMWLEIFZYHTJZ-VQIMIIECSA-N 1 0 267.416 5.105 10 0 CKAERO CC[C@H]([NH2+][C@H](C)c1ccccc1C)c1ccc(C)cc1 ZINC000021505396 171307591 /nfs/dbraw/zinc/30/75/91/171307591.db2.gz ZPMWLEIFZYHTJZ-APWZRJJASA-N 1 0 267.416 5.105 10 0 CKAERO C[C@@H]([NH2+]C1CCCCCCC1)c1ccc(OC(F)F)cc1 ZINC000021505499 171307775 /nfs/dbraw/zinc/30/77/75/171307775.db2.gz PFXBBJCBVUAEHE-CYBMUJFWSA-N 1 0 297.389 5.052 10 0 CKAERO C[C@H]([NH2+]C1CCCCCCC1)c1ccc(OC(F)F)cc1 ZINC000021505501 171307767 /nfs/dbraw/zinc/30/77/67/171307767.db2.gz PFXBBJCBVUAEHE-ZDUSSCGKSA-N 1 0 297.389 5.052 10 0 CKAERO CC[C@@H]([NH2+][C@@H](C)c1ccccc1C)c1ccc(Cl)cc1 ZINC000021506431 171308111 /nfs/dbraw/zinc/30/81/11/171308111.db2.gz UVRJVGARUMVJOK-KBXCAEBGSA-N 1 0 287.834 5.450 10 0 CKAERO CC[C@H]([NH2+][C@@H](C)c1ccccc1C)c1ccc(Cl)cc1 ZINC000021506432 171308078 /nfs/dbraw/zinc/30/80/78/171308078.db2.gz UVRJVGARUMVJOK-KSSFIOAISA-N 1 0 287.834 5.450 10 0 CKAERO CC[C@@H]([NH2+][C@H](C)c1ccccc1C)c1ccc(Cl)cc1 ZINC000021506434 171308047 /nfs/dbraw/zinc/30/80/47/171308047.db2.gz UVRJVGARUMVJOK-RDTXWAMCSA-N 1 0 287.834 5.450 10 0 CKAERO CC[C@H]([NH2+][C@H](C)c1ccccc1C)c1ccc(Cl)cc1 ZINC000021506436 171308085 /nfs/dbraw/zinc/30/80/85/171308085.db2.gz UVRJVGARUMVJOK-KDOFPFPSSA-N 1 0 287.834 5.450 10 0 CKAERO C1CCC([NH2+]C2CCCCCCCCCCC2)C1 ZINC000021506593 171307932 /nfs/dbraw/zinc/30/79/32/171307932.db2.gz ICYFCVMBTSWYAZ-UHFFFAOYSA-N 1 0 251.458 5.192 10 0 CKAERO Cc1cc(Oc2ccc(F)cc2[C@@H](C)[NH3+])ccc1C(C)C ZINC000021507191 171308371 /nfs/dbraw/zinc/30/83/71/171308371.db2.gz YOMCEPULTPRYLF-CYBMUJFWSA-N 1 0 287.378 5.070 10 0 CKAERO Cc1cc(Oc2ccc(F)cc2[C@H](C)[NH3+])ccc1C(C)C ZINC000021507192 171308364 /nfs/dbraw/zinc/30/83/64/171308364.db2.gz YOMCEPULTPRYLF-ZDUSSCGKSA-N 1 0 287.378 5.070 10 0 CKAERO C[C@H]([NH2+]C1CCCCCCC1)c1ccccc1Cl ZINC000021507581 184536080 /nfs/dbraw/zinc/53/60/80/184536080.db2.gz PEGAQYCPACWZFA-ZDUSSCGKSA-N 1 0 265.828 5.104 10 0 CKAERO C[C@@H]1CCC[C@@H]([NH2+]C2CCC(C(C)(C)C)CC2)[C@@H]1C ZINC000021508298 171308972 /nfs/dbraw/zinc/30/89/72/171308972.db2.gz HXPBULMDJVTUHR-AXRJEEMOSA-N 1 0 265.485 5.006 10 0 CKAERO C[C@H]1[C@H]([NH2+]C2CCC(C(C)(C)C)CC2)CCC[C@@H]1C ZINC000021508300 171308950 /nfs/dbraw/zinc/30/89/50/171308950.db2.gz HXPBULMDJVTUHR-WHHARQNVSA-N 1 0 265.485 5.006 10 0 CKAERO C[C@@H]1CCC[C@H]([NH2+]C2CCC(C(C)(C)C)CC2)[C@@H]1C ZINC000021508302 171308954 /nfs/dbraw/zinc/30/89/54/171308954.db2.gz HXPBULMDJVTUHR-AKNDPVLGSA-N 1 0 265.485 5.006 10 0 CKAERO C[C@@H]1[C@@H](C)CCC[C@@H]1[NH2+]C1CCC(C(C)(C)C)CC1 ZINC000021508303 171308773 /nfs/dbraw/zinc/30/87/73/171308773.db2.gz HXPBULMDJVTUHR-RRLIJXGGSA-N 1 0 265.485 5.006 10 0 CKAERO CC(C)CCC[C@@H](C)[NH2+]Cc1ccc(C(C)C)cc1 ZINC000021508529 171308906 /nfs/dbraw/zinc/30/89/06/171308906.db2.gz BAMIBUCVQLTBMP-MRXNPFEDSA-N 1 0 261.453 5.114 10 0 CKAERO CC(C)CCC[C@H](C)[NH2+]Cc1ccc(C(C)C)cc1 ZINC000021508531 171308684 /nfs/dbraw/zinc/30/86/84/171308684.db2.gz BAMIBUCVQLTBMP-INIZCTEOSA-N 1 0 261.453 5.114 10 0 CKAERO CC(C)CCC[C@@H](C)[NH2+]Cc1c(Cl)cccc1Cl ZINC000021509399 171309060 /nfs/dbraw/zinc/30/90/60/171309060.db2.gz FHPKPJCPKDKAEL-GFCCVEGCSA-N 1 0 288.262 5.298 10 0 CKAERO CC(C)CCC[C@H](C)[NH2+]Cc1c(Cl)cccc1Cl ZINC000021509401 171309221 /nfs/dbraw/zinc/30/92/21/171309221.db2.gz FHPKPJCPKDKAEL-LBPRGKRZSA-N 1 0 288.262 5.298 10 0 CKAERO CC(C)c1ccc([C@@H](C)[NH2+]Cc2ccccc2Cl)cc1 ZINC000021509730 171309708 /nfs/dbraw/zinc/30/97/08/171309708.db2.gz WBOBBCPMYNKQQX-CQSZACIVSA-N 1 0 287.834 5.314 10 0 CKAERO CC(C)c1ccc([C@H](C)[NH2+]Cc2ccccc2Cl)cc1 ZINC000021509732 171309755 /nfs/dbraw/zinc/30/97/55/171309755.db2.gz WBOBBCPMYNKQQX-AWEZNQCLSA-N 1 0 287.834 5.314 10 0 CKAERO CC[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1)c1ccc(C)cc1 ZINC000021510555 171309932 /nfs/dbraw/zinc/30/99/32/171309932.db2.gz SLIORCXXBUOSIY-KBXCAEBGSA-N 1 0 287.834 5.450 10 0 CKAERO CC[C@H]([NH2+][C@@H](C)c1ccc(Cl)cc1)c1ccc(C)cc1 ZINC000021510556 171309987 /nfs/dbraw/zinc/30/99/87/171309987.db2.gz SLIORCXXBUOSIY-KSSFIOAISA-N 1 0 287.834 5.450 10 0 CKAERO CC[C@@H]([NH2+][C@H](C)c1ccc(Cl)cc1)c1ccc(C)cc1 ZINC000021510558 171309990 /nfs/dbraw/zinc/30/99/90/171309990.db2.gz SLIORCXXBUOSIY-RDTXWAMCSA-N 1 0 287.834 5.450 10 0 CKAERO CC[C@H]([NH2+][C@H](C)c1ccc(Cl)cc1)c1ccc(C)cc1 ZINC000021510559 171310180 /nfs/dbraw/zinc/31/01/80/171310180.db2.gz SLIORCXXBUOSIY-KDOFPFPSSA-N 1 0 287.834 5.450 10 0 CKAERO c1csc(C[NH2+]C2CCCCCCCCCCC2)c1 ZINC000021510594 171310133 /nfs/dbraw/zinc/31/01/33/171310133.db2.gz REOJSTFHOOKRSN-UHFFFAOYSA-N 1 0 279.493 5.511 10 0 CKAERO CC(C)CC[C@@H](C)[NH2+]C1CCC(C(C)(C)C)CC1 ZINC000021511512 171310524 /nfs/dbraw/zinc/31/05/24/171310524.db2.gz UFUJKZYDWSORCQ-QQFBHYJXSA-N 1 0 253.474 5.006 10 0 CKAERO CC(C)CC[C@H](C)[NH2+]C1CCC(C(C)(C)C)CC1 ZINC000021511513 171310383 /nfs/dbraw/zinc/31/03/83/171310383.db2.gz UFUJKZYDWSORCQ-FHERZECASA-N 1 0 253.474 5.006 10 0 CKAERO CCCc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccccc2)cc1 ZINC000021511824 171310595 /nfs/dbraw/zinc/31/05/95/171310595.db2.gz OFLXTUOPZPEPGD-JKSUJKDBSA-N 1 0 267.416 5.051 10 0 CKAERO CCCc1ccc([C@H](C)[NH2+][C@@H](C)c2ccccc2)cc1 ZINC000021511826 171310566 /nfs/dbraw/zinc/31/05/66/171310566.db2.gz OFLXTUOPZPEPGD-HOTGVXAUSA-N 1 0 267.416 5.051 10 0 CKAERO CCCc1ccc([C@@H](C)[NH2+][C@H](C)c2ccccc2)cc1 ZINC000021511828 171310447 /nfs/dbraw/zinc/31/04/47/171310447.db2.gz OFLXTUOPZPEPGD-HZPDHXFCSA-N 1 0 267.416 5.051 10 0 CKAERO CCCc1ccc([C@H](C)[NH2+][C@H](C)c2ccccc2)cc1 ZINC000021511830 171310476 /nfs/dbraw/zinc/31/04/76/171310476.db2.gz OFLXTUOPZPEPGD-CVEARBPZSA-N 1 0 267.416 5.051 10 0 CKAERO CCCC(CCC)[NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000021512275 171310868 /nfs/dbraw/zinc/31/08/68/171310868.db2.gz ZLCACCQGKZFVLR-NSHDSACASA-N 1 0 288.262 5.613 10 0 CKAERO CCCC(CCC)[NH2+][C@H](C)c1ccc(Cl)c(Cl)c1 ZINC000021512277 171310870 /nfs/dbraw/zinc/31/08/70/171310870.db2.gz ZLCACCQGKZFVLR-LLVKDONJSA-N 1 0 288.262 5.613 10 0 CKAERO Cc1ccc(C)c([C@@H]([NH2+]CCC(C)C)c2ccccc2)c1 ZINC000021512973 171311525 /nfs/dbraw/zinc/31/15/25/171311525.db2.gz BPXFQQWIHZAKNP-FQEVSTJZSA-N 1 0 281.443 5.029 10 0 CKAERO Cc1ccc(C)c([C@H]([NH2+]CCC(C)C)c2ccccc2)c1 ZINC000021512975 171311291 /nfs/dbraw/zinc/31/12/91/171311291.db2.gz BPXFQQWIHZAKNP-HXUWFJFHSA-N 1 0 281.443 5.029 10 0 CKAERO Cc1ccc([C@@H](C)[NH2+]C2CCCCCCC2)c(C)c1 ZINC000021513615 171311323 /nfs/dbraw/zinc/31/13/23/171311323.db2.gz RMHXCMCEBZPDLN-MRXNPFEDSA-N 1 0 259.437 5.067 10 0 CKAERO Cc1ccc([C@H](C)[NH2+]C2CCCCCCC2)c(C)c1 ZINC000021513617 171311509 /nfs/dbraw/zinc/31/15/09/171311509.db2.gz RMHXCMCEBZPDLN-INIZCTEOSA-N 1 0 259.437 5.067 10 0 CKAERO Cc1ccccc1[C@H](C)[NH2+][C@H](CC(C)C)c1ccccc1 ZINC000021513663 171311529 /nfs/dbraw/zinc/31/15/29/171311529.db2.gz SXKYRBKZVLTOAH-FXAWDEMLSA-N 1 0 281.443 5.433 10 0 CKAERO Cc1ccccc1[C@H](C)[NH2+][C@@H](CC(C)C)c1ccccc1 ZINC000021513664 171311215 /nfs/dbraw/zinc/31/12/15/171311215.db2.gz SXKYRBKZVLTOAH-PXNSSMCTSA-N 1 0 281.443 5.433 10 0 CKAERO Cc1ccccc1[C@@H](C)[NH2+][C@H](CC(C)C)c1ccccc1 ZINC000021513666 171311401 /nfs/dbraw/zinc/31/14/01/171311401.db2.gz SXKYRBKZVLTOAH-YLJYHZDGSA-N 1 0 281.443 5.433 10 0 CKAERO Cc1ccccc1[C@@H](C)[NH2+][C@@H](CC(C)C)c1ccccc1 ZINC000021513667 171311464 /nfs/dbraw/zinc/31/14/64/171311464.db2.gz SXKYRBKZVLTOAH-XLIONFOSSA-N 1 0 281.443 5.433 10 0 CKAERO CC(C)CCC[C@@H](C)[NH2+][C@@H](C)c1ccccc1Cl ZINC000021513669 171311459 /nfs/dbraw/zinc/31/14/59/171311459.db2.gz AXZASWGFNOFRPB-KGLIPLIRSA-N 1 0 267.844 5.205 10 0 CKAERO CC(C)CCC[C@H](C)[NH2+][C@@H](C)c1ccccc1Cl ZINC000021513670 171311474 /nfs/dbraw/zinc/31/14/74/171311474.db2.gz AXZASWGFNOFRPB-KBPBESRZSA-N 1 0 267.844 5.205 10 0 CKAERO CC(C)CCC[C@@H](C)[NH2+][C@H](C)c1ccccc1Cl ZINC000021513672 171311179 /nfs/dbraw/zinc/31/11/79/171311179.db2.gz AXZASWGFNOFRPB-ZIAGYGMSSA-N 1 0 267.844 5.205 10 0 CKAERO CC(C)CCC[C@H](C)[NH2+][C@H](C)c1ccccc1Cl ZINC000021513673 171311361 /nfs/dbraw/zinc/31/13/61/171311361.db2.gz AXZASWGFNOFRPB-UONOGXRCSA-N 1 0 267.844 5.205 10 0 CKAERO C[C@@H]([NH2+]Cc1ccccc1Cl)c1ccc2c(c1)CCCC2 ZINC000021513991 171311596 /nfs/dbraw/zinc/31/15/96/171311596.db2.gz VAWXJZJOLPKKGK-CQSZACIVSA-N 1 0 299.845 5.070 10 0 CKAERO C[C@H]([NH2+]Cc1ccccc1Cl)c1ccc2c(c1)CCCC2 ZINC000021513993 171311682 /nfs/dbraw/zinc/31/16/82/171311682.db2.gz VAWXJZJOLPKKGK-AWEZNQCLSA-N 1 0 299.845 5.070 10 0 CKAERO C[C@@H]([NH2+][C@@H]1CCCC[C@@H]1C(C)(C)C)c1cccc(Cl)c1 ZINC000021514818 171312013 /nfs/dbraw/zinc/31/20/13/171312013.db2.gz QHOKQNWHDKKFCL-XOKHGSTOSA-N 1 0 293.882 5.596 10 0 CKAERO C[C@H]([NH2+][C@@H]1CCCC[C@@H]1C(C)(C)C)c1cccc(Cl)c1 ZINC000021514820 171311934 /nfs/dbraw/zinc/31/19/34/171311934.db2.gz QHOKQNWHDKKFCL-RRQGHBQHSA-N 1 0 293.882 5.596 10 0 CKAERO C[C@@H]([NH2+][C@H]1CCCC[C@@H]1C(C)(C)C)c1cccc(Cl)c1 ZINC000021514822 171312053 /nfs/dbraw/zinc/31/20/53/171312053.db2.gz QHOKQNWHDKKFCL-COXVUDFISA-N 1 0 293.882 5.596 10 0 CKAERO C[C@H]([NH2+][C@H]1CCCC[C@@H]1C(C)(C)C)c1cccc(Cl)c1 ZINC000021514824 171311871 /nfs/dbraw/zinc/31/18/71/171311871.db2.gz QHOKQNWHDKKFCL-JQFCIGGWSA-N 1 0 293.882 5.596 10 0 CKAERO Cc1cc(C)c([C@@H](C)[NH2+]C2CCCCCCC2)c(C)c1 ZINC000021515187 171311854 /nfs/dbraw/zinc/31/18/54/171311854.db2.gz DZFLKMKZQCCEHB-QGZVFWFLSA-N 1 0 273.464 5.375 10 0 CKAERO Cc1cc(C)c([C@H](C)[NH2+]C2CCCCCCC2)c(C)c1 ZINC000021515189 171312030 /nfs/dbraw/zinc/31/20/30/171312030.db2.gz DZFLKMKZQCCEHB-KRWDZBQOSA-N 1 0 273.464 5.375 10 0 CKAERO C[C@@H]([NH2+][C@@H](C)c1cccc(Cl)c1)c1ccc(Cl)cc1 ZINC000021515675 171312234 /nfs/dbraw/zinc/31/22/34/171312234.db2.gz CSTYHNBSYFGVHV-NEPJUHHUSA-N 1 0 294.225 5.405 10 0 CKAERO C[C@H]([NH2+][C@@H](C)c1cccc(Cl)c1)c1ccc(Cl)cc1 ZINC000021515676 171312258 /nfs/dbraw/zinc/31/22/58/171312258.db2.gz CSTYHNBSYFGVHV-RYUDHWBXSA-N 1 0 294.225 5.405 10 0 CKAERO C[C@@H]([NH2+][C@H](C)c1cccc(Cl)c1)c1ccc(Cl)cc1 ZINC000021515678 171312458 /nfs/dbraw/zinc/31/24/58/171312458.db2.gz CSTYHNBSYFGVHV-VXGBXAGGSA-N 1 0 294.225 5.405 10 0 CKAERO C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1)c1cccc(Cl)c1 ZINC000021515680 171312400 /nfs/dbraw/zinc/31/24/00/171312400.db2.gz CSTYHNBSYFGVHV-NWDGAFQWSA-N 1 0 294.225 5.405 10 0 CKAERO CCCC1CCC([NH2+][C@@H](C)CCCC(C)C)CC1 ZINC000021515694 171312500 /nfs/dbraw/zinc/31/25/00/171312500.db2.gz VQFODSSKASWRBF-GTPINHCMSA-N 1 0 253.474 5.150 10 0 CKAERO CCCC1CCC([NH2+][C@H](C)CCCC(C)C)CC1 ZINC000021515695 171312617 /nfs/dbraw/zinc/31/26/17/171312617.db2.gz VQFODSSKASWRBF-KLAILNCOSA-N 1 0 253.474 5.150 10 0 CKAERO C[C@H]([NH2+]C1[C@H](C)CCC[C@@H]1C)C12CC3CC(CC(C3)C1)C2 ZINC000021515885 171312320 /nfs/dbraw/zinc/31/23/20/171312320.db2.gz ZLTFFLKQMWUTPM-MNSUZKEASA-N 1 0 289.507 5.006 10 0 CKAERO C[C@H]([NH2+]C1[C@@H](C)CCC[C@@H]1C)C12CC3CC(CC(C3)C1)C2 ZINC000021515887 171312297 /nfs/dbraw/zinc/31/22/97/171312297.db2.gz ZLTFFLKQMWUTPM-KDRFKOMVSA-N 1 0 289.507 5.006 10 0 CKAERO CCc1ccc([C@@H]([NH2+]Cc2ccccc2C)C(C)C)cc1 ZINC000021516291 171312919 /nfs/dbraw/zinc/31/29/19/171312919.db2.gz HFKRUXVZWZBYFP-FQEVSTJZSA-N 1 0 281.443 5.044 10 0 CKAERO CCc1ccc([C@H]([NH2+]Cc2ccccc2C)C(C)C)cc1 ZINC000021516292 171312788 /nfs/dbraw/zinc/31/27/88/171312788.db2.gz HFKRUXVZWZBYFP-HXUWFJFHSA-N 1 0 281.443 5.044 10 0 CKAERO C[C@@H]([NH2+]C1CCCCCC1)c1cccc2ccccc21 ZINC000021516296 171312977 /nfs/dbraw/zinc/31/29/77/171312977.db2.gz GCXZFWHGSGHXQF-OAHLLOKOSA-N 1 0 267.416 5.213 10 0 CKAERO C[C@H]([NH2+]C1CCCCCC1)c1cccc2ccccc21 ZINC000021516297 171312750 /nfs/dbraw/zinc/31/27/50/171312750.db2.gz GCXZFWHGSGHXQF-HNNXBMFYSA-N 1 0 267.416 5.213 10 0 CKAERO CC(C)CCC[C@@H](C)[NH2+][C@H](C)c1cccc(Cl)c1 ZINC000021516387 171312768 /nfs/dbraw/zinc/31/27/68/171312768.db2.gz KBGLRQYPXCWGIX-ZIAGYGMSSA-N 1 0 267.844 5.205 10 0 CKAERO CC(C)CCC[C@H](C)[NH2+][C@H](C)c1cccc(Cl)c1 ZINC000021516388 171312962 /nfs/dbraw/zinc/31/29/62/171312962.db2.gz KBGLRQYPXCWGIX-UONOGXRCSA-N 1 0 267.844 5.205 10 0 CKAERO CC[C@@H]([NH2+][C@@H](C)c1ccccc1)c1cccc(Cl)c1 ZINC000021516444 171313019 /nfs/dbraw/zinc/31/30/19/171313019.db2.gz MJXLRXXSNPRQJZ-SUMWQHHRSA-N 1 0 273.807 5.142 10 0 CKAERO CC[C@H]([NH2+][C@@H](C)c1ccccc1)c1cccc(Cl)c1 ZINC000021516445 171312744 /nfs/dbraw/zinc/31/27/44/171312744.db2.gz MJXLRXXSNPRQJZ-GUYCJALGSA-N 1 0 273.807 5.142 10 0 CKAERO CC[C@@H]([NH2+][C@H](C)c1ccccc1)c1cccc(Cl)c1 ZINC000021516446 171313064 /nfs/dbraw/zinc/31/30/64/171313064.db2.gz MJXLRXXSNPRQJZ-CXAGYDPISA-N 1 0 273.807 5.142 10 0 CKAERO CC[C@H]([NH2+][C@H](C)c1ccccc1)c1cccc(Cl)c1 ZINC000021516447 171312786 /nfs/dbraw/zinc/31/27/86/171312786.db2.gz MJXLRXXSNPRQJZ-DYVFJYSZSA-N 1 0 273.807 5.142 10 0 CKAERO CCCCCC[NH2+][C@@H](CC)c1ccc(Br)cc1 ZINC000021516678 171312833 /nfs/dbraw/zinc/31/28/33/171312833.db2.gz NZAMRKKLKFVHNF-HNNXBMFYSA-N 1 0 298.268 5.070 10 0 CKAERO CCCCCC[NH2+][C@H](CC)c1ccc(Br)cc1 ZINC000021516679 171312764 /nfs/dbraw/zinc/31/27/64/171312764.db2.gz NZAMRKKLKFVHNF-OAHLLOKOSA-N 1 0 298.268 5.070 10 0 CKAERO C[C@H]([NH2+][C@H]1CCCC[C@H]1C)c1cc(Cl)ccc1Cl ZINC000021516689 171313072 /nfs/dbraw/zinc/31/30/72/171313072.db2.gz YTRKPAYOCAJGDO-ZETOZRRWSA-N 1 0 286.246 5.223 10 0 CKAERO C[C@H]([NH2+][C@H]1CCCC[C@@H]1C)c1cc(Cl)ccc1Cl ZINC000021516690 171312729 /nfs/dbraw/zinc/31/27/29/171312729.db2.gz YTRKPAYOCAJGDO-PGUXBMHVSA-N 1 0 286.246 5.223 10 0 CKAERO C[C@H]([NH2+][C@@H]1CCCC[C@H]1C)c1cc(Cl)ccc1Cl ZINC000021516691 171312998 /nfs/dbraw/zinc/31/29/98/171312998.db2.gz YTRKPAYOCAJGDO-JRPNMDOOSA-N 1 0 286.246 5.223 10 0 CKAERO C[C@H]([NH2+][C@@H]1CCCC[C@@H]1C)c1cc(Cl)ccc1Cl ZINC000021516692 171312969 /nfs/dbraw/zinc/31/29/69/171312969.db2.gz YTRKPAYOCAJGDO-ZIBATOQPSA-N 1 0 286.246 5.223 10 0 CKAERO c1ccc2c(c1)CCCC[C@H]2[NH2+]C1CCCCCCC1 ZINC000021516701 171312774 /nfs/dbraw/zinc/31/27/74/171312774.db2.gz SRWIRNBRNWPREB-LJQANCHMSA-N 1 0 271.448 5.157 10 0 CKAERO c1ccc2c(c1)CCCC[C@@H]2[NH2+]C1CCCCCCC1 ZINC000021516702 171312839 /nfs/dbraw/zinc/31/28/39/171312839.db2.gz SRWIRNBRNWPREB-IBGZPJMESA-N 1 0 271.448 5.157 10 0 CKAERO CC(C)(C)[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CCCc2ccccc21 ZINC000021517414 171313772 /nfs/dbraw/zinc/31/37/72/171313772.db2.gz KSMGWPPRLRMXSW-QRVBRYPASA-N 1 0 285.475 5.259 10 0 CKAERO CC(C)(C)[C@H]1CCCC[C@@H]1[NH2+][C@@H]1CCCc2ccccc21 ZINC000021517415 171313712 /nfs/dbraw/zinc/31/37/12/171313712.db2.gz KSMGWPPRLRMXSW-OTWHNJEPSA-N 1 0 285.475 5.259 10 0 CKAERO CC(C)(C)[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CCCc2ccccc21 ZINC000021517416 171313625 /nfs/dbraw/zinc/31/36/25/171313625.db2.gz KSMGWPPRLRMXSW-GUDVDZBRSA-N 1 0 285.475 5.259 10 0 CKAERO CC(C)(C)[C@H]1CCCC[C@H]1[NH2+][C@@H]1CCCc2ccccc21 ZINC000021517417 171313724 /nfs/dbraw/zinc/31/37/24/171313724.db2.gz KSMGWPPRLRMXSW-IPMKNSEASA-N 1 0 285.475 5.259 10 0 CKAERO CCCC(CCC)[NH2+][C@@H](C)C12CC3CC(CC(C3)C1)C2 ZINC000021517429 171313717 /nfs/dbraw/zinc/31/37/17/171313717.db2.gz RPGMLCFGEKFIAM-ISOUWHGUSA-N 1 0 277.496 5.150 10 0 CKAERO CCCC(CCC)[NH2+][C@H](C)C12CC3CC(CC(C3)C1)C2 ZINC000021517430 171313650 /nfs/dbraw/zinc/31/36/50/171313650.db2.gz RPGMLCFGEKFIAM-DGTBMVLOSA-N 1 0 277.496 5.150 10 0 CKAERO CCCCC1CCC([C@@H]([NH3+])c2ccc(C)s2)CC1 ZINC000021517941 171314198 /nfs/dbraw/zinc/31/41/98/171314198.db2.gz NCOXUHHKLZSVCD-ZBCRRDGASA-N 1 0 265.466 5.053 10 0 CKAERO CCCCC1CCC([C@H]([NH3+])c2ccc(C)s2)CC1 ZINC000021517942 171314021 /nfs/dbraw/zinc/31/40/21/171314021.db2.gz NCOXUHHKLZSVCD-XUJLQICISA-N 1 0 265.466 5.053 10 0 CKAERO C[C@@H](CCc1ccccc1)[NH2+][C@@H](C)c1ccc(Cl)cc1 ZINC000021517996 171313979 /nfs/dbraw/zinc/31/39/79/171313979.db2.gz CALOSIBVASJNDO-GJZGRUSLSA-N 1 0 287.834 5.012 10 0 CKAERO C[C@H](CCc1ccccc1)[NH2+][C@@H](C)c1ccc(Cl)cc1 ZINC000021517997 171314103 /nfs/dbraw/zinc/31/41/03/171314103.db2.gz CALOSIBVASJNDO-CABCVRRESA-N 1 0 287.834 5.012 10 0 CKAERO C[C@@H]([NH2+][C@@H](C)CCc1ccccc1)c1ccc(Cl)cc1 ZINC000021517998 171314046 /nfs/dbraw/zinc/31/40/46/171314046.db2.gz CALOSIBVASJNDO-LSDHHAIUSA-N 1 0 287.834 5.012 10 0 CKAERO C[C@H](CCc1ccccc1)[NH2+][C@H](C)c1ccc(Cl)cc1 ZINC000021517999 171314078 /nfs/dbraw/zinc/31/40/78/171314078.db2.gz CALOSIBVASJNDO-HUUCEWRRSA-N 1 0 287.834 5.012 10 0 CKAERO C[C@H]([NH2+][C@H]1CCCC[C@@H]1C)c1ccc(C(C)(C)C)cc1 ZINC000021518183 171314375 /nfs/dbraw/zinc/31/43/75/171314375.db2.gz JLYWJHHIFPJAOM-MPGHIAIKSA-N 1 0 273.464 5.213 10 0 CKAERO C[C@H]([NH2+][C@@H]1CCCC[C@@H]1C)c1ccc(C(C)(C)C)cc1 ZINC000021518185 171314349 /nfs/dbraw/zinc/31/43/49/171314349.db2.gz JLYWJHHIFPJAOM-RLFYNMQTSA-N 1 0 273.464 5.213 10 0 CKAERO CC[C@@H]([NH2+]C1CCCCCC1)c1cccc(Cl)c1 ZINC000021518355 171314652 /nfs/dbraw/zinc/31/46/52/171314652.db2.gz MMVHAKYQNZRZSW-MRXNPFEDSA-N 1 0 265.828 5.104 10 0 CKAERO CC[C@H]([NH2+]C1CCCCCC1)c1cccc(Cl)c1 ZINC000021518356 171314551 /nfs/dbraw/zinc/31/45/51/171314551.db2.gz MMVHAKYQNZRZSW-INIZCTEOSA-N 1 0 265.828 5.104 10 0 CKAERO C[C@@H]([NH2+][C@@H](C)c1cc(F)ccc1F)c1ccc(Cl)cc1 ZINC000021518401 171314437 /nfs/dbraw/zinc/31/44/37/171314437.db2.gz NWQNACSZVCTKPH-MNOVXSKESA-N 1 0 295.760 5.030 10 0 CKAERO C[C@H]([NH2+][C@@H](C)c1cc(F)ccc1F)c1ccc(Cl)cc1 ZINC000021518402 171314693 /nfs/dbraw/zinc/31/46/93/171314693.db2.gz NWQNACSZVCTKPH-QWRGUYRKSA-N 1 0 295.760 5.030 10 0 CKAERO C[C@@H]([NH2+][C@H](C)c1cc(F)ccc1F)c1ccc(Cl)cc1 ZINC000021518403 171314677 /nfs/dbraw/zinc/31/46/77/171314677.db2.gz NWQNACSZVCTKPH-GHMZBOCLSA-N 1 0 295.760 5.030 10 0 CKAERO C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1)c1cc(F)ccc1F ZINC000021518404 171314433 /nfs/dbraw/zinc/31/44/33/171314433.db2.gz NWQNACSZVCTKPH-WDEREUQCSA-N 1 0 295.760 5.030 10 0 CKAERO CC(C)C[C@@H]([NH2+][C@@H](C)c1ccccc1)c1ccccc1 ZINC000021518519 171314513 /nfs/dbraw/zinc/31/45/13/171314513.db2.gz SQLCCTICQVDPGR-QFBILLFUSA-N 1 0 267.416 5.125 10 0 CKAERO CC(C)C[C@H]([NH2+][C@@H](C)c1ccccc1)c1ccccc1 ZINC000021518520 171314673 /nfs/dbraw/zinc/31/46/73/171314673.db2.gz SQLCCTICQVDPGR-LPHOPBHVSA-N 1 0 267.416 5.125 10 0 CKAERO CC(C)C[C@@H]([NH2+][C@H](C)c1ccccc1)c1ccccc1 ZINC000021518521 171314383 /nfs/dbraw/zinc/31/43/83/171314383.db2.gz SQLCCTICQVDPGR-VQIMIIECSA-N 1 0 267.416 5.125 10 0 CKAERO CC(C)C[C@H]([NH2+][C@H](C)c1ccccc1)c1ccccc1 ZINC000021518522 171314341 /nfs/dbraw/zinc/31/43/41/171314341.db2.gz SQLCCTICQVDPGR-APWZRJJASA-N 1 0 267.416 5.125 10 0 CKAERO C[C@@H]([NH2+]C1CCCCCC1)c1ccc2ccccc2c1 ZINC000021518565 171314481 /nfs/dbraw/zinc/31/44/81/171314481.db2.gz SDMHCGKTYVITDW-OAHLLOKOSA-N 1 0 267.416 5.213 10 0 CKAERO C[C@H]([NH2+]C1CCCCCC1)c1ccc2ccccc2c1 ZINC000021518566 171314625 /nfs/dbraw/zinc/31/46/25/171314625.db2.gz SDMHCGKTYVITDW-HNNXBMFYSA-N 1 0 267.416 5.213 10 0 CKAERO Cc1ccc([C@H](C)[NH2+][C@H](C)c2cccc(Cl)c2)cc1C ZINC000021519156 171315189 /nfs/dbraw/zinc/31/51/89/171315189.db2.gz HEWYJWXKQHWWMA-CABCVRRESA-N 1 0 287.834 5.369 10 0 CKAERO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2cccc(Cl)c2)cc1C ZINC000021519157 171315194 /nfs/dbraw/zinc/31/51/94/171315194.db2.gz HEWYJWXKQHWWMA-GJZGRUSLSA-N 1 0 287.834 5.369 10 0 CKAERO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2cccc(Cl)c2)cc1C ZINC000021519158 171315235 /nfs/dbraw/zinc/31/52/35/171315235.db2.gz HEWYJWXKQHWWMA-HUUCEWRRSA-N 1 0 287.834 5.369 10 0 CKAERO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2cccc(Cl)c2)cc1C ZINC000021519159 171315143 /nfs/dbraw/zinc/31/51/43/171315143.db2.gz HEWYJWXKQHWWMA-LSDHHAIUSA-N 1 0 287.834 5.369 10 0 CKAERO C[C@@H]([NH3+])c1ccccc1Sc1cc(Cl)ccc1Cl ZINC000021519165 171315203 /nfs/dbraw/zinc/31/52/03/171315203.db2.gz IBISTRCDQNPLLM-SECBINFHSA-N 1 0 298.238 5.164 10 0 CKAERO C[C@H]([NH3+])c1ccccc1Sc1cc(Cl)ccc1Cl ZINC000021519166 171315219 /nfs/dbraw/zinc/31/52/19/171315219.db2.gz IBISTRCDQNPLLM-VIFPVBQESA-N 1 0 298.238 5.164 10 0 CKAERO CCCC1CCC([NH2+]C2CCCCCCC2)CC1 ZINC000021519220 171315225 /nfs/dbraw/zinc/31/52/25/171315225.db2.gz MLYJDPUXYRPHNS-UHFFFAOYSA-N 1 0 251.458 5.048 10 0 CKAERO CCC[C@@H]([NH2+][C@@H](C)c1ccccc1)c1ccc(Cl)cc1 ZINC000021519622 171315348 /nfs/dbraw/zinc/31/53/48/171315348.db2.gz UADQEPMABXYVRH-KBXCAEBGSA-N 1 0 287.834 5.532 10 0 CKAERO CCC[C@H]([NH2+][C@@H](C)c1ccccc1)c1ccc(Cl)cc1 ZINC000021519623 171315323 /nfs/dbraw/zinc/31/53/23/171315323.db2.gz UADQEPMABXYVRH-KSSFIOAISA-N 1 0 287.834 5.532 10 0 CKAERO CCC[C@@H]([NH2+][C@H](C)c1ccccc1)c1ccc(Cl)cc1 ZINC000021519624 171315353 /nfs/dbraw/zinc/31/53/53/171315353.db2.gz UADQEPMABXYVRH-RDTXWAMCSA-N 1 0 287.834 5.532 10 0 CKAERO CCC[C@H]([NH2+][C@H](C)c1ccccc1)c1ccc(Cl)cc1 ZINC000021519625 171315303 /nfs/dbraw/zinc/31/53/03/171315303.db2.gz UADQEPMABXYVRH-KDOFPFPSSA-N 1 0 287.834 5.532 10 0 CKAERO CCC(CC)[NH2+][C@@H](C)c1ccc2c(c1)Cc1ccccc1-2 ZINC000021520071 171315770 /nfs/dbraw/zinc/31/57/70/171315770.db2.gz KASBCNZHTZSLRW-AWEZNQCLSA-N 1 0 279.427 5.097 10 0 CKAERO CCC(CC)[NH2+][C@H](C)c1ccc2c(c1)Cc1ccccc1-2 ZINC000021520072 171315569 /nfs/dbraw/zinc/31/55/69/171315569.db2.gz KASBCNZHTZSLRW-CQSZACIVSA-N 1 0 279.427 5.097 10 0 CKAERO Cc1ccccc1C[NH2+][C@H](C)c1ccc(Cl)c(Cl)c1 ZINC000021520215 171315574 /nfs/dbraw/zinc/31/55/74/171315574.db2.gz AKNPHLMBAGPGFR-GFCCVEGCSA-N 1 0 294.225 5.153 10 0 CKAERO Cc1ccccc1C[NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000021520216 171315630 /nfs/dbraw/zinc/31/56/30/171315630.db2.gz AKNPHLMBAGPGFR-LBPRGKRZSA-N 1 0 294.225 5.153 10 0 CKAERO CC(C)C[C@@H]([NH2+]C1CCCCCCC1)c1ccccc1 ZINC000021520753 171316159 /nfs/dbraw/zinc/31/61/59/171316159.db2.gz FDDMINBUJAIVOK-LJQANCHMSA-N 1 0 273.464 5.476 10 0 CKAERO CC(C)C[C@H]([NH2+]C1CCCCCCC1)c1ccccc1 ZINC000021520754 171315970 /nfs/dbraw/zinc/31/59/70/171315970.db2.gz FDDMINBUJAIVOK-IBGZPJMESA-N 1 0 273.464 5.476 10 0 CKAERO C[C@H]([NH2+]C1CCC(C)CC1)c1cc(Cl)ccc1Cl ZINC000021520762 171315859 /nfs/dbraw/zinc/31/58/59/171315859.db2.gz JCQPTCOHQKTHPV-AKJDGMEZSA-N 1 0 286.246 5.223 10 0 CKAERO C[C@@H]([NH2+]C1CCC(C)CC1)c1cc(Cl)ccc1Cl ZINC000021520763 171315967 /nfs/dbraw/zinc/31/59/67/171315967.db2.gz JCQPTCOHQKTHPV-QWKFWESOSA-N 1 0 286.246 5.223 10 0 CKAERO CC[C@@H]([NH2+][C@@H](C)c1ccccc1Cl)c1ccccc1 ZINC000021520989 171315884 /nfs/dbraw/zinc/31/58/84/171315884.db2.gz CMXJOJFUNOMKQR-SUMWQHHRSA-N 1 0 273.807 5.142 10 0 CKAERO CC[C@H]([NH2+][C@@H](C)c1ccccc1Cl)c1ccccc1 ZINC000021520990 171315937 /nfs/dbraw/zinc/31/59/37/171315937.db2.gz CMXJOJFUNOMKQR-GUYCJALGSA-N 1 0 273.807 5.142 10 0 CKAERO CC[C@@H]([NH2+][C@H](C)c1ccccc1Cl)c1ccccc1 ZINC000021520991 171315926 /nfs/dbraw/zinc/31/59/26/171315926.db2.gz CMXJOJFUNOMKQR-CXAGYDPISA-N 1 0 273.807 5.142 10 0 CKAERO CC[C@H]([NH2+][C@H](C)c1ccccc1Cl)c1ccccc1 ZINC000021520992 171315862 /nfs/dbraw/zinc/31/58/62/171315862.db2.gz CMXJOJFUNOMKQR-DYVFJYSZSA-N 1 0 273.807 5.142 10 0 CKAERO CC(C)CCC[C@@H](C)[NH2+]Cc1ccc(Cl)c(Cl)c1 ZINC000021786590 171322448 /nfs/dbraw/zinc/32/24/48/171322448.db2.gz FOXVIIMLDPTQMY-GFCCVEGCSA-N 1 0 288.262 5.298 10 0 CKAERO CC(C)CCC[C@H](C)[NH2+]Cc1ccc(Cl)c(Cl)c1 ZINC000021786594 171322411 /nfs/dbraw/zinc/32/24/11/171322411.db2.gz FOXVIIMLDPTQMY-LBPRGKRZSA-N 1 0 288.262 5.298 10 0 CKAERO C[C@@H]([NH2+]C1CCCCCCC1)c1cccc2ccccc21 ZINC000021787848 171322998 /nfs/dbraw/zinc/32/29/98/171322998.db2.gz PTQMHQVBVLRXPC-MRXNPFEDSA-N 1 0 281.443 5.603 10 0 CKAERO C[C@H]([NH2+]C1CCCCCCC1)c1cccc2ccccc21 ZINC000021787851 171323015 /nfs/dbraw/zinc/32/30/15/171323015.db2.gz PTQMHQVBVLRXPC-INIZCTEOSA-N 1 0 281.443 5.603 10 0 CKAERO CC[C@@H](C)[C@H](c1ccccc1)[C@@H]([NH3+])c1ccc(Cl)cc1 ZINC000021788235 171323111 /nfs/dbraw/zinc/32/31/11/171323111.db2.gz COQHYSCXEVVKGV-XWIAVFTESA-N 1 0 287.834 5.170 10 0 CKAERO CC[C@H](C)[C@H](c1ccccc1)[C@@H]([NH3+])c1ccc(Cl)cc1 ZINC000021788239 171322870 /nfs/dbraw/zinc/32/28/70/171322870.db2.gz COQHYSCXEVVKGV-VHSSKADRSA-N 1 0 287.834 5.170 10 0 CKAERO CC[C@@H](C)[C@@H](c1ccccc1)[C@@H]([NH3+])c1ccc(Cl)cc1 ZINC000021788242 171322968 /nfs/dbraw/zinc/32/29/68/171322968.db2.gz COQHYSCXEVVKGV-BVGQSLNGSA-N 1 0 287.834 5.170 10 0 CKAERO CC[C@H](C)[C@@H](c1ccccc1)[C@@H]([NH3+])c1ccc(Cl)cc1 ZINC000021788246 171322955 /nfs/dbraw/zinc/32/29/55/171322955.db2.gz COQHYSCXEVVKGV-KKXDTOCCSA-N 1 0 287.834 5.170 10 0 CKAERO C[C@@H]([NH2+]C1CCCCCC1)c1cccc(C(F)(F)F)c1 ZINC000021788431 171323367 /nfs/dbraw/zinc/32/33/67/171323367.db2.gz OJCNLQMFWDACMO-GFCCVEGCSA-N 1 0 285.353 5.079 10 0 CKAERO C[C@H]([NH2+]C1CCCCCC1)c1cccc(C(F)(F)F)c1 ZINC000021788434 171323331 /nfs/dbraw/zinc/32/33/31/171323331.db2.gz OJCNLQMFWDACMO-LBPRGKRZSA-N 1 0 285.353 5.079 10 0 CKAERO c1ccc(C2CCC([NH2+]C3CCCCCC3)CC2)cc1 ZINC000021791346 171324282 /nfs/dbraw/zinc/32/42/82/171324282.db2.gz ZXXFGQQHVCGNQB-UHFFFAOYSA-N 1 0 271.448 5.025 10 0 CKAERO C[C@@H](CCc1ccccc1)[NH2+]C1CCC(C(C)(C)C)CC1 ZINC000021791777 171324184 /nfs/dbraw/zinc/32/41/84/171324184.db2.gz HYSKIRXEEOAATC-IVMQYODDSA-N 1 0 287.491 5.202 10 0 CKAERO C[C@H](CCc1ccccc1)[NH2+]C1CCC(C(C)(C)C)CC1 ZINC000021791779 171324307 /nfs/dbraw/zinc/32/43/07/171324307.db2.gz HYSKIRXEEOAATC-IPJUCJBFSA-N 1 0 287.491 5.202 10 0 CKAERO CC(C)c1ccc([C@@H](C)[NH2+]Cc2ccc(Cl)cc2)cc1 ZINC000021791839 171324131 /nfs/dbraw/zinc/32/41/31/171324131.db2.gz MTPRBZGAGLIQBK-CQSZACIVSA-N 1 0 287.834 5.314 10 0 CKAERO CC(C)c1ccc([C@H](C)[NH2+]Cc2ccc(Cl)cc2)cc1 ZINC000021791843 171324304 /nfs/dbraw/zinc/32/43/04/171324304.db2.gz MTPRBZGAGLIQBK-AWEZNQCLSA-N 1 0 287.834 5.314 10 0 CKAERO CCCCC[NH2+]C1CCCCCCCCCCC1 ZINC000021791969 171324160 /nfs/dbraw/zinc/32/41/60/171324160.db2.gz NUGVRCAIBKLKMN-UHFFFAOYSA-N 1 0 253.474 5.440 10 0 CKAERO CC(C)Cc1ccc([C@@H](C)[NH2+][C@@H]2CCCC[C@@H]2C)cc1 ZINC000021792275 171324120 /nfs/dbraw/zinc/32/41/20/171324120.db2.gz LWCOENALPIROQM-FRQCXROJSA-N 1 0 273.464 5.114 10 0 CKAERO CC(C)Cc1ccc([C@H](C)[NH2+][C@@H]2CCCC[C@@H]2C)cc1 ZINC000021792278 171324220 /nfs/dbraw/zinc/32/42/20/171324220.db2.gz LWCOENALPIROQM-TXPKVOOTSA-N 1 0 273.464 5.114 10 0 CKAERO CC(C)Cc1ccc([C@@H](C)[NH2+][C@H]2CCCC[C@@H]2C)cc1 ZINC000021792282 171324393 /nfs/dbraw/zinc/32/43/93/171324393.db2.gz LWCOENALPIROQM-FCEWJHQRSA-N 1 0 273.464 5.114 10 0 CKAERO CC(C)Cc1ccc([C@H](C)[NH2+][C@H]2CCCC[C@@H]2C)cc1 ZINC000021792286 171324358 /nfs/dbraw/zinc/32/43/58/171324358.db2.gz LWCOENALPIROQM-BXWFABGCSA-N 1 0 273.464 5.114 10 0 CKAERO C[C@@H]([NH2+]C1CCCCCC1)c1ccc(Cl)c(Cl)c1 ZINC000021792552 171324312 /nfs/dbraw/zinc/32/43/12/171324312.db2.gz MTVWHXIQVAZUJA-LLVKDONJSA-N 1 0 286.246 5.367 10 0 CKAERO C[C@H]([NH2+]C1CCCCCC1)c1ccc(Cl)c(Cl)c1 ZINC000021792555 171324201 /nfs/dbraw/zinc/32/42/01/171324201.db2.gz MTVWHXIQVAZUJA-NSHDSACASA-N 1 0 286.246 5.367 10 0 CKAERO CCCCCOc1ccc(C[NH2+][C@@H](C)CCC(C)C)cc1 ZINC000021794088 171324870 /nfs/dbraw/zinc/32/48/70/171324870.db2.gz CIZSCBVXCVTVFA-KRWDZBQOSA-N 1 0 291.479 5.170 10 0 CKAERO CCCCCOc1ccc(C[NH2+][C@H](C)CCC(C)C)cc1 ZINC000021794092 171324580 /nfs/dbraw/zinc/32/45/80/171324580.db2.gz CIZSCBVXCVTVFA-QGZVFWFLSA-N 1 0 291.479 5.170 10 0 CKAERO C[C@@H]([NH2+][C@@H](C)c1cccs1)c1ccc2ccccc2c1 ZINC000021794375 171324686 /nfs/dbraw/zinc/32/46/86/171324686.db2.gz MPVJXFLRLZFCPY-KGLIPLIRSA-N 1 0 281.424 5.313 10 0 CKAERO C[C@H]([NH2+][C@@H](C)c1ccc2ccccc2c1)c1cccs1 ZINC000021794378 171324634 /nfs/dbraw/zinc/32/46/34/171324634.db2.gz MPVJXFLRLZFCPY-KBPBESRZSA-N 1 0 281.424 5.313 10 0 CKAERO C[C@@H]([NH2+][C@H](C)c1ccc2ccccc2c1)c1cccs1 ZINC000021794382 171324705 /nfs/dbraw/zinc/32/47/05/171324705.db2.gz MPVJXFLRLZFCPY-ZIAGYGMSSA-N 1 0 281.424 5.313 10 0 CKAERO C[C@@H]([NH2+][C@@H](C)c1ccc2ccccc2c1)c1cccs1 ZINC000021794385 171324751 /nfs/dbraw/zinc/32/47/51/171324751.db2.gz MPVJXFLRLZFCPY-UONOGXRCSA-N 1 0 281.424 5.313 10 0 CKAERO CC(C)C[C@@H]([NH2+][C@@H](C)c1cccc(F)c1)c1ccccc1 ZINC000021795543 171324482 /nfs/dbraw/zinc/32/44/82/171324482.db2.gz NICNITFPHAHFHF-HNAYVOBHSA-N 1 0 285.406 5.264 10 0 CKAERO CC(C)C[C@H]([NH2+][C@@H](C)c1cccc(F)c1)c1ccccc1 ZINC000021795547 171324935 /nfs/dbraw/zinc/32/49/35/171324935.db2.gz NICNITFPHAHFHF-KXBFYZLASA-N 1 0 285.406 5.264 10 0 CKAERO CC(C)C[C@@H]([NH2+][C@H](C)c1cccc(F)c1)c1ccccc1 ZINC000021795551 171324931 /nfs/dbraw/zinc/32/49/31/171324931.db2.gz NICNITFPHAHFHF-DNVCBOLYSA-N 1 0 285.406 5.264 10 0 CKAERO CC(C)C[C@H]([NH2+][C@H](C)c1cccc(F)c1)c1ccccc1 ZINC000021795554 171324925 /nfs/dbraw/zinc/32/49/25/171324925.db2.gz NICNITFPHAHFHF-BEFAXECRSA-N 1 0 285.406 5.264 10 0 CKAERO CC(C)C[C@@H]([NH2+]Cc1ccccc1Cl)c1ccccc1 ZINC000021797258 171325244 /nfs/dbraw/zinc/32/52/44/171325244.db2.gz DDNCUNGMSZFVFE-GOSISDBHSA-N 1 0 287.834 5.217 10 0 CKAERO CC(C)C[C@H]([NH2+]Cc1ccccc1Cl)c1ccccc1 ZINC000021797262 171325106 /nfs/dbraw/zinc/32/51/06/171325106.db2.gz DDNCUNGMSZFVFE-SFHVURJKSA-N 1 0 287.834 5.217 10 0 CKAERO CC(C)(C)C1CCC([NH2+][C@@H]2CCCc3ccccc32)CC1 ZINC000021797365 171325105 /nfs/dbraw/zinc/32/51/05/171325105.db2.gz LIRQCNIVPHZIFW-FAFZWHIHSA-N 1 0 285.475 5.259 10 0 CKAERO CC(C)(C)C1CCC([NH2+][C@H]2CCCc3ccccc32)CC1 ZINC000021797368 171325090 /nfs/dbraw/zinc/32/50/90/171325090.db2.gz LIRQCNIVPHZIFW-TVPLGVNVSA-N 1 0 285.475 5.259 10 0 CKAERO Cc1cc(C)c([C@H](C)[NH2+][C@H](C)c2ccccc2C)cc1C ZINC000021797787 171325113 /nfs/dbraw/zinc/32/51/13/171325113.db2.gz MNUQQQCSMUGIHK-MSOLQXFVSA-N 1 0 281.443 5.332 10 0 CKAERO Cc1ccccc1[C@H](C)[NH2+][C@@H](C)c1cc(C)c(C)cc1C ZINC000021797791 171325188 /nfs/dbraw/zinc/32/51/88/171325188.db2.gz MNUQQQCSMUGIHK-ROUUACIJSA-N 1 0 281.443 5.332 10 0 CKAERO Cc1ccccc1[C@@H](C)[NH2+][C@H](C)c1cc(C)c(C)cc1C ZINC000021797795 171325270 /nfs/dbraw/zinc/32/52/70/171325270.db2.gz MNUQQQCSMUGIHK-QZTJIDSGSA-N 1 0 281.443 5.332 10 0 CKAERO Cc1cc(C)c([C@@H](C)[NH2+][C@@H](C)c2ccccc2C)cc1C ZINC000021797799 171325159 /nfs/dbraw/zinc/32/51/59/171325159.db2.gz MNUQQQCSMUGIHK-ZWKOTPCHSA-N 1 0 281.443 5.332 10 0 CKAERO CC(C)CC[C@@H](C)[NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000021798111 171325211 /nfs/dbraw/zinc/32/52/11/171325211.db2.gz OBIGUYDVURCPMS-NEPJUHHUSA-N 1 0 288.262 5.469 10 0 CKAERO CC(C)CC[C@H](C)[NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000021798114 171325247 /nfs/dbraw/zinc/32/52/47/171325247.db2.gz OBIGUYDVURCPMS-RYUDHWBXSA-N 1 0 288.262 5.469 10 0 CKAERO CC(C)CC[C@@H](C)[NH2+][C@H](C)c1ccc(Cl)c(Cl)c1 ZINC000021798117 171325303 /nfs/dbraw/zinc/32/53/03/171325303.db2.gz OBIGUYDVURCPMS-VXGBXAGGSA-N 1 0 288.262 5.469 10 0 CKAERO CC(C)CC[C@H](C)[NH2+][C@H](C)c1ccc(Cl)c(Cl)c1 ZINC000021798121 171325035 /nfs/dbraw/zinc/32/50/35/171325035.db2.gz OBIGUYDVURCPMS-NWDGAFQWSA-N 1 0 288.262 5.469 10 0 CKAERO C[C@@H]([NH2+]C1CCCCCCC1)c1cccc(C(F)(F)F)c1 ZINC000021798289 171325347 /nfs/dbraw/zinc/32/53/47/171325347.db2.gz MRKWNYQKOSMJDL-CYBMUJFWSA-N 1 0 299.380 5.469 10 0 CKAERO C[C@H]([NH2+]C1CCCCCCC1)c1cccc(C(F)(F)F)c1 ZINC000021798292 171325286 /nfs/dbraw/zinc/32/52/86/171325286.db2.gz MRKWNYQKOSMJDL-ZDUSSCGKSA-N 1 0 299.380 5.469 10 0 CKAERO Cc1ccc(C)c([C@H](C)[NH2+][C@H](C)c2ccccc2Cl)c1 ZINC000021798535 171325575 /nfs/dbraw/zinc/32/55/75/171325575.db2.gz XMJYMMYQIKZGGQ-CABCVRRESA-N 1 0 287.834 5.369 10 0 CKAERO Cc1ccc(C)c([C@H](C)[NH2+][C@@H](C)c2ccccc2Cl)c1 ZINC000021798538 171325555 /nfs/dbraw/zinc/32/55/55/171325555.db2.gz XMJYMMYQIKZGGQ-GJZGRUSLSA-N 1 0 287.834 5.369 10 0 CKAERO Cc1ccc(C)c([C@@H](C)[NH2+][C@H](C)c2ccccc2Cl)c1 ZINC000021798542 171325549 /nfs/dbraw/zinc/32/55/49/171325549.db2.gz XMJYMMYQIKZGGQ-HUUCEWRRSA-N 1 0 287.834 5.369 10 0 CKAERO Cc1ccc(C)c([C@@H](C)[NH2+][C@@H](C)c2ccccc2Cl)c1 ZINC000021798546 171325427 /nfs/dbraw/zinc/32/54/27/171325427.db2.gz XMJYMMYQIKZGGQ-LSDHHAIUSA-N 1 0 287.834 5.369 10 0 CKAERO C[C@@H]([NH2+]C1CCC(C(C)(C)C)CC1)c1ccccc1Cl ZINC000021798988 171325411 /nfs/dbraw/zinc/32/54/11/171325411.db2.gz YTONVEPRCFKQMV-WLYUNCDWSA-N 1 0 293.882 5.596 10 0 CKAERO C[C@H]([NH2+]C1CCC(C(C)(C)C)CC1)c1ccccc1Cl ZINC000021798992 171325580 /nfs/dbraw/zinc/32/55/80/171325580.db2.gz YTONVEPRCFKQMV-NFOMZHRRSA-N 1 0 293.882 5.596 10 0 CKAERO CC(C)C[C@@H]([NH2+]C[C@@H](C)c1ccccc1)c1ccccc1 ZINC000021800210 171325949 /nfs/dbraw/zinc/32/59/49/171325949.db2.gz DLCALPPKLARKEM-YLJYHZDGSA-N 1 0 281.443 5.167 10 0 CKAERO CC(C)C[C@H]([NH2+]C[C@@H](C)c1ccccc1)c1ccccc1 ZINC000021800213 171325805 /nfs/dbraw/zinc/32/58/05/171325805.db2.gz DLCALPPKLARKEM-XLIONFOSSA-N 1 0 281.443 5.167 10 0 CKAERO CC(C)C[C@@H]([NH2+]C[C@H](C)c1ccccc1)c1ccccc1 ZINC000021800216 171325737 /nfs/dbraw/zinc/32/57/37/171325737.db2.gz DLCALPPKLARKEM-FXAWDEMLSA-N 1 0 281.443 5.167 10 0 CKAERO CC(C)C[C@H]([NH2+]C[C@H](C)c1ccccc1)c1ccccc1 ZINC000021800220 171325901 /nfs/dbraw/zinc/32/59/01/171325901.db2.gz DLCALPPKLARKEM-PXNSSMCTSA-N 1 0 281.443 5.167 10 0 CKAERO CC[C@@H]([NH2+][C@@H](C)c1cccc(F)c1)c1ccc(Cl)cc1 ZINC000021801269 171326216 /nfs/dbraw/zinc/32/62/16/171326216.db2.gz ZAPYZHOXRVZOLY-YVEFUNNKSA-N 1 0 291.797 5.281 10 0 CKAERO CC[C@H]([NH2+][C@@H](C)c1cccc(F)c1)c1ccc(Cl)cc1 ZINC000021801270 171326195 /nfs/dbraw/zinc/32/61/95/171326195.db2.gz ZAPYZHOXRVZOLY-SJCJKPOMSA-N 1 0 291.797 5.281 10 0 CKAERO CC[C@@H]([NH2+][C@H](C)c1cccc(F)c1)c1ccc(Cl)cc1 ZINC000021801273 171326295 /nfs/dbraw/zinc/32/62/95/171326295.db2.gz ZAPYZHOXRVZOLY-SJKOYZFVSA-N 1 0 291.797 5.281 10 0 CKAERO CC[C@H]([NH2+][C@H](C)c1cccc(F)c1)c1ccc(Cl)cc1 ZINC000021801275 171326155 /nfs/dbraw/zinc/32/61/55/171326155.db2.gz ZAPYZHOXRVZOLY-PXAZEXFGSA-N 1 0 291.797 5.281 10 0 CKAERO CC(C)(C)[C@@H]1CCCC[C@@H]1[NH2+]CCC1=CCCCC1 ZINC000021801307 171326119 /nfs/dbraw/zinc/32/61/19/171326119.db2.gz RACOJUVFAVLRIF-SJORKVTESA-N 1 0 263.469 5.071 10 0 CKAERO CC(C)(C)[C@H]1CCCC[C@@H]1[NH2+]CCC1=CCCCC1 ZINC000021801309 171326100 /nfs/dbraw/zinc/32/61/00/171326100.db2.gz RACOJUVFAVLRIF-IRXDYDNUSA-N 1 0 263.469 5.071 10 0 CKAERO CC(C)(C)[C@@H]1CCCC[C@H]1[NH2+]CCC1=CCCCC1 ZINC000021801312 171326227 /nfs/dbraw/zinc/32/62/27/171326227.db2.gz RACOJUVFAVLRIF-IAGOWNOFSA-N 1 0 263.469 5.071 10 0 CKAERO CC(C)(C)[C@H]1CCCC[C@H]1[NH2+]CCC1=CCCCC1 ZINC000021801314 171326336 /nfs/dbraw/zinc/32/63/36/171326336.db2.gz RACOJUVFAVLRIF-DLBZAZTESA-N 1 0 263.469 5.071 10 0 CKAERO CC(C)c1ccc([C@@H](C)[NH2+][C@@H](C)c2ccccc2)cc1 ZINC000021803560 171326709 /nfs/dbraw/zinc/32/67/09/171326709.db2.gz VUWBSGATFFBIIL-JKSUJKDBSA-N 1 0 267.416 5.222 10 0 CKAERO CC(C)c1ccc([C@H](C)[NH2+][C@@H](C)c2ccccc2)cc1 ZINC000021803563 171326732 /nfs/dbraw/zinc/32/67/32/171326732.db2.gz VUWBSGATFFBIIL-HOTGVXAUSA-N 1 0 267.416 5.222 10 0 CKAERO CC(C)c1ccc([C@@H](C)[NH2+][C@H](C)c2ccccc2)cc1 ZINC000021803566 171326763 /nfs/dbraw/zinc/32/67/63/171326763.db2.gz VUWBSGATFFBIIL-HZPDHXFCSA-N 1 0 267.416 5.222 10 0 CKAERO CC(C)c1ccc([C@H](C)[NH2+][C@H](C)c2ccccc2)cc1 ZINC000021803568 171326551 /nfs/dbraw/zinc/32/65/51/171326551.db2.gz VUWBSGATFFBIIL-CVEARBPZSA-N 1 0 267.416 5.222 10 0 CKAERO C[C@@H]([NH2+][C@@H](C)c1cc2ccccc2o1)c1cccc(Cl)c1 ZINC000021803605 171326838 /nfs/dbraw/zinc/32/68/38/171326838.db2.gz WLXNUISXMFAMAK-OLZOCXBDSA-N 1 0 299.801 5.498 10 0 CKAERO C[C@H]([NH2+][C@@H](C)c1cccc(Cl)c1)c1cc2ccccc2o1 ZINC000021803608 171326778 /nfs/dbraw/zinc/32/67/78/171326778.db2.gz WLXNUISXMFAMAK-STQMWFEESA-N 1 0 299.801 5.498 10 0 CKAERO C[C@@H]([NH2+][C@H](C)c1cccc(Cl)c1)c1cc2ccccc2o1 ZINC000021803611 171326699 /nfs/dbraw/zinc/32/66/99/171326699.db2.gz WLXNUISXMFAMAK-CHWSQXEVSA-N 1 0 299.801 5.498 10 0 CKAERO C[C@@H]([NH2+][C@@H](C)c1cccc(Cl)c1)c1cc2ccccc2o1 ZINC000021803614 171326524 /nfs/dbraw/zinc/32/65/24/171326524.db2.gz WLXNUISXMFAMAK-QWHCGFSZSA-N 1 0 299.801 5.498 10 0 CKAERO CCc1ccc([C@@H]([NH2+]Cc2ccc(C)cc2)C(C)C)cc1 ZINC000021803679 171326850 /nfs/dbraw/zinc/32/68/50/171326850.db2.gz WMRRVTMHXMAKFI-FQEVSTJZSA-N 1 0 281.443 5.044 10 0 CKAERO CCc1ccc([C@H]([NH2+]Cc2ccc(C)cc2)C(C)C)cc1 ZINC000021803681 171326550 /nfs/dbraw/zinc/32/65/50/171326550.db2.gz WMRRVTMHXMAKFI-HXUWFJFHSA-N 1 0 281.443 5.044 10 0 CKAERO CC(C)(C)c1ccc(C[NH2+]C2CCCCCCC2)cc1 ZINC000021803830 171326687 /nfs/dbraw/zinc/32/66/87/171326687.db2.gz VXFYCJSAYNMWMO-UHFFFAOYSA-N 1 0 273.464 5.187 10 0 CKAERO CC[C@@H]([NH2+]C1CCCCCC1)c1ccc(Cl)cc1 ZINC000021804062 171326685 /nfs/dbraw/zinc/32/66/85/171326685.db2.gz QCFHVEIOHYJPKF-MRXNPFEDSA-N 1 0 265.828 5.104 10 0 CKAERO CC[C@H]([NH2+]C1CCCCCC1)c1ccc(Cl)cc1 ZINC000021804065 171326719 /nfs/dbraw/zinc/32/67/19/171326719.db2.gz QCFHVEIOHYJPKF-INIZCTEOSA-N 1 0 265.828 5.104 10 0 CKAERO C[C@@H]([NH2+]Cc1ccc(Cl)cc1)c1ccc2ccccc2c1 ZINC000021804845 171327222 /nfs/dbraw/zinc/32/72/22/171327222.db2.gz FWGHVWIDYMXHST-CQSZACIVSA-N 1 0 295.813 5.344 10 0 CKAERO C[C@H]([NH2+]Cc1ccc(Cl)cc1)c1ccc2ccccc2c1 ZINC000021804847 171326964 /nfs/dbraw/zinc/32/69/64/171326964.db2.gz FWGHVWIDYMXHST-AWEZNQCLSA-N 1 0 295.813 5.344 10 0 CKAERO CCCc1ccc([C@@H](C)[NH2+][C@@H](C)CCC(C)C)cc1 ZINC000021805581 171327357 /nfs/dbraw/zinc/32/73/57/171327357.db2.gz PCPHLEFQZGEJIA-JKSUJKDBSA-N 1 0 261.453 5.114 10 0 CKAERO CCCc1ccc([C@H](C)[NH2+][C@@H](C)CCC(C)C)cc1 ZINC000021805584 171327666 /nfs/dbraw/zinc/32/76/66/171327666.db2.gz PCPHLEFQZGEJIA-HOTGVXAUSA-N 1 0 261.453 5.114 10 0 CKAERO CCCc1ccc([C@@H](C)[NH2+][C@H](C)CCC(C)C)cc1 ZINC000021805586 171327420 /nfs/dbraw/zinc/32/74/20/171327420.db2.gz PCPHLEFQZGEJIA-HZPDHXFCSA-N 1 0 261.453 5.114 10 0 CKAERO CCCc1ccc([C@H](C)[NH2+][C@H](C)CCC(C)C)cc1 ZINC000021805589 171327519 /nfs/dbraw/zinc/32/75/19/171327519.db2.gz PCPHLEFQZGEJIA-CVEARBPZSA-N 1 0 261.453 5.114 10 0 CKAERO Cc1ccc(Oc2ccccc2[C@@H](C)[NH3+])c(C(C)(C)C)c1 ZINC000021806464 171327348 /nfs/dbraw/zinc/32/73/48/171327348.db2.gz USTLRFFWQBDSPQ-CQSZACIVSA-N 1 0 283.415 5.105 10 0 CKAERO Cc1ccc(Oc2ccccc2[C@H](C)[NH3+])c(C(C)(C)C)c1 ZINC000021806466 171327976 /nfs/dbraw/zinc/32/79/76/171327976.db2.gz USTLRFFWQBDSPQ-AWEZNQCLSA-N 1 0 283.415 5.105 10 0 CKAERO C[C@@H]([NH2+][C@@H](C)c1ccccc1Cl)c1ccc2c(c1)CCC2 ZINC000021808060 171328277 /nfs/dbraw/zinc/32/82/77/171328277.db2.gz LURUUKYUWGGELY-KGLIPLIRSA-N 1 0 299.845 5.241 10 0 CKAERO C[C@H]([NH2+][C@@H](C)c1ccccc1Cl)c1ccc2c(c1)CCC2 ZINC000021808062 171328260 /nfs/dbraw/zinc/32/82/60/171328260.db2.gz LURUUKYUWGGELY-KBPBESRZSA-N 1 0 299.845 5.241 10 0 CKAERO C[C@@H]([NH2+][C@H](C)c1ccccc1Cl)c1ccc2c(c1)CCC2 ZINC000021808065 171328122 /nfs/dbraw/zinc/32/81/22/171328122.db2.gz LURUUKYUWGGELY-ZIAGYGMSSA-N 1 0 299.845 5.241 10 0 CKAERO C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)CCC2)c1ccccc1Cl ZINC000021808067 171328301 /nfs/dbraw/zinc/32/83/01/171328301.db2.gz LURUUKYUWGGELY-UONOGXRCSA-N 1 0 299.845 5.241 10 0 CKAERO CC(C)(C)[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(Cl)cc1 ZINC000021808142 171328329 /nfs/dbraw/zinc/32/83/29/171328329.db2.gz RUENXAQDSNXJOC-CVEARBPZSA-N 1 0 279.855 5.035 10 0 CKAERO CC(C)(C)[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(Cl)cc1 ZINC000021808144 171328321 /nfs/dbraw/zinc/32/83/21/171328321.db2.gz RUENXAQDSNXJOC-HOTGVXAUSA-N 1 0 279.855 5.035 10 0 CKAERO CC(C)(C)[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(Cl)cc1 ZINC000021808146 171328360 /nfs/dbraw/zinc/32/83/60/171328360.db2.gz RUENXAQDSNXJOC-HZPDHXFCSA-N 1 0 279.855 5.035 10 0 CKAERO CC(C)(C)[C@H]1CCCC[C@H]1[NH2+]Cc1ccc(Cl)cc1 ZINC000021808148 171328364 /nfs/dbraw/zinc/32/83/64/171328364.db2.gz RUENXAQDSNXJOC-JKSUJKDBSA-N 1 0 279.855 5.035 10 0 CKAERO CCCCC[NH2+][C@@H](c1ccccc1)c1ccc(C)cc1C ZINC000021808313 171328407 /nfs/dbraw/zinc/32/84/07/171328407.db2.gz WRRBCOZTOZTDQI-FQEVSTJZSA-N 1 0 281.443 5.173 10 0 CKAERO CCCCC[NH2+][C@H](c1ccccc1)c1ccc(C)cc1C ZINC000021808316 171328119 /nfs/dbraw/zinc/32/81/19/171328119.db2.gz WRRBCOZTOZTDQI-HXUWFJFHSA-N 1 0 281.443 5.173 10 0 CKAERO C[C@H]([NH2+]C1CCC(C)CC1)c1ccc(C(C)(C)C)cc1 ZINC000021808999 171328529 /nfs/dbraw/zinc/32/85/29/171328529.db2.gz XUQMAVDLQCCALR-CSLYMUCUSA-N 1 0 273.464 5.213 10 0 CKAERO C[C@@H]([NH2+]C1CCC(C)CC1)c1ccc(C(C)(C)C)cc1 ZINC000021809001 171328708 /nfs/dbraw/zinc/32/87/08/171328708.db2.gz XUQMAVDLQCCALR-SWKXRBFHSA-N 1 0 273.464 5.213 10 0 CKAERO CCC[C@@H](C)C[NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000021809018 171328593 /nfs/dbraw/zinc/32/85/93/171328593.db2.gz AIQRREJWQKLBEA-MNOVXSKESA-N 1 0 274.235 5.080 10 0 CKAERO CCC[C@H](C)C[NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1 ZINC000021809021 171328524 /nfs/dbraw/zinc/32/85/24/171328524.db2.gz AIQRREJWQKLBEA-QWRGUYRKSA-N 1 0 274.235 5.080 10 0 CKAERO CCC[C@@H](C)C[NH2+][C@H](C)c1ccc(Cl)c(Cl)c1 ZINC000021809023 171328542 /nfs/dbraw/zinc/32/85/42/171328542.db2.gz AIQRREJWQKLBEA-GHMZBOCLSA-N 1 0 274.235 5.080 10 0 CKAERO CCC[C@H](C)C[NH2+][C@H](C)c1ccc(Cl)c(Cl)c1 ZINC000021809026 171328651 /nfs/dbraw/zinc/32/86/51/171328651.db2.gz AIQRREJWQKLBEA-WDEREUQCSA-N 1 0 274.235 5.080 10 0 CKAERO CC[C@@H]([NH2+]C1CCCCCCC1)c1ccc(Cl)cc1 ZINC000021809230 171328531 /nfs/dbraw/zinc/32/85/31/171328531.db2.gz WUHBTQGKQZQVCS-QGZVFWFLSA-N 1 0 279.855 5.494 10 0 CKAERO CC[C@H]([NH2+]C1CCCCCCC1)c1ccc(Cl)cc1 ZINC000021809231 171328666 /nfs/dbraw/zinc/32/86/66/171328666.db2.gz WUHBTQGKQZQVCS-KRWDZBQOSA-N 1 0 279.855 5.494 10 0 CKAERO Cc1ccccc1[C@@H](C)[NH2+]Cc1ccc(Cl)cc1Cl ZINC000021810130 262458915 /nfs/dbraw/zinc/45/89/15/262458915.db2.gz BRSUFLMOQKQAFJ-GFCCVEGCSA-N 1 0 294.225 5.153 10 0 CKAERO C[C@@H]([NH2+]C1CCCCCCC1)c1ccc2c(c1)CCCC2 ZINC000021810439 171329006 /nfs/dbraw/zinc/32/90/06/171329006.db2.gz FMGJONVIDPDPJZ-MRXNPFEDSA-N 1 0 285.475 5.329 10 0 CKAERO C[C@H]([NH2+]C1CCCCCCC1)c1ccc2c(c1)CCCC2 ZINC000021810440 171328905 /nfs/dbraw/zinc/32/89/05/171328905.db2.gz FMGJONVIDPDPJZ-INIZCTEOSA-N 1 0 285.475 5.329 10 0 CKAERO CC(C)CCCCCC[NH2+]Cc1ccc([C@@H]2C[C@@H]2C)o1 ZINC000021810475 171328774 /nfs/dbraw/zinc/32/87/74/171328774.db2.gz PJVGOFJFFBVPQD-DOTOQJQBSA-N 1 0 277.452 5.099 10 0 CKAERO CC(C)CCCCCC[NH2+]Cc1ccc([C@H]2C[C@@H]2C)o1 ZINC000021810477 171328787 /nfs/dbraw/zinc/32/87/87/171328787.db2.gz PJVGOFJFFBVPQD-RDJZCZTQSA-N 1 0 277.452 5.099 10 0 CKAERO CC(C)CCCCCC[NH2+]Cc1ccc([C@@H]2C[C@H]2C)o1 ZINC000021810479 171328877 /nfs/dbraw/zinc/32/88/77/171328877.db2.gz PJVGOFJFFBVPQD-NVXWUHKLSA-N 1 0 277.452 5.099 10 0 CKAERO CC(C)CCCCCC[NH2+]Cc1ccc([C@H]2C[C@H]2C)o1 ZINC000021810481 171328770 /nfs/dbraw/zinc/32/87/70/171328770.db2.gz PJVGOFJFFBVPQD-WBVHZDCISA-N 1 0 277.452 5.099 10 0 CKAERO CC(C)CCC[C@@H](C)[NH2+]Cc1ccc(C(F)(F)F)cc1 ZINC000021811209 171329334 /nfs/dbraw/zinc/32/93/34/171329334.db2.gz JIQUKPSWGXUSRC-CYBMUJFWSA-N 1 0 287.369 5.010 10 0 CKAERO CC(C)CCC[C@H](C)[NH2+]Cc1ccc(C(F)(F)F)cc1 ZINC000021811211 171329314 /nfs/dbraw/zinc/32/93/14/171329314.db2.gz JIQUKPSWGXUSRC-ZDUSSCGKSA-N 1 0 287.369 5.010 10 0 CKAERO CCC[C@@H]([NH2+][C@@H](C)c1cccc(Cl)c1)c1ccccc1 ZINC000021811625 171329319 /nfs/dbraw/zinc/32/93/19/171329319.db2.gz LIJBOTUUEXTPBU-KBXCAEBGSA-N 1 0 287.834 5.532 10 0 CKAERO CCC[C@@H]([NH2+][C@H](C)c1cccc(Cl)c1)c1ccccc1 ZINC000021811628 171329438 /nfs/dbraw/zinc/32/94/38/171329438.db2.gz LIJBOTUUEXTPBU-RDTXWAMCSA-N 1 0 287.834 5.532 10 0 CKAERO CCCc1ccc([C@H](C)[NH2+][C@@H](C)c2cccs2)cc1 ZINC000021811854 171329484 /nfs/dbraw/zinc/32/94/84/171329484.db2.gz UHNFZCIIBQKCJV-KBPBESRZSA-N 1 0 273.445 5.112 10 0 CKAERO CCCc1ccc([C@@H](C)[NH2+][C@H](C)c2cccs2)cc1 ZINC000021811855 171329379 /nfs/dbraw/zinc/32/93/79/171329379.db2.gz UHNFZCIIBQKCJV-ZIAGYGMSSA-N 1 0 273.445 5.112 10 0 CKAERO C[C@H]([NH2+][C@H]1CCCC[C@@H]1C)c1cccc2ccccc21 ZINC000021812205 171329714 /nfs/dbraw/zinc/32/97/14/171329714.db2.gz PEDZFLDSQXHXTN-DOXZYTNZSA-N 1 0 267.416 5.069 10 0 CKAERO C[C@H]([NH2+][C@@H]1CCCC[C@@H]1C)c1cccc2ccccc21 ZINC000021812207 171329769 /nfs/dbraw/zinc/32/97/69/171329769.db2.gz PEDZFLDSQXHXTN-YZVOILCLSA-N 1 0 267.416 5.069 10 0 CKAERO C[C@@H]([NH2+][C@@H]1CCCC[C@@H]1C(C)(C)C)c1ccccc1Cl ZINC000021812281 171329863 /nfs/dbraw/zinc/32/98/63/171329863.db2.gz KTBONZIJUVCJBN-UKPHBRMFSA-N 1 0 293.882 5.596 10 0 CKAERO C[C@H]([NH2+][C@@H]1CCCC[C@@H]1C(C)(C)C)c1ccccc1Cl ZINC000021812282 171329671 /nfs/dbraw/zinc/32/96/71/171329671.db2.gz KTBONZIJUVCJBN-JLJPHGGASA-N 1 0 293.882 5.596 10 0 CKAERO C[C@@H]([NH2+][C@H]1CCCC[C@@H]1C(C)(C)C)c1ccccc1Cl ZINC000021812283 171329663 /nfs/dbraw/zinc/32/96/63/171329663.db2.gz KTBONZIJUVCJBN-KMFMINBZSA-N 1 0 293.882 5.596 10 0 CKAERO C[C@H]([NH2+][C@H]1CCCC[C@@H]1C(C)(C)C)c1ccccc1Cl ZINC000021812284 171329638 /nfs/dbraw/zinc/32/96/38/171329638.db2.gz KTBONZIJUVCJBN-QRTARXTBSA-N 1 0 293.882 5.596 10 0 CKAERO CCCCC[NH2+][C@H](c1ccccc1)C1CCCCC1 ZINC000021812342 171329773 /nfs/dbraw/zinc/32/97/73/171329773.db2.gz GUNVPLYIAXUFII-GOSISDBHSA-N 1 0 259.437 5.088 10 0 CKAERO CCCCC[NH2+][C@@H](c1ccccc1)C1CCCCC1 ZINC000021812343 171329820 /nfs/dbraw/zinc/32/98/20/171329820.db2.gz GUNVPLYIAXUFII-SFHVURJKSA-N 1 0 259.437 5.088 10 0 CKAERO C[C@@H]([NH2+][C@@H]1CCCCc2ccccc21)c1ccccc1Cl ZINC000021812456 171329725 /nfs/dbraw/zinc/32/97/25/171329725.db2.gz MGTJDUBPAMQUMA-AUUYWEPGSA-N 1 0 299.845 5.458 10 0 CKAERO C[C@H]([NH2+][C@@H]1CCCCc2ccccc21)c1ccccc1Cl ZINC000021812457 171329770 /nfs/dbraw/zinc/32/97/70/171329770.db2.gz MGTJDUBPAMQUMA-IFXJQAMLSA-N 1 0 299.845 5.458 10 0 CKAERO C[C@@H]([NH2+][C@H]1CCCCc2ccccc21)c1ccccc1Cl ZINC000021812458 171329762 /nfs/dbraw/zinc/32/97/62/171329762.db2.gz MGTJDUBPAMQUMA-KUHUBIRLSA-N 1 0 299.845 5.458 10 0 CKAERO C[C@H]([NH2+][C@H]1CCCCc2ccccc21)c1ccccc1Cl ZINC000021812459 171329570 /nfs/dbraw/zinc/32/95/70/171329570.db2.gz MGTJDUBPAMQUMA-LIRRHRJNSA-N 1 0 299.845 5.458 10 0 CKAERO CCCC[C@@H](CC)C[NH2+][C@H](CC)c1ccc(Cl)cc1 ZINC000021812653 171330112 /nfs/dbraw/zinc/33/01/12/171330112.db2.gz LTAAZFLFNHZOID-RHSMWYFYSA-N 1 0 281.871 5.597 10 0 CKAERO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccccc2C)cc1C ZINC000021812979 171330475 /nfs/dbraw/zinc/33/04/75/171330475.db2.gz LKNJUCAJTSCXEP-SJORKVTESA-N 1 0 267.416 5.024 10 0 CKAERO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccccc2C)cc1C ZINC000021812980 171330634 /nfs/dbraw/zinc/33/06/34/171330634.db2.gz LKNJUCAJTSCXEP-IRXDYDNUSA-N 1 0 267.416 5.024 10 0 CKAERO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccccc2C)cc1C ZINC000021812981 171330666 /nfs/dbraw/zinc/33/06/66/171330666.db2.gz LKNJUCAJTSCXEP-IAGOWNOFSA-N 1 0 267.416 5.024 10 0 CKAERO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccccc2C)cc1C ZINC000021812982 171330416 /nfs/dbraw/zinc/33/04/16/171330416.db2.gz LKNJUCAJTSCXEP-DLBZAZTESA-N 1 0 267.416 5.024 10 0 CKAERO CCCCc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccccc2)cc1 ZINC000021813222 171330580 /nfs/dbraw/zinc/33/05/80/171330580.db2.gz AJYZVBBOUGWASI-DLBZAZTESA-N 1 0 281.443 5.441 10 0 CKAERO CCCCc1ccc([C@@H](C)[NH2+][C@H](C)c2ccccc2)cc1 ZINC000021813224 171330381 /nfs/dbraw/zinc/33/03/81/171330381.db2.gz AJYZVBBOUGWASI-IAGOWNOFSA-N 1 0 281.443 5.441 10 0 CKAERO CCc1ccc([C@@H]([NH2+]Cc2ccc(C)s2)C(C)C)cc1 ZINC000021813238 171330449 /nfs/dbraw/zinc/33/04/49/171330449.db2.gz WYWCPUNILMIAFA-SFHVURJKSA-N 1 0 287.472 5.106 10 0 CKAERO CCc1ccc([C@H]([NH2+]Cc2ccc(C)s2)C(C)C)cc1 ZINC000021813239 171330720 /nfs/dbraw/zinc/33/07/20/171330720.db2.gz WYWCPUNILMIAFA-GOSISDBHSA-N 1 0 287.472 5.106 10 0 CKAERO CCCCOc1ccc(C[NH2+]C[C@@H](CC)CCCC)cc1 ZINC000021813331 171330564 /nfs/dbraw/zinc/33/05/64/171330564.db2.gz ZNMWBYYDGLWRPJ-KRWDZBQOSA-N 1 0 291.479 5.172 10 0 CKAERO CCCCOc1ccc(C[NH2+]C[C@H](CC)CCCC)cc1 ZINC000021813332 171330661 /nfs/dbraw/zinc/33/06/61/171330661.db2.gz ZNMWBYYDGLWRPJ-QGZVFWFLSA-N 1 0 291.479 5.172 10 0 CKAERO C[C@@H]([NH2+][C@@H]1CCCC[C@@H]1C(C)(C)C)c1cccs1 ZINC000021813428 171331079 /nfs/dbraw/zinc/33/10/79/171331079.db2.gz QMZXFDKAPXBLGJ-HZSPNIEDSA-N 1 0 265.466 5.004 10 0 CKAERO C[C@H]([NH2+][C@@H]1CCCC[C@@H]1C(C)(C)C)c1cccs1 ZINC000021813429 171330780 /nfs/dbraw/zinc/33/07/80/171330780.db2.gz QMZXFDKAPXBLGJ-MELADBBJSA-N 1 0 265.466 5.004 10 0 CKAERO C[C@@H]([NH2+][C@H]1CCCC[C@@H]1C(C)(C)C)c1cccs1 ZINC000021813430 171330784 /nfs/dbraw/zinc/33/07/84/171330784.db2.gz QMZXFDKAPXBLGJ-RDBSUJKOSA-N 1 0 265.466 5.004 10 0 CKAERO C[C@H]([NH2+][C@H]1CCCC[C@@H]1C(C)(C)C)c1cccs1 ZINC000021813431 171330819 /nfs/dbraw/zinc/33/08/19/171330819.db2.gz QMZXFDKAPXBLGJ-IHRRRGAJSA-N 1 0 265.466 5.004 10 0 CKAERO Cc1ccc(C)c([C@H](C)[NH2+][C@H](C)c2ccccc2C)c1 ZINC000021813518 171330823 /nfs/dbraw/zinc/33/08/23/171330823.db2.gz UCRJUZLHFAKDFA-SJORKVTESA-N 1 0 267.416 5.024 10 0 CKAERO Cc1ccc(C)c([C@H](C)[NH2+][C@@H](C)c2ccccc2C)c1 ZINC000021813519 171331032 /nfs/dbraw/zinc/33/10/32/171331032.db2.gz UCRJUZLHFAKDFA-IRXDYDNUSA-N 1 0 267.416 5.024 10 0 CKAERO Cc1ccc(C)c([C@@H](C)[NH2+][C@H](C)c2ccccc2C)c1 ZINC000021813520 171330766 /nfs/dbraw/zinc/33/07/66/171330766.db2.gz UCRJUZLHFAKDFA-IAGOWNOFSA-N 1 0 267.416 5.024 10 0 CKAERO Cc1ccc(C)c([C@@H](C)[NH2+][C@@H](C)c2ccccc2C)c1 ZINC000021813521 171331074 /nfs/dbraw/zinc/33/10/74/171331074.db2.gz UCRJUZLHFAKDFA-DLBZAZTESA-N 1 0 267.416 5.024 10 0 CKAERO CC(C)CC[C@@H](C)[NH2+][C@@H]1CCCC[C@@H]1C(C)(C)C ZINC000021813644 171330992 /nfs/dbraw/zinc/33/09/92/171330992.db2.gz PCWLDGTVPIXNTM-OWCLPIDISA-N 1 0 253.474 5.006 10 0 CKAERO CC(C)CC[C@H](C)[NH2+][C@@H]1CCCC[C@@H]1C(C)(C)C ZINC000021813645 171330915 /nfs/dbraw/zinc/33/09/15/171330915.db2.gz PCWLDGTVPIXNTM-HRCADAONSA-N 1 0 253.474 5.006 10 0 CKAERO CC(C)CC[C@@H](C)[NH2+][C@H]1CCCC[C@@H]1C(C)(C)C ZINC000021813646 171331007 /nfs/dbraw/zinc/33/10/07/171331007.db2.gz PCWLDGTVPIXNTM-PMPSAXMXSA-N 1 0 253.474 5.006 10 0 CKAERO CC(C)CC[C@H](C)[NH2+][C@H]1CCCC[C@@H]1C(C)(C)C ZINC000021813647 171330971 /nfs/dbraw/zinc/33/09/71/171330971.db2.gz PCWLDGTVPIXNTM-JYJNAYRXSA-N 1 0 253.474 5.006 10 0 CKAERO CC(C)OCCC[NH2+]C1CCCCCCCCCCC1 ZINC000021813658 171330982 /nfs/dbraw/zinc/33/09/82/171330982.db2.gz ILFVDHAYOKFYPP-UHFFFAOYSA-N 1 0 283.500 5.064 10 0 CKAERO CCCC[C@@H](CC)C[NH2+][C@@H]1CCCC[C@@H]1C(C)(C)C ZINC000021813718 171330917 /nfs/dbraw/zinc/33/09/17/171330917.db2.gz UYCOFHZGWDBGEL-IXDOHACOSA-N 1 0 267.501 5.397 10 0 CKAERO CCCC[C@H](CC)C[NH2+][C@@H]1CCCC[C@@H]1C(C)(C)C ZINC000021813719 171331114 /nfs/dbraw/zinc/33/11/14/171331114.db2.gz UYCOFHZGWDBGEL-YESZJQIVSA-N 1 0 267.501 5.397 10 0 CKAERO CCCC[C@@H](CC)C[NH2+][C@H]1CCCC[C@@H]1C(C)(C)C ZINC000021813720 171330770 /nfs/dbraw/zinc/33/07/70/171330770.db2.gz UYCOFHZGWDBGEL-IKGGRYGDSA-N 1 0 267.501 5.397 10 0 CKAERO CCCC[C@H](CC)C[NH2+][C@H]1CCCC[C@@H]1C(C)(C)C ZINC000021813721 171331131 /nfs/dbraw/zinc/33/11/31/171331131.db2.gz UYCOFHZGWDBGEL-ULQDDVLXSA-N 1 0 267.501 5.397 10 0 CKAERO CCC1CCC([NH2+]CCCCCCC(C)C)CC1 ZINC000021813770 171330887 /nfs/dbraw/zinc/33/08/87/171330887.db2.gz KBBVVLVYAYETEN-UHFFFAOYSA-N 1 0 253.474 5.151 10 0 CKAERO CC(C)Cc1ccc([C@@H](C)[NH2+]C2CCCCCC2)cc1 ZINC000021813888 171331299 /nfs/dbraw/zinc/33/12/99/171331299.db2.gz QPAISQNJBBFKRB-MRXNPFEDSA-N 1 0 273.464 5.259 10 0 CKAERO CC(C)Cc1ccc([C@H](C)[NH2+]C2CCCCCC2)cc1 ZINC000021813889 171331253 /nfs/dbraw/zinc/33/12/53/171331253.db2.gz QPAISQNJBBFKRB-INIZCTEOSA-N 1 0 273.464 5.259 10 0 CKAERO CC(C)CCC[C@@H](C)[NH2+]C1CCC(C(C)(C)C)CC1 ZINC000021813931 171331323 /nfs/dbraw/zinc/33/13/23/171331323.db2.gz VEQDEKMEIRFKBE-KLAILNCOSA-N 1 0 267.501 5.396 10 0 CKAERO CC(C)CCC[C@H](C)[NH2+]C1CCC(C(C)(C)C)CC1 ZINC000021813932 171331384 /nfs/dbraw/zinc/33/13/84/171331384.db2.gz VEQDEKMEIRFKBE-GTPINHCMSA-N 1 0 267.501 5.396 10 0 CKAERO Cc1ccc(C[NH2+][C@H](C)c2ccc(Cl)c(Cl)c2)cc1 ZINC000021814038 171331430 /nfs/dbraw/zinc/33/14/30/171331430.db2.gz XOCNAGUATLFCHS-GFCCVEGCSA-N 1 0 294.225 5.153 10 0 CKAERO Cc1ccc(C[NH2+][C@@H](C)c2ccc(Cl)c(Cl)c2)cc1 ZINC000021814039 171331341 /nfs/dbraw/zinc/33/13/41/171331341.db2.gz XOCNAGUATLFCHS-LBPRGKRZSA-N 1 0 294.225 5.153 10 0 CKAERO CCc1c2ccccc2oc1[C@@H](C)[NH2+]C1CCC(C)CC1 ZINC000021814454 171331488 /nfs/dbraw/zinc/33/14/88/171331488.db2.gz QSNRADNMEIOZBL-SHARSMKWSA-N 1 0 285.431 5.225 10 0 CKAERO CCc1c2ccccc2oc1[C@H](C)[NH2+]C1CCC(C)CC1 ZINC000021814456 171331505 /nfs/dbraw/zinc/33/15/05/171331505.db2.gz QSNRADNMEIOZBL-SLTAFYQDSA-N 1 0 285.431 5.225 10 0 CKAERO Cc1ccc(C[NH2+][C@H](C)c2ccc(C(C)(C)C)cc2)cc1 ZINC000021814845 171331729 /nfs/dbraw/zinc/33/17/29/171331729.db2.gz BFRMBLBKGRTYRR-MRXNPFEDSA-N 1 0 281.443 5.143 10 0 CKAERO Cc1ccc(C[NH2+][C@@H](C)c2ccc(C(C)(C)C)cc2)cc1 ZINC000021814847 171331860 /nfs/dbraw/zinc/33/18/60/171331860.db2.gz BFRMBLBKGRTYRR-INIZCTEOSA-N 1 0 281.443 5.143 10 0 CKAERO CCCCOc1ccc(C[NH2+][C@@H](C)CCCC(C)C)cc1 ZINC000021815047 171331584 /nfs/dbraw/zinc/33/15/84/171331584.db2.gz WQBXYENMCUGZDG-KRWDZBQOSA-N 1 0 291.479 5.170 10 0 CKAERO CCCCOc1ccc(C[NH2+][C@H](C)CCCC(C)C)cc1 ZINC000021815048 171331595 /nfs/dbraw/zinc/33/15/95/171331595.db2.gz WQBXYENMCUGZDG-QGZVFWFLSA-N 1 0 291.479 5.170 10 0 CKAERO C[C@H]([NH2+][C@H]1CCCC[C@@H]1C)c1ccc(Cl)cc1Cl ZINC000021815133 171332060 /nfs/dbraw/zinc/33/20/60/171332060.db2.gz HSFMPAYXGMSUGY-PGUXBMHVSA-N 1 0 286.246 5.223 10 0 CKAERO C[C@H]([NH2+][C@@H]1CCCC[C@@H]1C)c1ccc(Cl)cc1Cl ZINC000021815137 171331908 /nfs/dbraw/zinc/33/19/08/171331908.db2.gz HSFMPAYXGMSUGY-ZIBATOQPSA-N 1 0 286.246 5.223 10 0 CKAERO CC(C)C[C@@H]([NH2+][C@@H]1CCC[C@@H](C)[C@@H]1C)c1ccccc1 ZINC000021815274 171332218 /nfs/dbraw/zinc/33/22/18/171332218.db2.gz BVJZIYHGJOOKRN-UKBAYJJMSA-N 1 0 273.464 5.188 10 0 CKAERO CC(C)C[C@H]([NH2+][C@@H]1CCC[C@@H](C)[C@@H]1C)c1ccccc1 ZINC000021815275 171332092 /nfs/dbraw/zinc/33/20/92/171332092.db2.gz BVJZIYHGJOOKRN-JFRXWTBNSA-N 1 0 273.464 5.188 10 0 CKAERO CC(C)C[C@@H]([NH2+][C@H]1CCC[C@@H](C)[C@@H]1C)c1ccccc1 ZINC000021815277 171332099 /nfs/dbraw/zinc/33/20/99/171332099.db2.gz BVJZIYHGJOOKRN-KCITZHQASA-N 1 0 273.464 5.188 10 0 CKAERO CC(C)C[C@H]([NH2+][C@H]1CCC[C@@H](C)[C@@H]1C)c1ccccc1 ZINC000021815279 171332054 /nfs/dbraw/zinc/33/20/54/171332054.db2.gz BVJZIYHGJOOKRN-NEPXVJNWSA-N 1 0 273.464 5.188 10 0 CKAERO CC(C)CCCCCC[NH2+]Cc1ccc(Cl)cc1 ZINC000021815466 171331920 /nfs/dbraw/zinc/33/19/20/171331920.db2.gz ALYMUCSIIWKYSB-UHFFFAOYSA-N 1 0 267.844 5.036 10 0 CKAERO CCC(CC)[C@@H]([NH3+])c1ccc(C(C)C)cc1C(C)C ZINC000021815636 171331862 /nfs/dbraw/zinc/33/18/62/171331862.db2.gz DUBDMZRAPMWXGQ-GOSISDBHSA-N 1 0 261.453 5.369 10 0 CKAERO CCC(CC)[C@H]([NH3+])c1ccc(C(C)C)cc1C(C)C ZINC000021815638 171331863 /nfs/dbraw/zinc/33/18/63/171331863.db2.gz DUBDMZRAPMWXGQ-SFHVURJKSA-N 1 0 261.453 5.369 10 0 CKAERO C[C@@H]([NH2+][C@@H](C)c1ccccc1Cl)c1cccc(Cl)c1 ZINC000021815679 171331865 /nfs/dbraw/zinc/33/18/65/171331865.db2.gz YALJKXVOLLGESN-NEPJUHHUSA-N 1 0 294.225 5.405 10 0 CKAERO C[C@H]([NH2+][C@@H](C)c1ccccc1Cl)c1cccc(Cl)c1 ZINC000021815681 171332189 /nfs/dbraw/zinc/33/21/89/171332189.db2.gz YALJKXVOLLGESN-RYUDHWBXSA-N 1 0 294.225 5.405 10 0 CKAERO C[C@@H]([NH2+][C@H](C)c1ccccc1Cl)c1cccc(Cl)c1 ZINC000021815683 171332048 /nfs/dbraw/zinc/33/20/48/171332048.db2.gz YALJKXVOLLGESN-VXGBXAGGSA-N 1 0 294.225 5.405 10 0 CKAERO C[C@@H]([NH2+][C@@H](C)c1cccc(Cl)c1)c1ccccc1Cl ZINC000021815684 171332136 /nfs/dbraw/zinc/33/21/36/171332136.db2.gz YALJKXVOLLGESN-NWDGAFQWSA-N 1 0 294.225 5.405 10 0 CKAERO CCC(C)(C)C1CCC([NH2+][C@@H]2CCCC[C@@H]2C)CC1 ZINC000021815777 171331949 /nfs/dbraw/zinc/33/19/49/171331949.db2.gz FEEGQQJUUBCETD-ZGRYLRDCSA-N 1 0 265.485 5.150 10 0 CKAERO CCC(C)(C)C1CCC([NH2+][C@H]2CCCC[C@@H]2C)CC1 ZINC000021815778 171331864 /nfs/dbraw/zinc/33/18/64/171331864.db2.gz FEEGQQJUUBCETD-OTBWCIGPSA-N 1 0 265.485 5.150 10 0 CKAERO CCC(C)(C)C1CCC([NH2+][C@@H]2CCCC[C@H]2C)CC1 ZINC000021815780 171332149 /nfs/dbraw/zinc/33/21/49/171332149.db2.gz FEEGQQJUUBCETD-RDHHWEPZSA-N 1 0 265.485 5.150 10 0 CKAERO CCC(C)(C)C1CCC([NH2+][C@H]2CCCC[C@H]2C)CC1 ZINC000021815782 171331954 /nfs/dbraw/zinc/33/19/54/171331954.db2.gz FEEGQQJUUBCETD-VXLLPVPCSA-N 1 0 265.485 5.150 10 0 CKAERO Cc1ccccc1[C@@H](C)[NH2+]Cc1cccc(Cl)c1Cl ZINC000021816219 171332351 /nfs/dbraw/zinc/33/23/51/171332351.db2.gz KLAUIQMCHMLSDK-GFCCVEGCSA-N 1 0 294.225 5.153 10 0 CKAERO Cc1ccccc1[C@H](C)[NH2+]Cc1cccc(Cl)c1Cl ZINC000021816221 171332463 /nfs/dbraw/zinc/33/24/63/171332463.db2.gz KLAUIQMCHMLSDK-LBPRGKRZSA-N 1 0 294.225 5.153 10 0 CKAERO C[C@@H](CCc1ccccc1)[NH2+][C@@H]1CCCC[C@@H]1C(C)(C)C ZINC000021816402 171332435 /nfs/dbraw/zinc/33/24/35/171332435.db2.gz ONQGAPGAOOIVLL-YTQUADARSA-N 1 0 287.491 5.202 10 0 CKAERO C[C@H](CCc1ccccc1)[NH2+][C@@H]1CCCC[C@@H]1C(C)(C)C ZINC000021816404 171332565 /nfs/dbraw/zinc/33/25/65/171332565.db2.gz ONQGAPGAOOIVLL-NZSAHSFTSA-N 1 0 287.491 5.202 10 0 CKAERO C[C@@H](CCc1ccccc1)[NH2+][C@H]1CCCC[C@@H]1C(C)(C)C ZINC000021816406 171332582 /nfs/dbraw/zinc/33/25/82/171332582.db2.gz ONQGAPGAOOIVLL-WDSOQIARSA-N 1 0 287.491 5.202 10 0 CKAERO C[C@H](CCc1ccccc1)[NH2+][C@H]1CCCC[C@@H]1C(C)(C)C ZINC000021816408 171332355 /nfs/dbraw/zinc/33/23/55/171332355.db2.gz ONQGAPGAOOIVLL-NEWSRXKRSA-N 1 0 287.491 5.202 10 0 CKAERO C[C@@H]([NH2+][C@@H]1CCCc2ccccc21)c1ccccc1Cl ZINC000021816426 171332404 /nfs/dbraw/zinc/33/24/04/171332404.db2.gz RHEGHVJTISZIQK-FZKQIMNGSA-N 1 0 285.818 5.068 10 0 CKAERO C[C@H]([NH2+][C@@H]1CCCc2ccccc21)c1ccccc1Cl ZINC000021816427 171332321 /nfs/dbraw/zinc/33/23/21/171332321.db2.gz RHEGHVJTISZIQK-SCLBCKFNSA-N 1 0 285.818 5.068 10 0 CKAERO C[C@@H]([NH2+][C@H]1CCCc2ccccc21)c1ccccc1Cl ZINC000021816429 171332420 /nfs/dbraw/zinc/33/24/20/171332420.db2.gz RHEGHVJTISZIQK-ACJLOTCBSA-N 1 0 285.818 5.068 10 0 CKAERO C[C@H]([NH2+][C@H]1CCCc2ccccc21)c1ccccc1Cl ZINC000021816431 171332280 /nfs/dbraw/zinc/33/22/80/171332280.db2.gz RHEGHVJTISZIQK-UGSOOPFHSA-N 1 0 285.818 5.068 10 0 CKAERO CCc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccccc2Cl)cc1 ZINC000021816434 171332374 /nfs/dbraw/zinc/33/23/74/171332374.db2.gz ITNIRPVNVQNHKL-KGLIPLIRSA-N 1 0 287.834 5.314 10 0 CKAERO CCc1ccc([C@H](C)[NH2+][C@@H](C)c2ccccc2Cl)cc1 ZINC000021816436 171332417 /nfs/dbraw/zinc/33/24/17/171332417.db2.gz ITNIRPVNVQNHKL-KBPBESRZSA-N 1 0 287.834 5.314 10 0 CKAERO CCc1ccc([C@@H](C)[NH2+][C@H](C)c2ccccc2Cl)cc1 ZINC000021816438 171332475 /nfs/dbraw/zinc/33/24/75/171332475.db2.gz ITNIRPVNVQNHKL-ZIAGYGMSSA-N 1 0 287.834 5.314 10 0 CKAERO CCc1ccc([C@H](C)[NH2+][C@H](C)c2ccccc2Cl)cc1 ZINC000021816440 171332297 /nfs/dbraw/zinc/33/22/97/171332297.db2.gz ITNIRPVNVQNHKL-UONOGXRCSA-N 1 0 287.834 5.314 10 0 CKAERO CCC(C)(C)C1CCC([NH2+][C@@H](C)c2ccccc2C)CC1 ZINC000021816618 171332356 /nfs/dbraw/zinc/33/23/56/171332356.db2.gz HLTVNKCZZIPIPY-AOCRQIFASA-N 1 0 287.491 5.641 10 0 CKAERO CCC(C)(C)C1CCC([NH2+][C@H](C)c2ccccc2C)CC1 ZINC000021816620 171332607 /nfs/dbraw/zinc/33/26/07/171332607.db2.gz HLTVNKCZZIPIPY-WWDZGPRUSA-N 1 0 287.491 5.641 10 0 CKAERO C[C@H]([NH2+]C1CCC(C)CC1)c1cccc2ccccc21 ZINC000021816757 171332992 /nfs/dbraw/zinc/33/29/92/171332992.db2.gz KDKOFUFATIHDFF-CKDBGZEDSA-N 1 0 267.416 5.069 10 0 CKAERO C[C@@H]([NH2+]C1CCC(C)CC1)c1cccc2ccccc21 ZINC000021816759 171332745 /nfs/dbraw/zinc/33/27/45/171332745.db2.gz KDKOFUFATIHDFF-ISXOHVOVSA-N 1 0 267.416 5.069 10 0 CKAERO Cc1ccc([C@H](C)[NH2+][C@H](C)c2cccc(Cl)c2)c(C)c1 ZINC000021816837 171333038 /nfs/dbraw/zinc/33/30/38/171333038.db2.gz BYBAZYCYPJABFE-CABCVRRESA-N 1 0 287.834 5.369 10 0 CKAERO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2cccc(Cl)c2)c(C)c1 ZINC000021816838 171332899 /nfs/dbraw/zinc/33/28/99/171332899.db2.gz BYBAZYCYPJABFE-GJZGRUSLSA-N 1 0 287.834 5.369 10 0 CKAERO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2cccc(Cl)c2)c(C)c1 ZINC000021816840 171332911 /nfs/dbraw/zinc/33/29/11/171332911.db2.gz BYBAZYCYPJABFE-HUUCEWRRSA-N 1 0 287.834 5.369 10 0 CKAERO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2cccc(Cl)c2)c(C)c1 ZINC000021816842 171332848 /nfs/dbraw/zinc/33/28/48/171332848.db2.gz BYBAZYCYPJABFE-LSDHHAIUSA-N 1 0 287.834 5.369 10 0 CKAERO Cc1ccccc1[C@@H](C)[NH2+]Cc1ccc(C(C)(C)C)cc1 ZINC000021816997 171332957 /nfs/dbraw/zinc/33/29/57/171332957.db2.gz PFLVNPZDKUJHBK-MRXNPFEDSA-N 1 0 281.443 5.143 10 0 CKAERO Cc1ccccc1[C@H](C)[NH2+]Cc1ccc(C(C)(C)C)cc1 ZINC000021816999 171332840 /nfs/dbraw/zinc/33/28/40/171332840.db2.gz PFLVNPZDKUJHBK-INIZCTEOSA-N 1 0 281.443 5.143 10 0 CKAERO Cc1ccc(C)c([C@H](C)[NH2+][C@H](C)c2cccc(Cl)c2)c1 ZINC000021817021 171332944 /nfs/dbraw/zinc/33/29/44/171332944.db2.gz IRMDSQCSCGEJGC-CABCVRRESA-N 1 0 287.834 5.369 10 0 CKAERO Cc1ccc(C)c([C@H](C)[NH2+][C@@H](C)c2cccc(Cl)c2)c1 ZINC000021817023 171333029 /nfs/dbraw/zinc/33/30/29/171333029.db2.gz IRMDSQCSCGEJGC-GJZGRUSLSA-N 1 0 287.834 5.369 10 0 CKAERO Cc1ccc(C)c([C@@H](C)[NH2+][C@H](C)c2cccc(Cl)c2)c1 ZINC000021817024 171332928 /nfs/dbraw/zinc/33/29/28/171332928.db2.gz IRMDSQCSCGEJGC-HUUCEWRRSA-N 1 0 287.834 5.369 10 0 CKAERO Cc1ccc(C)c([C@@H](C)[NH2+][C@@H](C)c2cccc(Cl)c2)c1 ZINC000021817026 171332784 /nfs/dbraw/zinc/33/27/84/171332784.db2.gz IRMDSQCSCGEJGC-LSDHHAIUSA-N 1 0 287.834 5.369 10 0 CKAERO CC(C)CC[C@@H](C)[NH2+][C@@H](C)c1ccc(Cl)cc1Cl ZINC000021817253 171333045 /nfs/dbraw/zinc/33/30/45/171333045.db2.gz ZNYWBEXQGIJGAB-NEPJUHHUSA-N 1 0 288.262 5.469 10 0 CKAERO CC(C)CC[C@H](C)[NH2+][C@@H](C)c1ccc(Cl)cc1Cl ZINC000021817254 171332995 /nfs/dbraw/zinc/33/29/95/171332995.db2.gz ZNYWBEXQGIJGAB-RYUDHWBXSA-N 1 0 288.262 5.469 10 0 CKAERO CC(C)CC[C@@H](C)[NH2+][C@H](C)c1ccc(Cl)cc1Cl ZINC000021817256 171333003 /nfs/dbraw/zinc/33/30/03/171333003.db2.gz ZNYWBEXQGIJGAB-VXGBXAGGSA-N 1 0 288.262 5.469 10 0 CKAERO CC(C)CC[C@H](C)[NH2+][C@H](C)c1ccc(Cl)cc1Cl ZINC000021817257 171333025 /nfs/dbraw/zinc/33/30/25/171333025.db2.gz ZNYWBEXQGIJGAB-NWDGAFQWSA-N 1 0 288.262 5.469 10 0 CKAERO C[C@@H]([NH2+]Cc1ccc(-c2ccccc2)cc1)c1cccs1 ZINC000021817343 171332807 /nfs/dbraw/zinc/33/28/07/171332807.db2.gz QFTPDWBBYMBBNO-OAHLLOKOSA-N 1 0 293.435 5.266 10 0 CKAERO C[C@H]([NH2+]Cc1ccc(-c2ccccc2)cc1)c1cccs1 ZINC000021817344 171332966 /nfs/dbraw/zinc/33/29/66/171332966.db2.gz QFTPDWBBYMBBNO-HNNXBMFYSA-N 1 0 293.435 5.266 10 0 CKAERO CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1[NH2+][C@@H](C)c1ccccc1Cl ZINC000021817863 171333473 /nfs/dbraw/zinc/33/34/73/171333473.db2.gz KDRJJDSHBXDOPF-LLDVTBCESA-N 1 0 293.882 5.451 10 0 CKAERO CC(C)[C@@H]1CC[C@H](C)C[C@@H]1[NH2+][C@@H](C)c1ccccc1Cl ZINC000021817864 171333300 /nfs/dbraw/zinc/33/33/00/171333300.db2.gz KDRJJDSHBXDOPF-XSWJXKHESA-N 1 0 293.882 5.451 10 0 CKAERO CC(C)[C@H]1CC[C@@H](C)C[C@@H]1[NH2+][C@@H](C)c1ccccc1Cl ZINC000021817866 171333286 /nfs/dbraw/zinc/33/32/86/171333286.db2.gz KDRJJDSHBXDOPF-FSZRXZPDSA-N 1 0 293.882 5.451 10 0 CKAERO CC(C)[C@H]1CC[C@H](C)C[C@@H]1[NH2+][C@@H](C)c1ccccc1Cl ZINC000021817868 171333330 /nfs/dbraw/zinc/33/33/30/171333330.db2.gz KDRJJDSHBXDOPF-AFIMGQEJSA-N 1 0 293.882 5.451 10 0 CKAERO c1ccc2c(c1)-c1ccccc1C2[NH2+]C1CCCCCC1 ZINC000021818262 171333249 /nfs/dbraw/zinc/33/32/49/171333249.db2.gz GVRQOEXSADKJTP-UHFFFAOYSA-N 1 0 277.411 5.069 10 0 CKAERO CCCC[C@@H](CC)C[NH2+]C1CCC(C(C)(C)C)CC1 ZINC000021818408 171333628 /nfs/dbraw/zinc/33/36/28/171333628.db2.gz LBJNJIPLNPAJNY-KLAILNCOSA-N 1 0 267.501 5.397 10 0 CKAERO CCCC[C@H](CC)C[NH2+]C1CCC(C(C)(C)C)CC1 ZINC000021818410 171333907 /nfs/dbraw/zinc/33/39/07/171333907.db2.gz LBJNJIPLNPAJNY-GTPINHCMSA-N 1 0 267.501 5.397 10 0 CKAERO CC(C)Cc1ccc([C@@H](C)[NH2+]C2CCCCCCC2)cc1 ZINC000021818557 171333626 /nfs/dbraw/zinc/33/36/26/171333626.db2.gz WXBOFWYCSSLRTG-QGZVFWFLSA-N 1 0 287.491 5.649 10 0 CKAERO CC(C)Cc1ccc([C@H](C)[NH2+]C2CCCCCCC2)cc1 ZINC000021818559 171333634 /nfs/dbraw/zinc/33/36/34/171333634.db2.gz WXBOFWYCSSLRTG-KRWDZBQOSA-N 1 0 287.491 5.649 10 0 CKAERO C[C@@H]([NH2+]C[C@H]1CC=CCC1)c1ccc(Cl)cc1Cl ZINC000021818803 171333636 /nfs/dbraw/zinc/33/36/36/171333636.db2.gz XHHKETDDPVRYOR-NEPJUHHUSA-N 1 0 284.230 5.000 10 0 CKAERO C[C@H]([NH2+]C[C@H]1CC=CCC1)c1ccc(Cl)cc1Cl ZINC000021818805 171333807 /nfs/dbraw/zinc/33/38/07/171333807.db2.gz XHHKETDDPVRYOR-RYUDHWBXSA-N 1 0 284.230 5.000 10 0 CKAERO C[C@@H]([NH2+]C[C@@H]1CC=CCC1)c1ccc(Cl)cc1Cl ZINC000021818807 171333882 /nfs/dbraw/zinc/33/38/82/171333882.db2.gz XHHKETDDPVRYOR-VXGBXAGGSA-N 1 0 284.230 5.000 10 0 CKAERO C[C@H]([NH2+]C[C@@H]1CC=CCC1)c1ccc(Cl)cc1Cl ZINC000021818809 171333603 /nfs/dbraw/zinc/33/36/03/171333603.db2.gz XHHKETDDPVRYOR-NWDGAFQWSA-N 1 0 284.230 5.000 10 0 CKAERO CC(C)CC(CC(C)C)[NH2+][C@@H](C)c1ccccc1Cl ZINC000021819520 171334052 /nfs/dbraw/zinc/33/40/52/171334052.db2.gz FCUXBMHKVLWTOY-AWEZNQCLSA-N 1 0 281.871 5.451 10 0 CKAERO CC(C)CC(CC(C)C)[NH2+][C@H](C)c1ccccc1Cl ZINC000021819522 171334200 /nfs/dbraw/zinc/33/42/00/171334200.db2.gz FCUXBMHKVLWTOY-CQSZACIVSA-N 1 0 281.871 5.451 10 0 CKAERO Cc1ccc(Oc2ccc([C@@H](C)[NH3+])cc2)c(C(C)(C)C)c1 ZINC000021819547 171334214 /nfs/dbraw/zinc/33/42/14/171334214.db2.gz GFTOGJXKATXKAH-CQSZACIVSA-N 1 0 283.415 5.105 10 0 CKAERO Cc1ccc(Oc2ccc([C@H](C)[NH3+])cc2)c(C(C)(C)C)c1 ZINC000021819549 171334128 /nfs/dbraw/zinc/33/41/28/171334128.db2.gz GFTOGJXKATXKAH-AWEZNQCLSA-N 1 0 283.415 5.105 10 0 CKAERO CCC[C@@H]([NH2+]C1CCCCCCC1)c1ccccc1 ZINC000021819622 171334177 /nfs/dbraw/zinc/33/41/77/171334177.db2.gz BYZFSSULBHBYSN-GOSISDBHSA-N 1 0 259.437 5.230 10 0 CKAERO CCC[C@H]([NH2+]C1CCCCCCC1)c1ccccc1 ZINC000021819624 171334184 /nfs/dbraw/zinc/33/41/84/171334184.db2.gz BYZFSSULBHBYSN-SFHVURJKSA-N 1 0 259.437 5.230 10 0 CKAERO CCC(C)(C)c1ccc(Oc2ccccc2[C@@H](C)[NH3+])cc1 ZINC000021819760 171334123 /nfs/dbraw/zinc/33/41/23/171334123.db2.gz RGKNHIXYWKAWFM-CQSZACIVSA-N 1 0 283.415 5.186 10 0 CKAERO CCC(C)(C)c1ccc(Oc2ccccc2[C@H](C)[NH3+])cc1 ZINC000021819762 171333979 /nfs/dbraw/zinc/33/39/79/171333979.db2.gz RGKNHIXYWKAWFM-AWEZNQCLSA-N 1 0 283.415 5.186 10 0 CKAERO CC[C@@H](C)C[C@@H](CC)[NH2+][C@@H](C)C12CC3CC(CC(C3)C1)C2 ZINC000022147214 171357350 /nfs/dbraw/zinc/35/73/50/171357350.db2.gz LOBGEDBKYGSTPC-HYCCEDHASA-N 1 0 291.523 5.396 10 0 CKAERO CC[C@H](C[C@@H](C)CC)[NH2+][C@@H](C)C12CC3CC(CC(C3)C1)C2 ZINC000022147217 171357092 /nfs/dbraw/zinc/35/70/92/171357092.db2.gz LOBGEDBKYGSTPC-YUOJLFPQSA-N 1 0 291.523 5.396 10 0 CKAERO CC[C@@H](C)C[C@H](CC)[NH2+][C@@H](C)C12CC3CC(CC(C3)C1)C2 ZINC000022147221 171357324 /nfs/dbraw/zinc/35/73/24/171357324.db2.gz LOBGEDBKYGSTPC-YJDFPITGSA-N 1 0 291.523 5.396 10 0 CKAERO CC[C@H](C)C[C@H](CC)[NH2+][C@@H](C)C12CC3CC(CC(C3)C1)C2 ZINC000022147224 171357177 /nfs/dbraw/zinc/35/71/77/171357177.db2.gz LOBGEDBKYGSTPC-FGMWCOEWSA-N 1 0 291.523 5.396 10 0 CKAERO CC[C@@H](C)C[C@@H](CC)[NH2+]CCCCCCC(C)C ZINC000022147720 171357346 /nfs/dbraw/zinc/35/73/46/171357346.db2.gz PBZFUTKLIZAKNH-IAGOWNOFSA-N 1 0 255.490 5.397 10 0 CKAERO CC[C@H](C[C@@H](C)CC)[NH2+]CCCCCCC(C)C ZINC000022147725 171357387 /nfs/dbraw/zinc/35/73/87/171357387.db2.gz PBZFUTKLIZAKNH-DLBZAZTESA-N 1 0 255.490 5.397 10 0 CKAERO CC[C@@H](C)C[C@H](CC)[NH2+]CCCCCCC(C)C ZINC000022147728 171357335 /nfs/dbraw/zinc/35/73/35/171357335.db2.gz PBZFUTKLIZAKNH-SJORKVTESA-N 1 0 255.490 5.397 10 0 CKAERO CC[C@H](C)C[C@H](CC)[NH2+]CCCCCCC(C)C ZINC000022147732 171357300 /nfs/dbraw/zinc/35/73/00/171357300.db2.gz PBZFUTKLIZAKNH-IRXDYDNUSA-N 1 0 255.490 5.397 10 0 CKAERO CC(C)CC(CC(C)C)[NH2+][C@@H](C)c1cccc(Cl)c1 ZINC000022148416 171357636 /nfs/dbraw/zinc/35/76/36/171357636.db2.gz JMMOPMNBEFILHT-AWEZNQCLSA-N 1 0 281.871 5.451 10 0 CKAERO CC(C)CC(CC(C)C)[NH2+][C@H](C)c1cccc(Cl)c1 ZINC000022148420 171357577 /nfs/dbraw/zinc/35/75/77/171357577.db2.gz JMMOPMNBEFILHT-CQSZACIVSA-N 1 0 281.871 5.451 10 0 CKAERO C[C@@H]([NH2+][C@@H]1CCCc2ccccc21)c1cccc(Cl)c1 ZINC000022148591 171357724 /nfs/dbraw/zinc/35/77/24/171357724.db2.gz PSOXWEMHUAXDSR-FZKQIMNGSA-N 1 0 285.818 5.068 10 0 CKAERO C[C@H]([NH2+][C@@H]1CCCc2ccccc21)c1cccc(Cl)c1 ZINC000022148594 171357691 /nfs/dbraw/zinc/35/76/91/171357691.db2.gz PSOXWEMHUAXDSR-SCLBCKFNSA-N 1 0 285.818 5.068 10 0 CKAERO C[C@@H]([NH2+][C@H]1CCCc2ccccc21)c1cccc(Cl)c1 ZINC000022148598 171357569 /nfs/dbraw/zinc/35/75/69/171357569.db2.gz PSOXWEMHUAXDSR-ACJLOTCBSA-N 1 0 285.818 5.068 10 0 CKAERO C[C@H]([NH2+][C@H]1CCCc2ccccc21)c1cccc(Cl)c1 ZINC000022148602 171357574 /nfs/dbraw/zinc/35/75/74/171357574.db2.gz PSOXWEMHUAXDSR-UGSOOPFHSA-N 1 0 285.818 5.068 10 0 CKAERO CC[C@@H](C)c1ccccc1Oc1ccc([C@@H](C)[NH3+])cc1F ZINC000022149098 171358110 /nfs/dbraw/zinc/35/81/10/171358110.db2.gz IPQREDYODFQFEC-CHWSQXEVSA-N 1 0 287.378 5.151 10 0 CKAERO CC[C@H](C)c1ccccc1Oc1ccc([C@@H](C)[NH3+])cc1F ZINC000022149102 171358058 /nfs/dbraw/zinc/35/80/58/171358058.db2.gz IPQREDYODFQFEC-QWHCGFSZSA-N 1 0 287.378 5.151 10 0 CKAERO CC[C@@H](C)c1ccccc1Oc1ccc([C@H](C)[NH3+])cc1F ZINC000022149105 171357954 /nfs/dbraw/zinc/35/79/54/171357954.db2.gz IPQREDYODFQFEC-OLZOCXBDSA-N 1 0 287.378 5.151 10 0 CKAERO CC[C@H](C)c1ccccc1Oc1ccc([C@H](C)[NH3+])cc1F ZINC000022149108 171357859 /nfs/dbraw/zinc/35/78/59/171357859.db2.gz IPQREDYODFQFEC-STQMWFEESA-N 1 0 287.378 5.151 10 0 CKAERO CC(C)(C)C1CCC([NH2+]CCc2ccc(Cl)cc2)CC1 ZINC000022149822 171358074 /nfs/dbraw/zinc/35/80/74/171358074.db2.gz PNISAUUXYCRLJR-UHFFFAOYSA-N 1 0 293.882 5.077 10 0 CKAERO CC(C)CCC[C@@H](C)[NH2+]C1CCC(c2ccccc2)CC1 ZINC000022150015 171358283 /nfs/dbraw/zinc/35/82/83/171358283.db2.gz BDFXRKZEOPKGCW-QHGAOEGBSA-N 1 0 287.491 5.517 10 0 CKAERO CC(C)CCC[C@H](C)[NH2+]C1CCC(c2ccccc2)CC1 ZINC000022150018 171358250 /nfs/dbraw/zinc/35/82/50/171358250.db2.gz BDFXRKZEOPKGCW-KKXNLOMOSA-N 1 0 287.491 5.517 10 0 CKAERO CC(C)(C)C1CCC([NH2+]Cc2ccccc2Cl)CC1 ZINC000022150045 171358311 /nfs/dbraw/zinc/35/83/11/171358311.db2.gz OTWJZXSMXIWLFA-UHFFFAOYSA-N 1 0 279.855 5.035 10 0 CKAERO c1coc([C@@H]([NH2+]C2CCCCCCC2)c2ccccc2)c1 ZINC000022150300 171358303 /nfs/dbraw/zinc/35/83/03/171358303.db2.gz HDOYZQACXVBKMD-IBGZPJMESA-N 1 0 283.415 5.072 10 0 CKAERO c1coc([C@H]([NH2+]C2CCCCCCC2)c2ccccc2)c1 ZINC000022150304 171358205 /nfs/dbraw/zinc/35/82/05/171358205.db2.gz HDOYZQACXVBKMD-LJQANCHMSA-N 1 0 283.415 5.072 10 0 CKAERO Cc1cc([C@H](C)[NH2+][C@H](C)c2cccc(Cl)c2)c(C)s1 ZINC000022151310 171358553 /nfs/dbraw/zinc/35/85/53/171358553.db2.gz CKOHKNJTISCHTJ-NEPJUHHUSA-N 1 0 293.863 5.430 10 0 CKAERO Cc1cc([C@H](C)[NH2+][C@@H](C)c2cccc(Cl)c2)c(C)s1 ZINC000022151314 171358629 /nfs/dbraw/zinc/35/86/29/171358629.db2.gz CKOHKNJTISCHTJ-RYUDHWBXSA-N 1 0 293.863 5.430 10 0 CKAERO Cc1cc([C@@H](C)[NH2+][C@H](C)c2cccc(Cl)c2)c(C)s1 ZINC000022151318 171358535 /nfs/dbraw/zinc/35/85/35/171358535.db2.gz CKOHKNJTISCHTJ-VXGBXAGGSA-N 1 0 293.863 5.430 10 0 CKAERO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2cccc(Cl)c2)c(C)s1 ZINC000022151322 171358399 /nfs/dbraw/zinc/35/83/99/171358399.db2.gz CKOHKNJTISCHTJ-NWDGAFQWSA-N 1 0 293.863 5.430 10 0 CKAERO Cc1ccc(C(C)C)c(Oc2cccc(F)c2[C@@H](C)[NH3+])c1 ZINC000022151582 171358842 /nfs/dbraw/zinc/35/88/42/171358842.db2.gz HWZIOZVKFGDWAB-CYBMUJFWSA-N 1 0 287.378 5.070 10 0 CKAERO Cc1ccc(C(C)C)c(Oc2cccc(F)c2[C@H](C)[NH3+])c1 ZINC000022151586 171359276 /nfs/dbraw/zinc/35/92/76/171359276.db2.gz HWZIOZVKFGDWAB-ZDUSSCGKSA-N 1 0 287.378 5.070 10 0 CKAERO C[C@H]([NH2+]C1CCC(C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000022152205 171359496 /nfs/dbraw/zinc/35/94/96/171359496.db2.gz NBOIXGPHEVTLSS-AKJDGMEZSA-N 1 0 286.246 5.223 10 0 CKAERO C[C@@H]([NH2+]C1CCC(C)CC1)c1ccc(Cl)c(Cl)c1 ZINC000022152209 171359783 /nfs/dbraw/zinc/35/97/83/171359783.db2.gz NBOIXGPHEVTLSS-QWKFWESOSA-N 1 0 286.246 5.223 10 0 CKAERO C[C@@H]([NH2+][C@@H](C)c1ccccc1Cl)c1ccc(Cl)cc1 ZINC000022152485 171359710 /nfs/dbraw/zinc/35/97/10/171359710.db2.gz GHKCQAPYTMOBDU-NEPJUHHUSA-N 1 0 294.225 5.405 10 0 CKAERO C[C@H]([NH2+][C@@H](C)c1ccccc1Cl)c1ccc(Cl)cc1 ZINC000022152488 171359561 /nfs/dbraw/zinc/35/95/61/171359561.db2.gz GHKCQAPYTMOBDU-RYUDHWBXSA-N 1 0 294.225 5.405 10 0 CKAERO C[C@@H]([NH2+][C@H](C)c1ccccc1Cl)c1ccc(Cl)cc1 ZINC000022152491 171359602 /nfs/dbraw/zinc/35/96/02/171359602.db2.gz GHKCQAPYTMOBDU-VXGBXAGGSA-N 1 0 294.225 5.405 10 0 CKAERO C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1)c1ccccc1Cl ZINC000022152494 171359401 /nfs/dbraw/zinc/35/94/01/171359401.db2.gz GHKCQAPYTMOBDU-NWDGAFQWSA-N 1 0 294.225 5.405 10 0 CKAERO C[C@@H]([NH2+]C1CCCCCCC1)C12CC3CC(CC(C3)C1)C2 ZINC000022152815 171360089 /nfs/dbraw/zinc/36/00/89/171360089.db2.gz AOXHGGGNZKGLEI-HWWITLHISA-N 1 0 289.507 5.294 10 0 CKAERO C[C@H]([NH2+]C1CCCCCCC1)C12CC3CC(CC(C3)C1)C2 ZINC000022152818 171359992 /nfs/dbraw/zinc/35/99/92/171359992.db2.gz AOXHGGGNZKGLEI-CCLIWJKGSA-N 1 0 289.507 5.294 10 0 CKAERO CC(C)CC(CC(C)C)[NH2+][C@@H](C)c1ccc(Cl)cc1 ZINC000022153221 171360123 /nfs/dbraw/zinc/36/01/23/171360123.db2.gz BJZZLHZTPOATLD-AWEZNQCLSA-N 1 0 281.871 5.451 10 0 CKAERO CC(C)CC(CC(C)C)[NH2+][C@H](C)c1ccc(Cl)cc1 ZINC000022153225 171360392 /nfs/dbraw/zinc/36/03/92/171360392.db2.gz BJZZLHZTPOATLD-CQSZACIVSA-N 1 0 281.871 5.451 10 0 CKAERO CCCCC[NH2+][C@@H](c1ccccc1)c1cc(C)ccc1C ZINC000022153498 171360946 /nfs/dbraw/zinc/36/09/46/171360946.db2.gz UKNJSRIMKOPONQ-FQEVSTJZSA-N 1 0 281.443 5.173 10 0 CKAERO CCCCC[NH2+][C@H](c1ccccc1)c1cc(C)ccc1C ZINC000022153502 171360924 /nfs/dbraw/zinc/36/09/24/171360924.db2.gz UKNJSRIMKOPONQ-HXUWFJFHSA-N 1 0 281.443 5.173 10 0 CKAERO C(C[NH2+]C1CCCCCCCCCCC1)COCC1CC1 ZINC000022153553 171360834 /nfs/dbraw/zinc/36/08/34/171360834.db2.gz ICJYEYFKZPUUPH-UHFFFAOYSA-N 1 0 295.511 5.066 10 0 CKAERO CC(C)CCC[C@@H](C)[NH2+]Cc1ccccc1C(F)(F)F ZINC000022153571 171360599 /nfs/dbraw/zinc/36/05/99/171360599.db2.gz DVSNCSRGWVGPRZ-CYBMUJFWSA-N 1 0 287.369 5.010 10 0 CKAERO CC(C)CCC[C@H](C)[NH2+]Cc1ccccc1C(F)(F)F ZINC000022153574 171360481 /nfs/dbraw/zinc/36/04/81/171360481.db2.gz DVSNCSRGWVGPRZ-ZDUSSCGKSA-N 1 0 287.369 5.010 10 0 CKAERO CCCCC1CCC([C@@H]([NH3+])c2ccc(Cl)cc2)CC1 ZINC000022153714 171360559 /nfs/dbraw/zinc/36/05/59/171360559.db2.gz BZNVJPFWMOWYQP-MQBCKMQZSA-N 1 0 279.855 5.336 10 0 CKAERO CCCCC1CCC([C@H]([NH3+])c2ccc(Cl)cc2)CC1 ZINC000022153718 171360494 /nfs/dbraw/zinc/36/04/94/171360494.db2.gz BZNVJPFWMOWYQP-KVULBXGLSA-N 1 0 279.855 5.336 10 0 CKAERO CCCC[N@H+](CC)CCC[C@@H]1CCCc2ccccc21 ZINC000027982820 171541881 /nfs/dbraw/zinc/54/18/81/171541881.db2.gz WLBZHVYQXDLEBH-SFHVURJKSA-N 1 0 273.464 5.009 10 0 CKAERO C[NH2+][C@@H](C)c1ccccc1Oc1ccc(Cl)cc1Cl ZINC000034666081 171854353 /nfs/dbraw/zinc/85/43/53/171854353.db2.gz IJAJIEUMSRXUML-JTQLQIEISA-N 1 0 296.197 5.066 10 0 CKAERO CC(C)[NH2+]Cc1ccc(-c2ccccc2C(C)C)s1 ZINC000034670665 171856772 /nfs/dbraw/zinc/85/67/72/171856772.db2.gz ZJSDAXNIVLWOHZ-UHFFFAOYSA-N 1 0 273.445 5.037 10 0 CKAERO CCC[NH2+]Cc1ccc(-c2ccccc2C(C)C)s1 ZINC000034670666 171856784 /nfs/dbraw/zinc/85/67/84/171856784.db2.gz NPYSNZZJQONYTR-UHFFFAOYSA-N 1 0 273.445 5.038 10 0 CKAERO CC[NH2+][C@H](CC)c1ccc(-c2ccccc2Cl)s1 ZINC000034671174 171856837 /nfs/dbraw/zinc/85/68/37/171856837.db2.gz HDVGRNICKQVOMR-CYBMUJFWSA-N 1 0 279.836 5.129 10 0 CKAERO CCC[NH2+][C@H](CC)c1ccc(-c2ccc(C)cc2)s1 ZINC000034671222 171857092 /nfs/dbraw/zinc/85/70/92/171857092.db2.gz RTSAICGNYZKLFO-OAHLLOKOSA-N 1 0 273.445 5.174 10 0 CKAERO CC[NH2+][C@@H](C)c1ccc(-c2ccc(C)c(Cl)c2)s1 ZINC000034671286 171857356 /nfs/dbraw/zinc/85/73/56/171857356.db2.gz VOQQPWFCDXPJEC-NSHDSACASA-N 1 0 279.836 5.047 10 0 CKAERO CC[NH2+][C@H](C)c1ccc(-c2ccc(C)c(Cl)c2)s1 ZINC000034671288 171857098 /nfs/dbraw/zinc/85/70/98/171857098.db2.gz VOQQPWFCDXPJEC-LLVKDONJSA-N 1 0 279.836 5.047 10 0 CKAERO CC[NH2+][C@@H](C)c1ccc(-c2cc(Cl)ccc2C)s1 ZINC000034671418 171857298 /nfs/dbraw/zinc/85/72/98/171857298.db2.gz VCSHBIWKWAHMLZ-NSHDSACASA-N 1 0 279.836 5.047 10 0 CKAERO CC[NH2+][C@H](C)c1ccc(-c2cccc(C(C)C)c2)s1 ZINC000034671534 171857326 /nfs/dbraw/zinc/85/73/26/171857326.db2.gz UHUUQDOOIDFSQR-CYBMUJFWSA-N 1 0 273.445 5.209 10 0 CKAERO CCC[C@H]([NH2+]C)c1ccc(-c2ccc(CC)cc2)s1 ZINC000034671992 171857696 /nfs/dbraw/zinc/85/76/96/171857696.db2.gz GOKILTZHTMZDDE-HNNXBMFYSA-N 1 0 273.445 5.038 10 0 CKAERO CCC[NH2+][C@@H](C)c1ccc(-c2ccc(CC)cc2)s1 ZINC000034672007 171857718 /nfs/dbraw/zinc/85/77/18/171857718.db2.gz CBBLKQJGXHEJIV-ZDUSSCGKSA-N 1 0 273.445 5.038 10 0 CKAERO CCC[C@@H]([NH2+]C)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000034672132 171857863 /nfs/dbraw/zinc/85/78/63/171857863.db2.gz UCTPCOWOYPJUQU-CYBMUJFWSA-N 1 0 279.836 5.129 10 0 CKAERO CC[C@@H]([NH2+]C)c1ccc(-c2cccc(Cl)c2C)s1 ZINC000034672184 171857919 /nfs/dbraw/zinc/85/79/19/171857919.db2.gz ZJBTUTINCMAMOY-CYBMUJFWSA-N 1 0 279.836 5.047 10 0 CKAERO CC[C@H]([NH2+]C)c1ccc(-c2ccc(C)cc2Cl)s1 ZINC000034672237 517826228 /nfs/dbraw/zinc/82/62/28/517826228.db2.gz MBXUTVCMKOYQHR-ZDUSSCGKSA-N 1 0 279.836 5.047 10 0 CKAERO CC[C@@H]([NH2+]C)c1ccc(-c2ccc(C)cc2Cl)s1 ZINC000034672239 171858068 /nfs/dbraw/zinc/85/80/68/171858068.db2.gz MBXUTVCMKOYQHR-CYBMUJFWSA-N 1 0 279.836 5.047 10 0 CKAERO CC[NH2+][C@@H](C)c1ccc(-c2ccc(C)cc2Cl)s1 ZINC000034672245 171857885 /nfs/dbraw/zinc/85/78/85/171857885.db2.gz USCZQSZGTWILNQ-NSHDSACASA-N 1 0 279.836 5.047 10 0 CKAERO C[NH2+][C@H](c1ccc(-c2ccc(F)cc2Cl)s1)C(C)C ZINC000034672312 171858005 /nfs/dbraw/zinc/85/80/05/171858005.db2.gz UFJRXKBKNVRZTA-HNNXBMFYSA-N 1 0 297.826 5.124 10 0 CKAERO CCC[C@@H]([NH2+]C)c1ccc(-c2ccc(F)cc2Cl)s1 ZINC000034672325 171857840 /nfs/dbraw/zinc/85/78/40/171857840.db2.gz UWSBFQBAYRIGRP-CYBMUJFWSA-N 1 0 297.826 5.268 10 0 CKAERO CCC[NH2+][C@H](C)c1ccc(-c2cc(C)ccc2C)s1 ZINC000034672615 171858559 /nfs/dbraw/zinc/85/85/59/171858559.db2.gz JARZPNQADPXMDZ-CQSZACIVSA-N 1 0 273.445 5.093 10 0 CKAERO C[NH2+][C@H](c1ccc(-c2ccc(Cl)cc2F)s1)C(C)C ZINC000034672701 171858583 /nfs/dbraw/zinc/85/85/83/171858583.db2.gz YRXUMUZDCODTIL-HNNXBMFYSA-N 1 0 297.826 5.124 10 0 CKAERO C[NH2+][C@H](c1ccc(-c2cccc(Cl)c2F)s1)C(C)C ZINC000034673307 171859157 /nfs/dbraw/zinc/85/91/57/171859157.db2.gz ZTBGYMMRNWIWQM-HNNXBMFYSA-N 1 0 297.826 5.124 10 0 CKAERO CCC[C@@H]([NH2+]C)c1ccc(-c2cccc(Cl)c2F)s1 ZINC000034673314 171858898 /nfs/dbraw/zinc/85/88/98/171858898.db2.gz WTUWVTCJYPIXEZ-GFCCVEGCSA-N 1 0 297.826 5.268 10 0 CKAERO C[NH2+][C@H](C)c1ccc(-c2cc(Cl)ccc2Cl)s1 ZINC000034673460 171858743 /nfs/dbraw/zinc/85/87/43/171858743.db2.gz PEARRKLSZXEKMW-MRVPVSSYSA-N 1 0 286.227 5.002 10 0 CKAERO C[NH2+][C@@H](c1ccc(-c2ccc(Cl)cc2C)s1)C1CC1 ZINC000034673585 171859017 /nfs/dbraw/zinc/85/90/17/171859017.db2.gz BGUZIWPDUADIBL-MRXNPFEDSA-N 1 0 291.847 5.047 10 0 CKAERO CC[NH2+][C@@H](CC)c1ccc(-c2ccc(Cl)cc2C)s1 ZINC000034673601 171858877 /nfs/dbraw/zinc/85/88/77/171858877.db2.gz OSYYQFPRVZUOFV-AWEZNQCLSA-N 1 0 293.863 5.438 10 0 CKAERO CCC[NH2+][C@H](C)c1ccc(-c2ccc(Cl)cc2C)s1 ZINC000034673606 171858988 /nfs/dbraw/zinc/85/89/88/171858988.db2.gz MKZJIGHXSJGMMA-GFCCVEGCSA-N 1 0 293.863 5.438 10 0 CKAERO CC[NH2+][C@H](C)c1ccc(-c2ccc(Cl)cc2C)s1 ZINC000034673608 171859080 /nfs/dbraw/zinc/85/90/80/171859080.db2.gz ZEUDZVLTJTUEAV-LLVKDONJSA-N 1 0 279.836 5.047 10 0 CKAERO CCCCCC[C@@H](C)[NH2+]Cc1ccccc1C(F)(F)F ZINC000034991416 171917828 /nfs/dbraw/zinc/91/78/28/171917828.db2.gz BBNIOMGFBIDLOD-CYBMUJFWSA-N 1 0 287.369 5.154 10 0 CKAERO CCCCCC[C@@H](C)[NH2+]Cc1ccc(C(C)C)cc1 ZINC000034991424 171917895 /nfs/dbraw/zinc/91/78/95/171917895.db2.gz ISHKRSLQECRXCL-MRXNPFEDSA-N 1 0 261.453 5.259 10 0 CKAERO CSc1ccc(C[NH2+][C@H](C)c2ccc(C(C)C)cc2)cc1 ZINC000034992126 328837863 /nfs/dbraw/zinc/83/78/63/328837863.db2.gz ZZEPVRHIMLULQO-OAHLLOKOSA-N 1 0 299.483 5.383 10 0 CKAERO Cc1cc(C)c(C[NH2+][C@H](C)c2cccc(Cl)c2)cc1C ZINC000034992588 171920008 /nfs/dbraw/zinc/92/00/08/171920008.db2.gz UMWSUVGAQHZBKY-OAHLLOKOSA-N 1 0 287.834 5.116 10 0 CKAERO CCc1ccc([C@@H](C)[NH2+]Cc2cc(C)c(C)cc2C)cc1 ZINC000034992723 171919681 /nfs/dbraw/zinc/91/96/81/171919681.db2.gz RTLGTKQSWXQJBW-QGZVFWFLSA-N 1 0 281.443 5.025 10 0 CKAERO Cc1ccc(C)c([C@H](C)[NH2+]Cc2ccc(C(C)C)cc2)c1 ZINC000034993024 171920347 /nfs/dbraw/zinc/92/03/47/171920347.db2.gz CLUJYYHPOMUAKO-KRWDZBQOSA-N 1 0 281.443 5.278 10 0 CKAERO Cc1ccc(C[NH2+][C@H](CC(C)C)c2ccccc2)c(C)c1 ZINC000034993427 171920814 /nfs/dbraw/zinc/92/08/14/171920814.db2.gz WZQXFYVJMGBGJL-HXUWFJFHSA-N 1 0 281.443 5.180 10 0 CKAERO C[C@@H]([NH2+][C@H]1CCCC[C@@H]1C1CCCCC1)c1ccccc1 ZINC000034994303 171922611 /nfs/dbraw/zinc/92/26/11/171922611.db2.gz GIXPMHCQZYAVSN-AHRSYUTCSA-N 1 0 285.475 5.476 10 0 CKAERO C([NH2+][C@@H]1CCCC[C@@H]1C1CCCCC1)C1CCCCC1 ZINC000034994762 171923025 /nfs/dbraw/zinc/92/30/25/171923025.db2.gz NUVYFLLSAQVMGU-RTBURBONSA-N 1 0 277.496 5.295 10 0 CKAERO C([NH2+][C@H]1CCCC[C@H]1C1CCCCC1)C1CCCCC1 ZINC000034994765 171923234 /nfs/dbraw/zinc/92/32/34/171923234.db2.gz NUVYFLLSAQVMGU-OALUTQOASA-N 1 0 277.496 5.295 10 0 CKAERO CCCCCC[NH2+][C@H]1CCCC[C@@H]1C1CCCCC1 ZINC000034994798 171922953 /nfs/dbraw/zinc/92/29/53/171922953.db2.gz ZILFIHIEOASMDF-MSOLQXFVSA-N 1 0 265.485 5.295 10 0 CKAERO CCCCCC[NH2+][C@@H]1CCCC[C@H]1C1CCCCC1 ZINC000034994799 171923103 /nfs/dbraw/zinc/92/31/03/171923103.db2.gz ZILFIHIEOASMDF-ZWKOTPCHSA-N 1 0 265.485 5.295 10 0 CKAERO c1cc(-c2ccccc2)sc1C[NH2+]C1CCCCCCC1 ZINC000034994931 171923036 /nfs/dbraw/zinc/92/30/36/171923036.db2.gz CHYSTESJRJGFMK-UHFFFAOYSA-N 1 0 299.483 5.618 10 0 CKAERO CC(C)(C)[C@H]1CCCC[C@@H]1[NH2+]Cc1cccc(Cl)c1 ZINC000034995033 171923657 /nfs/dbraw/zinc/92/36/57/171923657.db2.gz CXSFFVCJMDVDPU-HOTGVXAUSA-N 1 0 279.855 5.035 10 0 CKAERO CC(C)(C)[C@@H]1CCCC[C@H]1[NH2+]Cc1cccc(Cl)c1 ZINC000034995034 171923539 /nfs/dbraw/zinc/92/35/39/171923539.db2.gz CXSFFVCJMDVDPU-HZPDHXFCSA-N 1 0 279.855 5.035 10 0 CKAERO c1ccc2c(c1)CCC[C@H]2[NH2+][C@@H]1CC[C@@H]2CCCC[C@@H]2C1 ZINC000034995112 171923573 /nfs/dbraw/zinc/92/35/73/171923573.db2.gz VXVSXBONTZGCNY-ZCDKGFTFSA-N 1 0 283.459 5.013 10 0 CKAERO C1CCC([C@H]2CCCC[C@@H]2[NH2+]C2CCCCCC2)CC1 ZINC000034995189 171923882 /nfs/dbraw/zinc/92/38/82/171923882.db2.gz VSUXPEYOCHLSTL-MOPGFXCFSA-N 1 0 277.496 5.438 10 0 CKAERO CC(C)CC[C@H](C)[NH2+][C@H]1CCCC[C@@H]1C1CCCCC1 ZINC000034995239 171923625 /nfs/dbraw/zinc/92/36/25/171923625.db2.gz OXZPWUXILVSFOT-UHOSZYNNSA-N 1 0 279.512 5.540 10 0 CKAERO CCCCCC[C@H](C)[NH2+]C1CCC(C(C)(C)C)CC1 ZINC000034995369 171923518 /nfs/dbraw/zinc/92/35/18/171923518.db2.gz YZIODFQFSXXTKS-GTPINHCMSA-N 1 0 267.501 5.540 10 0 CKAERO CCCCCC[C@H](C)[NH2+]C1CCC(c2ccccc2)CC1 ZINC000034995373 171923368 /nfs/dbraw/zinc/92/33/68/171923368.db2.gz NJORHRMJYTUFOD-KKXNLOMOSA-N 1 0 287.491 5.661 10 0 CKAERO CCCCCC[C@@H](C)[NH2+]C1CCC(CCC)CC1 ZINC000034995380 171923858 /nfs/dbraw/zinc/92/38/58/171923858.db2.gz VIHZIHJITYZWKD-KLAILNCOSA-N 1 0 253.474 5.294 10 0 CKAERO CCCCCC[C@H](C)[NH2+]C1CCC(CCC)CC1 ZINC000034995381 171923360 /nfs/dbraw/zinc/92/33/60/171923360.db2.gz VIHZIHJITYZWKD-GTPINHCMSA-N 1 0 253.474 5.294 10 0 CKAERO CCCCCC[C@@H](C)[NH2+][C@@H]1CCCC[C@@H]1C(C)(C)C ZINC000034995388 171923596 /nfs/dbraw/zinc/92/35/96/171923596.db2.gz FQIXCNVLFOOJEO-IXDOHACOSA-N 1 0 267.501 5.540 10 0 CKAERO CCCCCC[C@H](C)[NH2+][C@H]1CCCC[C@@H]1C(C)(C)C ZINC000034995391 171923524 /nfs/dbraw/zinc/92/35/24/171923524.db2.gz FQIXCNVLFOOJEO-ULQDDVLXSA-N 1 0 267.501 5.540 10 0 CKAERO CCCCCC[C@@H](C)[NH2+][C@@H]1CC[C@@H]2CCCC[C@@H]2C1 ZINC000034995412 171923585 /nfs/dbraw/zinc/92/35/85/171923585.db2.gz DVWNLEQOLSAEFA-XMTFNYHQSA-N 1 0 265.485 5.294 10 0 CKAERO Fc1ccc(C[NH2+][C@H]2CCCC[C@@H]2C2CCCCC2)cc1 ZINC000034995502 171923830 /nfs/dbraw/zinc/92/38/30/171923830.db2.gz OVHCNFBRIFNSKZ-MOPGFXCFSA-N 1 0 289.438 5.054 10 0 CKAERO Fc1ccc(C[NH2+][C@H]2CCCC[C@H]2C2CCCCC2)cc1 ZINC000034995504 171923491 /nfs/dbraw/zinc/92/34/91/171923491.db2.gz OVHCNFBRIFNSKZ-OALUTQOASA-N 1 0 289.438 5.054 10 0 CKAERO C[C@H]1[C@H]([NH2+]Cc2ccc(-c3ccccc3)s2)CCC[C@@H]1C ZINC000034995568 171924036 /nfs/dbraw/zinc/92/40/36/171924036.db2.gz ZEVRURCAFKVTDN-HDMKZQKVSA-N 1 0 299.483 5.329 10 0 CKAERO C[C@H]1CCCC[C@@H]1[NH2+][C@@H]1CCCC[C@@H]1C1CCCCC1 ZINC000034995590 171924539 /nfs/dbraw/zinc/92/45/39/171924539.db2.gz LLOAXZSTERKUMV-WZGPROSRSA-N 1 0 277.496 5.294 10 0 CKAERO CC1CCC([NH2+][C@@H]2CCCC[C@H]2C2CCCCC2)CC1 ZINC000034995796 171924174 /nfs/dbraw/zinc/92/41/74/171924174.db2.gz WVVCUCWJUXDSHU-SOTJZCEJSA-N 1 0 277.496 5.294 10 0 CKAERO Fc1ccccc1C[NH2+][C@@H]1CCCC[C@@H]1C1CCCCC1 ZINC000034995850 171924538 /nfs/dbraw/zinc/92/45/38/171924538.db2.gz AZEKBFGXLUXYHZ-IEBWSBKVSA-N 1 0 289.438 5.054 10 0 CKAERO Fc1ccccc1C[NH2+][C@H]1CCCC[C@@H]1C1CCCCC1 ZINC000034995851 171924524 /nfs/dbraw/zinc/92/45/24/171924524.db2.gz AZEKBFGXLUXYHZ-MJGOQNOKSA-N 1 0 289.438 5.054 10 0 CKAERO CC(C)c1ccc([C@H](C)[NH2+]C2[C@H](C)CCC[C@@H]2C)cc1 ZINC000034996145 171924826 /nfs/dbraw/zinc/92/48/26/171924826.db2.gz UXCSQYLXRQRZJE-IJOZJFQKSA-N 1 0 273.464 5.285 10 0 CKAERO CC[C@H]([NH2+]C1CCC(C(C)(C)C)CC1)c1ccc(C)cc1 ZINC000034996316 171924859 /nfs/dbraw/zinc/92/48/59/171924859.db2.gz VYPKQZQSHUCZJA-ACBHZAAOSA-N 1 0 287.491 5.641 10 0 CKAERO CC[C@@H]([NH2+]C1CCC(C(C)(C)C)CC1)c1ccc(C)cc1 ZINC000034996317 171924874 /nfs/dbraw/zinc/92/48/74/171924874.db2.gz VYPKQZQSHUCZJA-CTWPCTMYSA-N 1 0 287.491 5.641 10 0 CKAERO CC[C@H]([NH2+][C@@H]1CCCC[C@@H]1C(C)(C)C)c1ccc(C)cc1 ZINC000034996334 171924669 /nfs/dbraw/zinc/92/46/69/171924669.db2.gz GGYVRECIVZHSFG-GBESFXJTSA-N 1 0 287.491 5.641 10 0 CKAERO CC[C@@H]([NH2+][C@@H]1CCCC[C@@H]1C(C)(C)C)c1ccc(C)cc1 ZINC000034996335 171924760 /nfs/dbraw/zinc/92/47/60/171924760.db2.gz GGYVRECIVZHSFG-IPMKNSEASA-N 1 0 287.491 5.641 10 0 CKAERO CC[C@H]([NH2+][C@H]1CCCC[C@@H]1C(C)(C)C)c1ccc(C)cc1 ZINC000034996336 171924766 /nfs/dbraw/zinc/92/47/66/171924766.db2.gz GGYVRECIVZHSFG-FHWLQOOXSA-N 1 0 287.491 5.641 10 0 CKAERO CC[C@@H]([NH2+][C@@H]1CC[C@@H]2CCCC[C@@H]2C1)c1ccc(C)cc1 ZINC000034996353 171925173 /nfs/dbraw/zinc/92/51/73/171925173.db2.gz AWHNAJKAWRNJBP-MTFMMBMASA-N 1 0 285.475 5.395 10 0 CKAERO C[C@H]1C[C@@H]([NH2+][C@@H]2CCSc3ccccc32)CC(C)(C)C1 ZINC000034996509 171925658 /nfs/dbraw/zinc/92/56/58/171925658.db2.gz NYWNUEABGPRHHO-SQWLQELKSA-N 1 0 289.488 5.028 10 0 CKAERO C[C@@H]([NH2+][C@H]1CC[C@@H]2CCCC[C@@H]2C1)c1ccccc1Cl ZINC000035009638 171926416 /nfs/dbraw/zinc/92/64/16/171926416.db2.gz HREDFBYRNLDGQR-QXSJWSMHSA-N 1 0 291.866 5.350 10 0 CKAERO c1csc(CC[NH2+][C@@H]2CCCC[C@H]2C2CCCCC2)c1 ZINC000035009696 171927144 /nfs/dbraw/zinc/92/71/44/171927144.db2.gz HEDCTMTVRCKEIJ-ZWKOTPCHSA-N 1 0 291.504 5.019 10 0 CKAERO CCCC1CCC([NH2+][C@@H](C)c2ccc(CC)cc2)CC1 ZINC000035009809 171927477 /nfs/dbraw/zinc/92/74/77/171927477.db2.gz HSJPWDDPFJPJLJ-DMKPSLHHSA-N 1 0 273.464 5.259 10 0 CKAERO CCc1ccc([C@@H](C)[NH2+][C@@H]2CCCC[C@@H]2C(C)(C)C)cc1 ZINC000035009817 171926999 /nfs/dbraw/zinc/92/69/99/171926999.db2.gz QKPCCTXFVJQAIX-AYOQOUSVSA-N 1 0 287.491 5.505 10 0 CKAERO CCc1ccc([C@@H](C)[NH2+][C@H]2CC[C@@H]3CCCC[C@@H]3C2)cc1 ZINC000035009837 171927536 /nfs/dbraw/zinc/92/75/36/171927536.db2.gz VEIPBHRTEAGTJI-NMLACTOBSA-N 1 0 285.475 5.259 10 0 CKAERO C[C@@H]([NH2+][C@H]1CC[C@@H]2CCCC[C@@H]2C1)c1ccc(Cl)cc1 ZINC000035009945 171927570 /nfs/dbraw/zinc/92/75/70/171927570.db2.gz GRPYTPZPEBXFGX-VUNQQRPYSA-N 1 0 291.866 5.350 10 0 CKAERO C[C@H]([NH2+]C1[C@H](C)CCC[C@@H]1C)c1cccc(C(F)(F)F)c1 ZINC000035009980 171927428 /nfs/dbraw/zinc/92/74/28/171927428.db2.gz JQZWSQQUABHXOA-IVMGVGPUSA-N 1 0 299.380 5.181 10 0 CKAERO C[C@@H]([NH2+][C@@H]1CCCC[C@@H]1C(C)(C)C)c1ccccc1F ZINC000035010511 171928182 /nfs/dbraw/zinc/92/81/82/171928182.db2.gz HJNLUQNOKZUCNO-UKPHBRMFSA-N 1 0 277.427 5.081 10 0 CKAERO CCCC1CCC([NH2+][C@@H](C)c2cc(C)ccc2C)CC1 ZINC000035010605 171928327 /nfs/dbraw/zinc/92/83/27/171928327.db2.gz JFXUMCFWKRADFX-AOCRQIFASA-N 1 0 273.464 5.313 10 0 CKAERO C[C@@H]([NH2+][C@@H]1CCCC[C@@H]1C(C)(C)C)c1ccc(F)cc1F ZINC000035010802 171927942 /nfs/dbraw/zinc/92/79/42/171927942.db2.gz QMIPXRJQHKQAQT-ISTRZQFTSA-N 1 0 295.417 5.220 10 0 CKAERO CCC1CCC([NH2+][C@@H](C)c2ccc3c(c2)CCCC3)CC1 ZINC000035011796 171929466 /nfs/dbraw/zinc/92/94/66/171929466.db2.gz COCSMTANGWGGSP-SHPPYHEDSA-N 1 0 285.475 5.185 10 0 CKAERO C[C@H](C[NH2+][C@@H](c1ccc(Cl)cc1)C1CC1)c1ccccc1 ZINC000035011931 171929586 /nfs/dbraw/zinc/92/95/86/171929586.db2.gz JBYXDNGQZZSBBY-AUUYWEPGSA-N 1 0 299.845 5.184 10 0 CKAERO C[C@H](C[NH2+][C@H](c1ccc(Cl)cc1)C1CC1)c1ccccc1 ZINC000035011934 171929379 /nfs/dbraw/zinc/92/93/79/171929379.db2.gz JBYXDNGQZZSBBY-KUHUBIRLSA-N 1 0 299.845 5.184 10 0 CKAERO CC1CCC([NH2+][C@H](c2cccs2)c2ccccc2)CC1 ZINC000035012111 171929298 /nfs/dbraw/zinc/92/92/98/171929298.db2.gz SETMIBKIJCURBL-PVARCSIZSA-N 1 0 285.456 5.006 10 0 CKAERO CC1CCC([NH2+][C@@H](c2cccs2)c2ccccc2)CC1 ZINC000035012112 171929572 /nfs/dbraw/zinc/92/95/72/171929572.db2.gz SETMIBKIJCURBL-JFUPDXTOSA-N 1 0 285.456 5.006 10 0 CKAERO c1csc([C@H]([NH2+]C2CCCCCC2)c2ccccc2)c1 ZINC000035012114 171929574 /nfs/dbraw/zinc/92/95/74/171929574.db2.gz BJQNMDLPLSOHKW-GOSISDBHSA-N 1 0 285.456 5.150 10 0 CKAERO C[C@H]([NH2+][C@H]1CCCC[C@@H]1C1CCCCC1)c1ccco1 ZINC000035012564 171930693 /nfs/dbraw/zinc/93/06/93/171930693.db2.gz WOMBLMSEQZXLJM-UAGQMJEPSA-N 1 0 275.436 5.069 10 0 CKAERO CC(C)(C)C1CCC([NH2+]C2C3CC4CC(C3)CC2C4)CC1 ZINC000035012798 171930710 /nfs/dbraw/zinc/93/07/10/171930710.db2.gz RSYVRIJYDMZCRA-UHFFFAOYSA-N 1 0 289.507 5.006 10 0 CKAERO CCCC1CCC([NH2+][C@H](CC)c2ccc(OC)cc2)CC1 ZINC000035012921 171930092 /nfs/dbraw/zinc/93/00/92/171930092.db2.gz AUPVBTPOMMUBBK-GXOAENINSA-N 1 0 289.463 5.095 10 0 CKAERO CCC[C@@H]([NH2+]C1CCC(CC)CC1)c1ccccc1 ZINC000035013085 171930787 /nfs/dbraw/zinc/93/07/87/171930787.db2.gz QGPNWLNUEWZACB-VMWRSERWSA-N 1 0 259.437 5.086 10 0 CKAERO CCC[C@@H]([NH2+]C1CCC(C(C)(C)C)CC1)c1ccccc1 ZINC000035013110 171930645 /nfs/dbraw/zinc/93/06/45/171930645.db2.gz ITAKPUXBPLLCPV-CTWPCTMYSA-N 1 0 287.491 5.722 10 0 CKAERO CCc1ccc(C[NH2+]C2CCC(C(C)(C)CC)CC2)cc1 ZINC000035013245 171930974 /nfs/dbraw/zinc/93/09/74/171930974.db2.gz QZPWDELGWHYYRD-UHFFFAOYSA-N 1 0 287.491 5.334 10 0 CKAERO CCC(C)(C)C1CCC([NH2+]Cc2ccc(C)cc2C)CC1 ZINC000035013255 171931245 /nfs/dbraw/zinc/93/12/45/171931245.db2.gz IVNILRAWSIPCOX-UHFFFAOYSA-N 1 0 287.491 5.388 10 0 CKAERO CCC(C)(C)C1CCC([NH2+]C2[C@H](C)CCC[C@H]2C)CC1 ZINC000035013279 171931211 /nfs/dbraw/zinc/93/12/11/171931211.db2.gz GSRQWEXEVUGXJZ-NUWOQIAWSA-N 1 0 279.512 5.396 10 0 CKAERO Cc1ccc([C@H](C)[NH2+]C2CCCCCCCCCCC2)o1 ZINC000035013319 171931075 /nfs/dbraw/zinc/93/10/75/171931075.db2.gz FCJMCSXGBLGKLV-KRWDZBQOSA-N 1 0 291.479 5.912 10 0 CKAERO CC(C)[C@@H]([NH2+][C@H]1C[C@@H](C)CC(C)(C)C1)c1ccccc1 ZINC000035015780 171932414 /nfs/dbraw/zinc/93/24/14/171932414.db2.gz KCJWAAVEWNNNGF-BPQIPLTHSA-N 1 0 273.464 5.188 10 0 CKAERO CC(C)[C@H]([NH2+]C1CCCCCCC1)c1ccccc1 ZINC000035015964 171932556 /nfs/dbraw/zinc/93/25/56/171932556.db2.gz ANRRTQHNXBBKGK-SFHVURJKSA-N 1 0 259.437 5.086 10 0 CKAERO CCCC1CCC([NH2+][C@H](c2ccccc2)C(C)C)CC1 ZINC000035016148 171932651 /nfs/dbraw/zinc/93/26/51/171932651.db2.gz ONMHJUKBQUMILG-KVZIAJEVSA-N 1 0 273.464 5.332 10 0 CKAERO CC(C)[C@H]([NH2+][C@H]1CCCC[C@@H]1C(C)(C)C)c1ccccc1 ZINC000035016193 171932940 /nfs/dbraw/zinc/93/29/40/171932940.db2.gz FECHCEDGZFBUSE-FHWLQOOXSA-N 1 0 287.491 5.578 10 0 CKAERO CC(C)[C@@H]([NH2+][C@@H]1C[C@@H](C)CC[C@@H]1C(C)C)c1ccccc1 ZINC000035016305 171933751 /nfs/dbraw/zinc/93/37/51/171933751.db2.gz IRYNNXDQNLJGRY-MTFMMBMASA-N 1 0 287.491 5.434 10 0 CKAERO CC(C)[C@@H]([NH2+][C@H]1C[C@@H](C)CC(C)(C)C1)c1ccc(F)cc1 ZINC000035016323 171933205 /nfs/dbraw/zinc/93/32/05/171933205.db2.gz MSIXTYJCXCCQRL-FHLIZLRMSA-N 1 0 291.454 5.327 10 0 CKAERO CC(C)[C@@H]([NH2+]C1CCCCCCC1)c1ccc(F)cc1 ZINC000035016435 171933408 /nfs/dbraw/zinc/93/34/08/171933408.db2.gz PTOAPWCMCLXYLL-GOSISDBHSA-N 1 0 277.427 5.225 10 0 CKAERO CC(C)[C@@H]([NH2+][C@H]1C[C@@H](C)CC(C)(C)C1)c1cccs1 ZINC000035016902 171934537 /nfs/dbraw/zinc/93/45/37/171934537.db2.gz RLCQHEMJFIKHDV-IJEWVQPXSA-N 1 0 279.493 5.250 10 0 CKAERO CC(C)[C@H]([NH2+]Cc1cccc2ccccc21)c1cccs1 ZINC000035016976 171934691 /nfs/dbraw/zinc/93/46/91/171934691.db2.gz QNLFMURYLNYHTQ-IBGZPJMESA-N 1 0 295.451 5.388 10 0 CKAERO CC(C)[C@@H]([NH2+]Cc1cccc2ccccc21)c1cccs1 ZINC000035016977 171934222 /nfs/dbraw/zinc/93/42/22/171934222.db2.gz QNLFMURYLNYHTQ-LJQANCHMSA-N 1 0 295.451 5.388 10 0 CKAERO Cc1cc(C)c(C[NH2+][C@@H](c2cccs2)C(C)C)c(C)c1 ZINC000035017221 171934069 /nfs/dbraw/zinc/93/40/69/171934069.db2.gz SUGPSMDUZQPRRM-GOSISDBHSA-N 1 0 287.472 5.160 10 0 CKAERO CCCC1CCC([NH2+][C@H](c2cccs2)C(C)C)CC1 ZINC000035017227 171934028 /nfs/dbraw/zinc/93/40/28/171934028.db2.gz RVDDXUNNWXCMSV-DQPZFDDXSA-N 1 0 279.493 5.394 10 0 CKAERO CC(C)[C@@H]([NH2+][C@@H]1C[C@@H](C)CC[C@@H]1C(C)C)c1cccs1 ZINC000035017435 171934256 /nfs/dbraw/zinc/93/42/56/171934256.db2.gz XZCOAVKMKHOFMS-BVIKNXMNSA-N 1 0 293.520 5.496 10 0 CKAERO CCCC[C@@H](CC)C[NH2+]Cc1c2ccccc2oc1CC ZINC000035017735 171934834 /nfs/dbraw/zinc/93/48/34/171934834.db2.gz KZMMMNRZTFPZOT-OAHLLOKOSA-N 1 0 287.447 5.301 10 0 CKAERO Fc1ccc2c(c1)[C@H]([NH2+]C1CCCCCCC1)CCS2 ZINC000035043561 171947704 /nfs/dbraw/zinc/94/77/04/171947704.db2.gz YUPTUUZLQKLFHT-MRXNPFEDSA-N 1 0 293.451 5.065 10 0 CKAERO Fc1ccc2c(c1)[C@@H]([NH2+]C1CCCCCCC1)CCS2 ZINC000035043564 171947732 /nfs/dbraw/zinc/94/77/32/171947732.db2.gz YUPTUUZLQKLFHT-INIZCTEOSA-N 1 0 293.451 5.065 10 0 CKAERO CC(C)(C)[C@H]1CCCC[C@H]1[NH2+][C@@H]1CC[C@@H]2CCCC[C@@H]2C1 ZINC000035044448 171947370 /nfs/dbraw/zinc/94/73/70/171947370.db2.gz LNVUSCPRHHGQKR-BRIYLRKRSA-N 1 0 291.523 5.540 10 0 CKAERO Clc1ccc2c(c1)[C@@H]([NH2+]C1CCCCCC1)CCS2 ZINC000035047327 171951294 /nfs/dbraw/zinc/95/12/94/171951294.db2.gz KZGDAOQOROXZSF-HNNXBMFYSA-N 1 0 295.879 5.189 10 0 CKAERO C[C@H]1CCCC[C@H]1[NH2+][C@@H]1CCSc2ccc(Cl)cc21 ZINC000035047376 171951038 /nfs/dbraw/zinc/95/10/38/171951038.db2.gz VVPONDLZLUGVOW-NILFDRSVSA-N 1 0 295.879 5.045 10 0 CKAERO Fc1cccc2c1SCC[C@@H]2[NH2+]C1CCCCCCC1 ZINC000035047613 171951296 /nfs/dbraw/zinc/95/12/96/171951296.db2.gz AMTVXYRREPNXOU-INIZCTEOSA-N 1 0 293.451 5.065 10 0 CKAERO CCCC1CCC([NH2+][C@@H](C)c2ccc(OCC)cc2)CC1 ZINC000035052980 171953859 /nfs/dbraw/zinc/95/38/59/171953859.db2.gz DBAUVCJTBCXWJG-HJOIGYKYSA-N 1 0 289.463 5.095 10 0 CKAERO CCCC1CCC([NH2+][C@H](C)c2ccc(OCC)cc2)CC1 ZINC000035052981 171953727 /nfs/dbraw/zinc/95/37/27/171953727.db2.gz DBAUVCJTBCXWJG-KLHKWILBSA-N 1 0 289.463 5.095 10 0 CKAERO CC(C)(C)C1CCC([NH2+][C@H](c2ccccc2)C2CC2)CC1 ZINC000035053252 171953916 /nfs/dbraw/zinc/95/39/16/171953916.db2.gz DKQHLDZALJJYHO-CTWPCTMYSA-N 1 0 285.475 5.332 10 0 CKAERO CCCC1CCC([NH2+][C@H](c2ccccc2)C2CC2)CC1 ZINC000035053262 171953762 /nfs/dbraw/zinc/95/37/62/171953762.db2.gz BYBBYDGDLUXRFO-XUJQIHCRSA-N 1 0 271.448 5.086 10 0 CKAERO CC(C)(C)[C@@H]1CCCC[C@H]1[NH2+][C@@H](c1ccccc1)C1CC1 ZINC000035053279 171953538 /nfs/dbraw/zinc/95/35/38/171953538.db2.gz PCGXOJRRYMUINU-QRVBRYPASA-N 1 0 285.475 5.332 10 0 CKAERO c1ccc([C@H]([NH2+][C@H]2CC[C@@H]3CCCC[C@@H]3C2)C2CC2)cc1 ZINC000035053290 171953513 /nfs/dbraw/zinc/95/35/13/171953513.db2.gz HMKPBADZBGGPSE-LDTOTXGLSA-N 1 0 283.459 5.086 10 0 CKAERO Cc1ccccc1C[NH2+][C@H](c1ccc(Cl)cc1)C(C)C ZINC000035054151 171955648 /nfs/dbraw/zinc/95/56/48/171955648.db2.gz ZBJKFMNXEYEKSU-SFHVURJKSA-N 1 0 287.834 5.135 10 0 CKAERO Cc1ccc(C[NH2+][C@@H](c2ccc(Cl)cc2)C(C)C)cc1 ZINC000035054152 171955697 /nfs/dbraw/zinc/95/56/97/171955697.db2.gz FBYSRNBMKRXOKC-GOSISDBHSA-N 1 0 287.834 5.135 10 0 CKAERO CC(C)[C@@H]([NH2+]CC1CCCCC1)c1ccc(Cl)cc1 ZINC000035054223 171955874 /nfs/dbraw/zinc/95/58/74/171955874.db2.gz WVABLIZLRVEWRR-QGZVFWFLSA-N 1 0 279.855 5.207 10 0 CKAERO CC(C)[C@@H]([NH2+]C1CCCCCCC1)c1ccc(Cl)cc1 ZINC000035054259 171955881 /nfs/dbraw/zinc/95/58/81/171955881.db2.gz HGQLZXMTUDCTHM-GOSISDBHSA-N 1 0 293.882 5.740 10 0 CKAERO CCC1CCC([NH2+][C@H](c2ccc(Cl)cc2)C(C)C)CC1 ZINC000035054261 171955857 /nfs/dbraw/zinc/95/58/57/171955857.db2.gz KZWFJKNUEBWAFV-UYJHFMRCSA-N 1 0 293.882 5.596 10 0 CKAERO CCCCc1oc2ccccc2c1C[NH2+][C@@H](C)CCC ZINC000035112392 171985958 /nfs/dbraw/zinc/98/59/58/171985958.db2.gz ZANXEJFUIRTHHO-AWEZNQCLSA-N 1 0 273.420 5.054 10 0 CKAERO CCCCC[C@@H](C)[NH2+]Cc1ccc(Cl)c(Cl)c1 ZINC000035134002 172000341 /nfs/dbraw/zinc/00/03/41/172000341.db2.gz LFBYXGHUTWXLEX-LLVKDONJSA-N 1 0 274.235 5.052 10 0 CKAERO CCCCC[C@@H](C)[NH2+]Cc1ccc(OCCC(C)C)cc1 ZINC000035134008 171999577 /nfs/dbraw/zinc/99/95/77/171999577.db2.gz WWJVWNSBRTXVTC-QGZVFWFLSA-N 1 0 291.479 5.170 10 0 CKAERO CCCCC[C@H](C)[NH2+]Cc1ccc(OCCC(C)C)cc1 ZINC000035134009 172000246 /nfs/dbraw/zinc/00/02/46/172000246.db2.gz WWJVWNSBRTXVTC-KRWDZBQOSA-N 1 0 291.479 5.170 10 0 CKAERO CCCCC[C@H](C)[NH2+]Cc1c(Cl)cccc1Cl ZINC000035134027 172000343 /nfs/dbraw/zinc/00/03/43/172000343.db2.gz LTBKHNNDRQIMDQ-NSHDSACASA-N 1 0 274.235 5.052 10 0 CKAERO CCCCC[C@@H](C)[NH2+]C1CCC(C(C)(C)CC)CC1 ZINC000035135641 172002861 /nfs/dbraw/zinc/00/28/61/172002861.db2.gz QDRJEAHGNWLPDA-KLAILNCOSA-N 1 0 267.501 5.540 10 0 CKAERO CCCCC[C@H](C)[NH2+]C1CCC(C(C)(C)CC)CC1 ZINC000035135643 172002823 /nfs/dbraw/zinc/00/28/23/172002823.db2.gz QDRJEAHGNWLPDA-GTPINHCMSA-N 1 0 267.501 5.540 10 0 CKAERO CCCCC[C@@H](C)[NH2+]C1CCC(C(C)(C)C)CC1 ZINC000035135686 172002808 /nfs/dbraw/zinc/00/28/08/172002808.db2.gz PICLRJRWQIGUAC-QQFBHYJXSA-N 1 0 253.474 5.150 10 0 CKAERO CCCCC[C@H](C)[NH2+]C1CCC(C(C)(C)C)CC1 ZINC000035135688 172003265 /nfs/dbraw/zinc/00/32/65/172003265.db2.gz PICLRJRWQIGUAC-FHERZECASA-N 1 0 253.474 5.150 10 0 CKAERO CCCCC[C@@H](C)[NH2+]C1CCC(c2ccccc2)CC1 ZINC000035135694 172003200 /nfs/dbraw/zinc/00/32/00/172003200.db2.gz KCPCZINDNHFONJ-IPJUCJBFSA-N 1 0 273.464 5.271 10 0 CKAERO CCCCC[C@@H](C)[NH2+][C@@H]1CCCC[C@@H]1C(C)(C)C ZINC000035135715 172002799 /nfs/dbraw/zinc/00/27/99/172002799.db2.gz SFNOVAVTXZABLE-OWCLPIDISA-N 1 0 253.474 5.150 10 0 CKAERO CCCCC[C@H](C)[NH2+][C@@H]1CCCC[C@@H]1C(C)(C)C ZINC000035135717 172002881 /nfs/dbraw/zinc/00/28/81/172002881.db2.gz SFNOVAVTXZABLE-HRCADAONSA-N 1 0 253.474 5.150 10 0 CKAERO CCCCC[C@@H](C)[NH2+][C@H]1CCCC[C@@H]1C(C)(C)C ZINC000035135718 172002812 /nfs/dbraw/zinc/00/28/12/172002812.db2.gz SFNOVAVTXZABLE-PMPSAXMXSA-N 1 0 253.474 5.150 10 0 CKAERO CCCCC[C@H](C)[NH2+][C@H]1CCCC[C@@H]1C(C)(C)C ZINC000035135720 172003163 /nfs/dbraw/zinc/00/31/63/172003163.db2.gz SFNOVAVTXZABLE-JYJNAYRXSA-N 1 0 253.474 5.150 10 0 CKAERO CCCCC[C@@H](C)[NH2+]Cc1ccc(-c2ccc(F)cc2)o1 ZINC000035135722 172002893 /nfs/dbraw/zinc/00/28/93/172002893.db2.gz WOMVULUAJPQZJA-CQSZACIVSA-N 1 0 289.394 5.144 10 0 CKAERO CCCCC[C@H](C)[NH2+]Cc1ccc(-c2ccc(F)cc2)o1 ZINC000035135723 172003064 /nfs/dbraw/zinc/00/30/64/172003064.db2.gz WOMVULUAJPQZJA-AWEZNQCLSA-N 1 0 289.394 5.144 10 0 CKAERO C[C@H]([NH2+]C1CCCCCCCCCCC1)C1CC1 ZINC000035136369 172004009 /nfs/dbraw/zinc/00/40/09/172004009.db2.gz FAMDCHSRAQQARM-HNNXBMFYSA-N 1 0 251.458 5.048 10 0 CKAERO C[C@@H]([NH2+]C1CCCCCCCCCCC1)C1CC1 ZINC000035136371 172003922 /nfs/dbraw/zinc/00/39/22/172003922.db2.gz FAMDCHSRAQQARM-OAHLLOKOSA-N 1 0 251.458 5.048 10 0 CKAERO C[C@H]([NH2+]C1CCCCCCCCCCC1)c1ccco1 ZINC000035136765 172004122 /nfs/dbraw/zinc/00/41/22/172004122.db2.gz FOYKFCAZXDOBFS-INIZCTEOSA-N 1 0 277.452 5.604 10 0 CKAERO C[C@@H]([NH2+]C1CCCCCCCCCCC1)c1ccco1 ZINC000035136767 172004023 /nfs/dbraw/zinc/00/40/23/172004023.db2.gz FOYKFCAZXDOBFS-MRXNPFEDSA-N 1 0 277.452 5.604 10 0 CKAERO CCCCC[C@@H](C)[NH2+]C1c2ccccc2-c2ccccc21 ZINC000035140477 172007921 /nfs/dbraw/zinc/00/79/21/172007921.db2.gz RDYHAZZOUZRGJT-OAHLLOKOSA-N 1 0 279.427 5.315 10 0 CKAERO CCCCC[C@H](C)[NH2+]C1c2ccccc2-c2ccccc21 ZINC000035140479 172008455 /nfs/dbraw/zinc/00/84/55/172008455.db2.gz RDYHAZZOUZRGJT-HNNXBMFYSA-N 1 0 279.427 5.315 10 0 CKAERO CC(C)CCCCCC[NH2+]C1C2CC3CC(C2)CC1C3 ZINC000035161867 172022465 /nfs/dbraw/zinc/02/24/65/172022465.db2.gz WMLWFUWAZRYATL-UHFFFAOYSA-N 1 0 277.496 5.007 10 0 CKAERO Cc1cccc(C[NH2+][C@@H]2CCCC[C@@H]2C2CCCCC2)c1 ZINC000035230264 172070701 /nfs/dbraw/zinc/07/07/01/172070701.db2.gz IEGJMFATVPVWNA-WOJBJXKFSA-N 1 0 285.475 5.224 10 0 CKAERO Cc1cccc(C[NH2+][C@H]2CCCC[C@@H]2C2CCCCC2)c1 ZINC000035230266 172071026 /nfs/dbraw/zinc/07/10/26/172071026.db2.gz IEGJMFATVPVWNA-UXHICEINSA-N 1 0 285.475 5.224 10 0 CKAERO Cc1cccc(C[NH2+][C@@H]2CCCC[C@H]2C2CCCCC2)c1 ZINC000035230268 172070766 /nfs/dbraw/zinc/07/07/66/172070766.db2.gz IEGJMFATVPVWNA-VQTJNVASSA-N 1 0 285.475 5.224 10 0 CKAERO Cc1cccc(C[NH2+][C@H]2CCCC[C@H]2C2CCCCC2)c1 ZINC000035230270 172070697 /nfs/dbraw/zinc/07/06/97/172070697.db2.gz IEGJMFATVPVWNA-PMACEKPBSA-N 1 0 285.475 5.224 10 0 CKAERO C[C@H]([NH2+]C1CCCCCCC1)c1ccc(Cl)s1 ZINC000035232558 184537554 /nfs/dbraw/zinc/53/75/54/184537554.db2.gz SRDVIZBLOFAHMW-NSHDSACASA-N 1 0 271.857 5.165 10 0 CKAERO Cc1cc(C)c(C[NH2+][C@@H](C)c2ccc(Cl)s2)c(C)c1 ZINC000035253394 172083641 /nfs/dbraw/zinc/08/36/41/172083641.db2.gz OYIGEHKNZABRSZ-ZDUSSCGKSA-N 1 0 293.863 5.178 10 0 CKAERO Cc1cc(C)c(C[NH2+][C@H](C)c2ccc(Cl)s2)c(C)c1 ZINC000035253396 172083590 /nfs/dbraw/zinc/08/35/90/172083590.db2.gz OYIGEHKNZABRSZ-CYBMUJFWSA-N 1 0 293.863 5.178 10 0 CKAERO Cc1cc(C)c(C[NH2+][C@@H](C)c2ccc(Cl)s2)cc1C ZINC000035253558 172083483 /nfs/dbraw/zinc/08/34/83/172083483.db2.gz UIRCXOXUJGIMBF-ZDUSSCGKSA-N 1 0 293.863 5.178 10 0 CKAERO Cc1cc(C)c(C[NH2+][C@H](C)c2ccc(Cl)s2)cc1C ZINC000035253559 172083336 /nfs/dbraw/zinc/08/33/36/172083336.db2.gz UIRCXOXUJGIMBF-CYBMUJFWSA-N 1 0 293.863 5.178 10 0 CKAERO CCCC1CCC([NH2+][C@@H](C)c2ccc(Cl)s2)CC1 ZINC000035253749 172083199 /nfs/dbraw/zinc/08/31/99/172083199.db2.gz RPMPUTXTUIDSPT-HIFPTAJRSA-N 1 0 285.884 5.411 10 0 CKAERO CCCC1CCC([NH2+][C@H](C)c2ccc(Cl)s2)CC1 ZINC000035253751 172083534 /nfs/dbraw/zinc/08/35/34/172083534.db2.gz RPMPUTXTUIDSPT-PNESKVBLSA-N 1 0 285.884 5.411 10 0 CKAERO CCC1CCC([NH2+][C@@H](C)c2ccc(Cl)s2)CC1 ZINC000035253771 172083258 /nfs/dbraw/zinc/08/32/58/172083258.db2.gz YZUJWVIDIWIACR-UNXYVOJBSA-N 1 0 271.857 5.021 10 0 CKAERO CCC1CCC([NH2+][C@H](C)c2ccc(Cl)s2)CC1 ZINC000035253773 172083158 /nfs/dbraw/zinc/08/31/58/172083158.db2.gz YZUJWVIDIWIACR-VOMCLLRMSA-N 1 0 271.857 5.021 10 0 CKAERO C[C@H]([NH2+][C@H]1C[C@@H](C)CC(C)(C)C1)c1ccc(Cl)s1 ZINC000035253781 172083526 /nfs/dbraw/zinc/08/35/26/172083526.db2.gz BLFDLYIYPWRKTN-WOPDTQHZSA-N 1 0 285.884 5.267 10 0 CKAERO C[C@H]([NH2+][C@@H]1C[C@@H](C)CC(C)(C)C1)c1ccc(Cl)s1 ZINC000035253784 172083302 /nfs/dbraw/zinc/08/33/02/172083302.db2.gz BLFDLYIYPWRKTN-GRYCIOLGSA-N 1 0 285.884 5.267 10 0 CKAERO CC(C)(C)[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(Cl)s1 ZINC000035255158 172084535 /nfs/dbraw/zinc/08/45/35/172084535.db2.gz LJMIKLSDJROILL-OLZOCXBDSA-N 1 0 285.884 5.096 10 0 CKAERO CC(C)(C)[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(Cl)s1 ZINC000035255159 172084904 /nfs/dbraw/zinc/08/49/04/172084904.db2.gz LJMIKLSDJROILL-STQMWFEESA-N 1 0 285.884 5.096 10 0 CKAERO CC(C)(C)[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(Cl)s1 ZINC000035255160 172084689 /nfs/dbraw/zinc/08/46/89/172084689.db2.gz LJMIKLSDJROILL-CHWSQXEVSA-N 1 0 285.884 5.096 10 0 CKAERO CC(C)(C)[C@H]1CCCC[C@H]1[NH2+]Cc1ccc(Cl)s1 ZINC000035255161 172084622 /nfs/dbraw/zinc/08/46/22/172084622.db2.gz LJMIKLSDJROILL-QWHCGFSZSA-N 1 0 285.884 5.096 10 0 CKAERO c1csc(-c2csc(C[NH2+]CC3CCCCC3)c2)c1 ZINC000035255952 172086380 /nfs/dbraw/zinc/08/63/80/172086380.db2.gz AHJVQBRSEBEWPU-UHFFFAOYSA-N 1 0 291.485 5.147 10 0 CKAERO CCCCCC[NH2+]Cc1cc(-c2cccs2)cs1 ZINC000035255953 172086273 /nfs/dbraw/zinc/08/62/73/172086273.db2.gz SKRQSNJLNJEYNU-UHFFFAOYSA-N 1 0 279.474 5.147 10 0 CKAERO CC1CCC([NH2+]Cc2cc(-c3cccs3)cs2)CC1 ZINC000035256014 172086181 /nfs/dbraw/zinc/08/61/81/172086181.db2.gz OAKXDKZYRNUSOR-UHFFFAOYSA-N 1 0 291.485 5.145 10 0 CKAERO CCC1CCC([NH2+][C@@H](C)c2ccc(SC)cc2)CC1 ZINC000035256589 172086972 /nfs/dbraw/zinc/08/69/72/172086972.db2.gz DVHUVECXMMTMJU-HLIUYOAVSA-N 1 0 277.477 5.028 10 0 CKAERO CCC1CCC([NH2+][C@H](C)c2ccc(SC)cc2)CC1 ZINC000035256590 172087041 /nfs/dbraw/zinc/08/70/41/172087041.db2.gz DVHUVECXMMTMJU-VQCLRJIVSA-N 1 0 277.477 5.028 10 0 CKAERO CC[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(Cl)c(Cl)c1 ZINC000035256739 172087170 /nfs/dbraw/zinc/08/71/70/172087170.db2.gz UAWLNAGNUXIJBU-DOMZBBRYSA-N 1 0 286.246 5.052 10 0 CKAERO CC[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(Cl)c(Cl)c1 ZINC000035256740 172086899 /nfs/dbraw/zinc/08/68/99/172086899.db2.gz UAWLNAGNUXIJBU-WFASDCNBSA-N 1 0 286.246 5.052 10 0 CKAERO CC[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(Cl)c(Cl)c1 ZINC000035256741 172086696 /nfs/dbraw/zinc/08/66/96/172086696.db2.gz UAWLNAGNUXIJBU-IUODEOHRSA-N 1 0 286.246 5.052 10 0 CKAERO CC[C@H]1CCCC[C@H]1[NH2+]Cc1ccc(Cl)c(Cl)c1 ZINC000035256742 172086950 /nfs/dbraw/zinc/08/69/50/172086950.db2.gz UAWLNAGNUXIJBU-SWLSCSKDSA-N 1 0 286.246 5.052 10 0 CKAERO CC[C@@H]1CCCC[C@@H]1[NH2+]Cc1cccc(Cl)c1Cl ZINC000035257007 172087731 /nfs/dbraw/zinc/08/77/31/172087731.db2.gz CZSCESJAGRPGCI-RISCZKNCSA-N 1 0 286.246 5.052 10 0 CKAERO CC[C@H]1CCCC[C@@H]1[NH2+]Cc1cccc(Cl)c1Cl ZINC000035257008 172087724 /nfs/dbraw/zinc/08/77/24/172087724.db2.gz CZSCESJAGRPGCI-FZMZJTMJSA-N 1 0 286.246 5.052 10 0 CKAERO CC[C@@H]1CCCC[C@H]1[NH2+]Cc1cccc(Cl)c1Cl ZINC000035257009 172087741 /nfs/dbraw/zinc/08/77/41/172087741.db2.gz CZSCESJAGRPGCI-BXUZGUMPSA-N 1 0 286.246 5.052 10 0 CKAERO CC[C@H]1CCCC[C@H]1[NH2+]Cc1cccc(Cl)c1Cl ZINC000035257010 172087639 /nfs/dbraw/zinc/08/76/39/172087639.db2.gz CZSCESJAGRPGCI-SMDDNHRTSA-N 1 0 286.246 5.052 10 0 CKAERO CC[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc(Cl)cc1Cl ZINC000035257011 172087420 /nfs/dbraw/zinc/08/74/20/172087420.db2.gz KNUNYYLVLIUOKR-ABAIWWIYSA-N 1 0 286.246 5.052 10 0 CKAERO CC[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(Cl)cc1Cl ZINC000035257012 172087290 /nfs/dbraw/zinc/08/72/90/172087290.db2.gz KNUNYYLVLIUOKR-NHYWBVRUSA-N 1 0 286.246 5.052 10 0 CKAERO CC[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(Cl)cc1Cl ZINC000035257013 172087267 /nfs/dbraw/zinc/08/72/67/172087267.db2.gz KNUNYYLVLIUOKR-IAQYHMDHSA-N 1 0 286.246 5.052 10 0 CKAERO CC[C@H]1CCCC[C@H]1[NH2+]Cc1ccc(Cl)cc1Cl ZINC000035257014 172087678 /nfs/dbraw/zinc/08/76/78/172087678.db2.gz KNUNYYLVLIUOKR-XHDPSFHLSA-N 1 0 286.246 5.052 10 0 CKAERO CC(C)(C)CC(C)(C)[NH2+]Cc1ccc(C(F)(F)F)cc1 ZINC000035257248 172088047 /nfs/dbraw/zinc/08/80/47/172088047.db2.gz YKXPXKSEUBXFES-UHFFFAOYSA-N 1 0 287.369 5.010 10 0 CKAERO CC(C)(C)CC(C)(C)[NH2+]Cc1ccc(C(C)(C)C)cc1 ZINC000035257252 172087994 /nfs/dbraw/zinc/08/79/94/172087994.db2.gz GTMMPCUBXVVFEW-UHFFFAOYSA-N 1 0 275.480 5.289 10 0 CKAERO CC(C)(C)CC(C)(C)[NH2+]Cc1ccc2ccccc2c1 ZINC000035257275 172088385 /nfs/dbraw/zinc/08/83/85/172088385.db2.gz ZRYICBAJAGGGSG-UHFFFAOYSA-N 1 0 269.432 5.144 10 0 CKAERO C[C@@H]1C[C@H]([NH2+]C(C)(C)CC(C)(C)C)CC(C)(C)C1 ZINC000035257296 172088336 /nfs/dbraw/zinc/08/83/36/172088336.db2.gz GQAMORSQCZAYRS-KGLIPLIRSA-N 1 0 253.474 5.006 10 0 CKAERO C[C@H]1C[C@H]([NH2+]C(C)(C)CC(C)(C)C)CC(C)(C)C1 ZINC000035257297 172088027 /nfs/dbraw/zinc/08/80/27/172088027.db2.gz GQAMORSQCZAYRS-KBPBESRZSA-N 1 0 253.474 5.006 10 0 CKAERO C[C@@H]1C[C@@H]([NH2+]C(C)(C)CC(C)(C)C)CC(C)(C)C1 ZINC000035257298 172088133 /nfs/dbraw/zinc/08/81/33/172088133.db2.gz GQAMORSQCZAYRS-ZIAGYGMSSA-N 1 0 253.474 5.006 10 0 CKAERO C[C@H]1C[C@@H]([NH2+]C(C)(C)CC(C)(C)C)CC(C)(C)C1 ZINC000035257299 172087846 /nfs/dbraw/zinc/08/78/46/172087846.db2.gz GQAMORSQCZAYRS-UONOGXRCSA-N 1 0 253.474 5.006 10 0 CKAERO CCCC1CCC([NH2+]C(C)(C)CC(C)(C)C)CC1 ZINC000035257336 172088070 /nfs/dbraw/zinc/08/80/70/172088070.db2.gz LJNSQQHTRHYHEY-UHFFFAOYSA-N 1 0 253.474 5.150 10 0 CKAERO CC(C)(C)CC(C)(C)[NH2+]C1CCC(C(C)(C)C)CC1 ZINC000035257339 172088420 /nfs/dbraw/zinc/08/84/20/172088420.db2.gz HBIOLGDNXQNAPT-UHFFFAOYSA-N 1 0 267.501 5.396 10 0 CKAERO CC(C)c1ccc(C[NH2+][C@@H]2CCC[C@H](C(F)(F)F)C2)cc1 ZINC000035257654 330244845 /nfs/dbraw/zinc/24/48/45/330244845.db2.gz NJFYHLFRGCTGOC-JKSUJKDBSA-N 1 0 299.380 5.021 10 0 CKAERO CC(C)c1ccc(C[NH2+][C@H]2CCC[C@H](C(F)(F)F)C2)cc1 ZINC000035257655 330244775 /nfs/dbraw/zinc/24/47/75/330244775.db2.gz NJFYHLFRGCTGOC-HOTGVXAUSA-N 1 0 299.380 5.021 10 0 CKAERO CC(C)c1ccc(C[NH2+][C@@H]2CCC[C@@H](C(F)(F)F)C2)cc1 ZINC000035257656 330244782 /nfs/dbraw/zinc/24/47/82/330244782.db2.gz NJFYHLFRGCTGOC-HZPDHXFCSA-N 1 0 299.380 5.021 10 0 CKAERO CC(C)c1ccc(C[NH2+][C@H]2CCC[C@@H](C(F)(F)F)C2)cc1 ZINC000035257657 330244799 /nfs/dbraw/zinc/24/47/99/330244799.db2.gz NJFYHLFRGCTGOC-CVEARBPZSA-N 1 0 299.380 5.021 10 0 CKAERO CC(C)c1ccc(C[NH2+]C2CCC(C(F)(F)F)CC2)cc1 ZINC000035258378 330245148 /nfs/dbraw/zinc/24/51/48/330245148.db2.gz PBGQSFOILGBWMR-UHFFFAOYSA-N 1 0 299.380 5.021 10 0 CKAERO CCCC1CCC([NH2+]C2CCC(C(F)(F)F)CC2)CC1 ZINC000035258446 330245129 /nfs/dbraw/zinc/24/51/29/330245129.db2.gz JTTARVDLKIVMNF-UHFFFAOYSA-N 1 0 291.401 5.056 10 0 CKAERO CCC[C@H]([NH2+]C)c1ccc(-c2cc(Cl)ccc2F)s1 ZINC000035284875 172103362 /nfs/dbraw/zinc/10/33/62/172103362.db2.gz JIOJZQSJAKZYKS-ZDUSSCGKSA-N 1 0 297.826 5.268 10 0 CKAERO CCC[C@@H]([NH2+]C)c1ccc(-c2cc(Cl)ccc2F)s1 ZINC000035284877 172103185 /nfs/dbraw/zinc/10/31/85/172103185.db2.gz JIOJZQSJAKZYKS-CYBMUJFWSA-N 1 0 297.826 5.268 10 0 CKAERO CC[NH2+][C@@H](CC)c1ccc(-c2cc(Cl)ccc2F)s1 ZINC000035284881 172103645 /nfs/dbraw/zinc/10/36/45/172103645.db2.gz YYJTUDOAEQMZLH-ZDUSSCGKSA-N 1 0 297.826 5.268 10 0 CKAERO CC[NH2+][C@H](CC)c1ccc(-c2cc(Cl)ccc2F)s1 ZINC000035284883 172103223 /nfs/dbraw/zinc/10/32/23/172103223.db2.gz YYJTUDOAEQMZLH-CYBMUJFWSA-N 1 0 297.826 5.268 10 0 CKAERO CC(C)c1ccc([C@H]([NH3+])c2ccsc2)c(C(C)C)c1 ZINC000035380696 172163390 /nfs/dbraw/zinc/16/33/90/172163390.db2.gz RDCFJNNPXCWDAP-QGZVFWFLSA-N 1 0 273.445 5.043 10 0 CKAERO CC(C)c1ccc([C@@H]([NH3+])c2ccsc2)c(C(C)C)c1 ZINC000035380698 172163381 /nfs/dbraw/zinc/16/33/81/172163381.db2.gz RDCFJNNPXCWDAP-KRWDZBQOSA-N 1 0 273.445 5.043 10 0 CKAERO CC(C)c1ccc([C@H]([NH3+])c2cccs2)c(C(C)C)c1 ZINC000035380746 172163488 /nfs/dbraw/zinc/16/34/88/172163488.db2.gz CUXIYCVXDWYEJD-KRWDZBQOSA-N 1 0 273.445 5.043 10 0 CKAERO CC(C)c1ccc([C@@H]([NH3+])c2cccs2)c(C(C)C)c1 ZINC000035380748 172163518 /nfs/dbraw/zinc/16/35/18/172163518.db2.gz CUXIYCVXDWYEJD-QGZVFWFLSA-N 1 0 273.445 5.043 10 0 CKAERO CCc1ccc([C@@H](C[C@@H](C)CC(C)(C)C)[NH2+]C)s1 ZINC000035460665 172209153 /nfs/dbraw/zinc/20/91/53/172209153.db2.gz GOXRABLZPYWAIT-TZMCWYRMSA-N 1 0 267.482 5.033 10 0 CKAERO CCc1ccc([C@H](C[C@@H](C)CC(C)(C)C)[NH2+]C)s1 ZINC000035460668 172209390 /nfs/dbraw/zinc/20/93/90/172209390.db2.gz GOXRABLZPYWAIT-OCCSQVGLSA-N 1 0 267.482 5.033 10 0 CKAERO CCc1ccc([C@@H](C[C@H](C)CC(C)(C)C)[NH2+]C)s1 ZINC000035460670 172209210 /nfs/dbraw/zinc/20/92/10/172209210.db2.gz GOXRABLZPYWAIT-GXTWGEPZSA-N 1 0 267.482 5.033 10 0 CKAERO CCc1ccc([C@H](C[C@H](C)CC(C)(C)C)[NH2+]C)s1 ZINC000035460672 172209008 /nfs/dbraw/zinc/20/90/08/172209008.db2.gz GOXRABLZPYWAIT-JSGCOSHPSA-N 1 0 267.482 5.033 10 0 CKAERO C[NH2+][C@@H](C[C@H](C)CC(C)(C)C)c1ccc(Cl)cc1 ZINC000035464158 172212224 /nfs/dbraw/zinc/21/22/24/172212224.db2.gz XBMQCGDSTVAFAE-WFASDCNBSA-N 1 0 267.844 5.063 10 0 CKAERO C[NH2+][C@@H](C[C@@H](C)CC(C)(C)C)c1ccc(Cl)cc1 ZINC000035464161 172212681 /nfs/dbraw/zinc/21/26/81/172212681.db2.gz XBMQCGDSTVAFAE-DOMZBBRYSA-N 1 0 267.844 5.063 10 0 CKAERO C[NH2+][C@H](C[C@H](C)CC(C)(C)C)c1ccc(Cl)cc1 ZINC000035464164 172212655 /nfs/dbraw/zinc/21/26/55/172212655.db2.gz XBMQCGDSTVAFAE-SWLSCSKDSA-N 1 0 267.844 5.063 10 0 CKAERO C[NH2+][C@H](C[C@@H](C)CC(C)(C)C)c1ccc(Cl)cc1 ZINC000035464166 172212099 /nfs/dbraw/zinc/21/20/99/172212099.db2.gz XBMQCGDSTVAFAE-IUODEOHRSA-N 1 0 267.844 5.063 10 0 CKAERO CCCCC[C@H]([NH2+]C)c1c(C)c(C)c(C)c(C)c1C ZINC000035467653 172216272 /nfs/dbraw/zinc/21/62/72/172216272.db2.gz AYFLPPUVBDDWJF-KRWDZBQOSA-N 1 0 261.453 5.070 10 0 CKAERO CCCCC[C@@H]([NH2+]C)c1c(C)c(C)c(C)c(C)c1C ZINC000035467654 172215801 /nfs/dbraw/zinc/21/58/01/172215801.db2.gz AYFLPPUVBDDWJF-QGZVFWFLSA-N 1 0 261.453 5.070 10 0 CKAERO C[NH2+][C@H](C[C@@H](C)CC(C)(C)C)c1ccc(C)cc1C ZINC000035468091 172216529 /nfs/dbraw/zinc/21/65/29/172216529.db2.gz XRMFNZQWJFLNFU-RHSMWYFYSA-N 1 0 261.453 5.026 10 0 CKAERO C[NH2+][C@@H](C[C@@H](C)CC(C)(C)C)c1ccc(C)cc1C ZINC000035468093 172217061 /nfs/dbraw/zinc/21/70/61/172217061.db2.gz XRMFNZQWJFLNFU-PBHICJAKSA-N 1 0 261.453 5.026 10 0 CKAERO C[NH2+][C@H](C[C@H](C)CC(C)(C)C)c1ccc(C)cc1C ZINC000035468094 172217026 /nfs/dbraw/zinc/21/70/26/172217026.db2.gz XRMFNZQWJFLNFU-WMLDXEAASA-N 1 0 261.453 5.026 10 0 CKAERO C[NH2+][C@@H](C[C@H](C)CC(C)(C)C)c1ccc(C)cc1C ZINC000035468096 172216484 /nfs/dbraw/zinc/21/64/84/172216484.db2.gz XRMFNZQWJFLNFU-YOEHRIQHSA-N 1 0 261.453 5.026 10 0 CKAERO CCCCC1CCC([C@H]([NH2+]C)c2cccs2)CC1 ZINC000035488076 172223049 /nfs/dbraw/zinc/22/30/49/172223049.db2.gz FGHBZEXSCUDOJM-XUJLQICISA-N 1 0 265.466 5.005 10 0 CKAERO CCCCC1CCC([C@@H]([NH2+]C)c2cccs2)CC1 ZINC000035488078 172223176 /nfs/dbraw/zinc/22/31/76/172223176.db2.gz FGHBZEXSCUDOJM-ZBCRRDGASA-N 1 0 265.466 5.005 10 0 CKAERO C[NH2+][C@H](C[C@@H](C)CC(C)(C)C)c1cc(C)ccc1C ZINC000035489522 172224837 /nfs/dbraw/zinc/22/48/37/172224837.db2.gz AJONEDXLLAQPPG-RHSMWYFYSA-N 1 0 261.453 5.026 10 0 CKAERO C[NH2+][C@@H](C[C@@H](C)CC(C)(C)C)c1cc(C)ccc1C ZINC000035489525 172225103 /nfs/dbraw/zinc/22/51/03/172225103.db2.gz AJONEDXLLAQPPG-PBHICJAKSA-N 1 0 261.453 5.026 10 0 CKAERO C[NH2+][C@H](C[C@H](C)CC(C)(C)C)c1cc(C)ccc1C ZINC000035489528 172224770 /nfs/dbraw/zinc/22/47/70/172224770.db2.gz AJONEDXLLAQPPG-WMLDXEAASA-N 1 0 261.453 5.026 10 0 CKAERO C[NH2+][C@@H](C[C@H](C)CC(C)(C)C)c1cc(C)ccc1C ZINC000035489532 172224956 /nfs/dbraw/zinc/22/49/56/172224956.db2.gz AJONEDXLLAQPPG-YOEHRIQHSA-N 1 0 261.453 5.026 10 0 CKAERO CC[C@@H](C)[C@H]([NH2+]C)c1ccc(C2CCCCC2)cc1 ZINC000035496495 172229883 /nfs/dbraw/zinc/22/98/83/172229883.db2.gz GDWNFKQPDLBWHB-KDOFPFPSSA-N 1 0 259.437 5.041 10 0 CKAERO CC[C@H](C)[C@H]([NH2+]C)c1ccc(C2CCCCC2)cc1 ZINC000035496497 172229484 /nfs/dbraw/zinc/22/94/84/172229484.db2.gz GDWNFKQPDLBWHB-KSSFIOAISA-N 1 0 259.437 5.041 10 0 CKAERO CC[C@@H](C)[C@@H]([NH2+]C)c1ccc(C2CCCCC2)cc1 ZINC000035496498 172229682 /nfs/dbraw/zinc/22/96/82/172229682.db2.gz GDWNFKQPDLBWHB-RDTXWAMCSA-N 1 0 259.437 5.041 10 0 CKAERO CC[C@H](C)[C@@H]([NH2+]C)c1ccc(C2CCCCC2)cc1 ZINC000035496500 172229334 /nfs/dbraw/zinc/22/93/34/172229334.db2.gz GDWNFKQPDLBWHB-KBXCAEBGSA-N 1 0 259.437 5.041 10 0 CKAERO C[NH2+][C@H](C[C@@H](C)CC(C)(C)C)c1cc(C)sc1C ZINC000035497500 172230928 /nfs/dbraw/zinc/23/09/28/172230928.db2.gz JXHUUKRYIRRWPA-IAQYHMDHSA-N 1 0 267.482 5.088 10 0 CKAERO C[NH2+][C@@H](C[C@@H](C)CC(C)(C)C)c1cc(C)sc1C ZINC000035497502 172230351 /nfs/dbraw/zinc/23/03/51/172230351.db2.gz JXHUUKRYIRRWPA-ABAIWWIYSA-N 1 0 267.482 5.088 10 0 CKAERO C[NH2+][C@H](C[C@H](C)CC(C)(C)C)c1cc(C)sc1C ZINC000035497504 172230431 /nfs/dbraw/zinc/23/04/31/172230431.db2.gz JXHUUKRYIRRWPA-XHDPSFHLSA-N 1 0 267.482 5.088 10 0 CKAERO C[NH2+][C@@H](C[C@H](C)CC(C)(C)C)c1cc(C)sc1C ZINC000035497506 172230738 /nfs/dbraw/zinc/23/07/38/172230738.db2.gz JXHUUKRYIRRWPA-NHYWBVRUSA-N 1 0 267.482 5.088 10 0 CKAERO C[NH2+][C@@H](C[C@H](C)CC(C)(C)C)c1ccc(Cl)s1 ZINC000035498043 172231204 /nfs/dbraw/zinc/23/12/04/172231204.db2.gz HBAXJTWRCBYWJA-QWRGUYRKSA-N 1 0 273.873 5.124 10 0 CKAERO C[NH2+][C@@H](C[C@@H](C)CC(C)(C)C)c1ccc(Cl)s1 ZINC000035498045 172231311 /nfs/dbraw/zinc/23/13/11/172231311.db2.gz HBAXJTWRCBYWJA-MNOVXSKESA-N 1 0 273.873 5.124 10 0 CKAERO C[NH2+][C@H](C[C@H](C)CC(C)(C)C)c1ccc(Cl)s1 ZINC000035498047 172231123 /nfs/dbraw/zinc/23/11/23/172231123.db2.gz HBAXJTWRCBYWJA-WDEREUQCSA-N 1 0 273.873 5.124 10 0 CKAERO C[NH2+][C@H](C[C@@H](C)CC(C)(C)C)c1ccc(Cl)s1 ZINC000035498049 172231257 /nfs/dbraw/zinc/23/12/57/172231257.db2.gz HBAXJTWRCBYWJA-GHMZBOCLSA-N 1 0 273.873 5.124 10 0 CKAERO C[NH2+][C@@H](CCC1CCCCC1)c1ccc(Cl)s1 ZINC000035498274 172231348 /nfs/dbraw/zinc/23/13/48/172231348.db2.gz QZVXMNDVTWXLCH-LBPRGKRZSA-N 1 0 271.857 5.023 10 0 CKAERO C[NH2+][C@H](CCC1CCCCC1)c1ccc(Cl)s1 ZINC000035498277 172231344 /nfs/dbraw/zinc/23/13/44/172231344.db2.gz QZVXMNDVTWXLCH-GFCCVEGCSA-N 1 0 271.857 5.023 10 0 CKAERO CCCC[C@@H](CC)[C@H]([NH2+]C)c1ccc(Cl)c(Cl)c1 ZINC000035501490 172235408 /nfs/dbraw/zinc/23/54/08/172235408.db2.gz BPLBBYGTLBRHQK-ABAIWWIYSA-N 1 0 288.262 5.470 10 0 CKAERO CCCC[C@H](CC)[C@H]([NH2+]C)c1ccc(Cl)c(Cl)c1 ZINC000035501491 172235897 /nfs/dbraw/zinc/23/58/97/172235897.db2.gz BPLBBYGTLBRHQK-NHYWBVRUSA-N 1 0 288.262 5.470 10 0 CKAERO CCCC[C@@H](CC)[C@@H]([NH2+]C)c1ccc(Cl)c(Cl)c1 ZINC000035501492 172235924 /nfs/dbraw/zinc/23/59/24/172235924.db2.gz BPLBBYGTLBRHQK-IAQYHMDHSA-N 1 0 288.262 5.470 10 0 CKAERO CCCC[C@H](CC)[C@@H]([NH2+]C)c1ccc(Cl)c(Cl)c1 ZINC000035501493 172235843 /nfs/dbraw/zinc/23/58/43/172235843.db2.gz BPLBBYGTLBRHQK-XHDPSFHLSA-N 1 0 288.262 5.470 10 0 CKAERO C[NH2+][C@@H](CC1CCCCC1)c1ccc(Cl)c(Cl)c1 ZINC000035501504 172235441 /nfs/dbraw/zinc/23/54/41/172235441.db2.gz DOQPQEIFDSKQBR-HNNXBMFYSA-N 1 0 286.246 5.224 10 0 CKAERO C[NH2+][C@H](CC1CCCCC1)c1ccc(Cl)c(Cl)c1 ZINC000035501505 172235746 /nfs/dbraw/zinc/23/57/46/172235746.db2.gz DOQPQEIFDSKQBR-OAHLLOKOSA-N 1 0 286.246 5.224 10 0 CKAERO C[NH2+][C@@H](CCC1CCCC1)c1ccc(Cl)c(Cl)c1 ZINC000035501570 172235871 /nfs/dbraw/zinc/23/58/71/172235871.db2.gz APOVDAUFSFALRA-HNNXBMFYSA-N 1 0 286.246 5.224 10 0 CKAERO C[NH2+][C@H](CCC1CCCC1)c1ccc(Cl)c(Cl)c1 ZINC000035501571 172235595 /nfs/dbraw/zinc/23/55/95/172235595.db2.gz APOVDAUFSFALRA-OAHLLOKOSA-N 1 0 286.246 5.224 10 0 CKAERO CCCC[C@@H](CC)[C@H]([NH2+]C)c1cc(Cl)ccc1Cl ZINC000035501857 172236227 /nfs/dbraw/zinc/23/62/27/172236227.db2.gz PGWFSWQPZGHFBK-ABAIWWIYSA-N 1 0 288.262 5.470 10 0 CKAERO CCCC[C@H](CC)[C@H]([NH2+]C)c1cc(Cl)ccc1Cl ZINC000035501858 172236897 /nfs/dbraw/zinc/23/68/97/172236897.db2.gz PGWFSWQPZGHFBK-NHYWBVRUSA-N 1 0 288.262 5.470 10 0 CKAERO CCCC[C@@H](CC)[C@@H]([NH2+]C)c1cc(Cl)ccc1Cl ZINC000035501859 172236632 /nfs/dbraw/zinc/23/66/32/172236632.db2.gz PGWFSWQPZGHFBK-IAQYHMDHSA-N 1 0 288.262 5.470 10 0 CKAERO CCCC[C@H](CC)[C@@H]([NH2+]C)c1cc(Cl)ccc1Cl ZINC000035501860 172236728 /nfs/dbraw/zinc/23/67/28/172236728.db2.gz PGWFSWQPZGHFBK-XHDPSFHLSA-N 1 0 288.262 5.470 10 0 CKAERO C[NH2+][C@@H](CC1CCCCC1)c1cc(Cl)ccc1Cl ZINC000035501871 172236371 /nfs/dbraw/zinc/23/63/71/172236371.db2.gz ZCCDQKQYPBTWAZ-HNNXBMFYSA-N 1 0 286.246 5.224 10 0 CKAERO C[NH2+][C@H](CC1CCCCC1)c1cc(Cl)ccc1Cl ZINC000035501872 172236569 /nfs/dbraw/zinc/23/65/69/172236569.db2.gz ZCCDQKQYPBTWAZ-OAHLLOKOSA-N 1 0 286.246 5.224 10 0 CKAERO C[NH2+][C@@H](CCC1CCCC1)c1cc(Cl)ccc1Cl ZINC000035501937 172236711 /nfs/dbraw/zinc/23/67/11/172236711.db2.gz JFNXNVPAMPRLRI-HNNXBMFYSA-N 1 0 286.246 5.224 10 0 CKAERO C[NH2+][C@H](CCC1CCCC1)c1cc(Cl)ccc1Cl ZINC000035501938 172236621 /nfs/dbraw/zinc/23/66/21/172236621.db2.gz JFNXNVPAMPRLRI-OAHLLOKOSA-N 1 0 286.246 5.224 10 0 CKAERO CCCC[C@@H](CC)[C@H]([NH2+]C)c1cc(Cl)sc1Cl ZINC000035502109 172236351 /nfs/dbraw/zinc/23/63/51/172236351.db2.gz OMNUWHGXZUXWSQ-SKDRFNHKSA-N 1 0 294.291 5.532 10 0 CKAERO CCCC[C@H](CC)[C@H]([NH2+]C)c1cc(Cl)sc1Cl ZINC000035502111 172236417 /nfs/dbraw/zinc/23/64/17/172236417.db2.gz OMNUWHGXZUXWSQ-CABZTGNLSA-N 1 0 294.291 5.532 10 0 CKAERO CCCC[C@@H](CC)[C@@H]([NH2+]C)c1cc(Cl)sc1Cl ZINC000035502112 172236273 /nfs/dbraw/zinc/23/62/73/172236273.db2.gz OMNUWHGXZUXWSQ-BXKDBHETSA-N 1 0 294.291 5.532 10 0 CKAERO CCCC[C@H](CC)[C@@H]([NH2+]C)c1cc(Cl)sc1Cl ZINC000035502113 172236335 /nfs/dbraw/zinc/23/63/35/172236335.db2.gz OMNUWHGXZUXWSQ-JOYOIKCWSA-N 1 0 294.291 5.532 10 0 CKAERO C[NH2+][C@@H](CC1CCCCC1)c1cc(Cl)sc1Cl ZINC000035502130 172236838 /nfs/dbraw/zinc/23/68/38/172236838.db2.gz GURVBGRJRCBJRG-NSHDSACASA-N 1 0 292.275 5.286 10 0 CKAERO C[NH2+][C@H](CC1CCCCC1)c1cc(Cl)sc1Cl ZINC000035502131 172236532 /nfs/dbraw/zinc/23/65/32/172236532.db2.gz GURVBGRJRCBJRG-LLVKDONJSA-N 1 0 292.275 5.286 10 0 CKAERO C[NH2+][C@@H](CCC1CCCC1)c1cc(Cl)sc1Cl ZINC000035502215 172237613 /nfs/dbraw/zinc/23/76/13/172237613.db2.gz SAUXSCSGKIKDLF-NSHDSACASA-N 1 0 292.275 5.286 10 0 CKAERO C[NH2+][C@H](CCC1CCCC1)c1cc(Cl)sc1Cl ZINC000035502216 172237179 /nfs/dbraw/zinc/23/71/79/172237179.db2.gz SAUXSCSGKIKDLF-LLVKDONJSA-N 1 0 292.275 5.286 10 0 CKAERO CC[NH2+][C@@H](C[C@@H](C)CC(C)(C)C)c1ccc(C)s1 ZINC000035510038 172241780 /nfs/dbraw/zinc/24/17/80/172241780.db2.gz PJPVGTBVKNIHTH-OCCSQVGLSA-N 1 0 267.482 5.170 10 0 CKAERO CC[NH2+][C@H](C[C@@H](C)CC(C)(C)C)c1ccc(C)s1 ZINC000035510040 172241632 /nfs/dbraw/zinc/24/16/32/172241632.db2.gz PJPVGTBVKNIHTH-TZMCWYRMSA-N 1 0 267.482 5.170 10 0 CKAERO CC[NH2+][C@@H](C[C@H](C)CC(C)(C)C)c1ccc(C)s1 ZINC000035510042 172241660 /nfs/dbraw/zinc/24/16/60/172241660.db2.gz PJPVGTBVKNIHTH-JSGCOSHPSA-N 1 0 267.482 5.170 10 0 CKAERO CC[NH2+][C@H](C[C@H](C)CC(C)(C)C)c1ccc(C)s1 ZINC000035510044 172241612 /nfs/dbraw/zinc/24/16/12/172241612.db2.gz PJPVGTBVKNIHTH-GXTWGEPZSA-N 1 0 267.482 5.170 10 0 CKAERO CC[NH2+][C@@H](CCC1CCCCC1)c1ccc(C)s1 ZINC000035510214 172241644 /nfs/dbraw/zinc/24/16/44/172241644.db2.gz AEHDDKDQZAKNGC-HNNXBMFYSA-N 1 0 265.466 5.068 10 0 CKAERO CC[NH2+][C@H](CCC1CCCCC1)c1ccc(C)s1 ZINC000035510216 172241816 /nfs/dbraw/zinc/24/18/16/172241816.db2.gz AEHDDKDQZAKNGC-OAHLLOKOSA-N 1 0 265.466 5.068 10 0 CKAERO CCCC[C@@H](CC)[C@H]([NH2+]CC)c1ccc(CC)s1 ZINC000035537448 172244193 /nfs/dbraw/zinc/24/41/93/172244193.db2.gz NUMZJVANVKYKSQ-CJNGLKHVSA-N 1 0 267.482 5.178 10 0 CKAERO CCCC[C@H](CC)[C@H]([NH2+]CC)c1ccc(CC)s1 ZINC000035537451 172244082 /nfs/dbraw/zinc/24/40/82/172244082.db2.gz NUMZJVANVKYKSQ-BBRMVZONSA-N 1 0 267.482 5.178 10 0 CKAERO CCCC[C@@H](CC)[C@@H]([NH2+]CC)c1ccc(CC)s1 ZINC000035537454 172244072 /nfs/dbraw/zinc/24/40/72/172244072.db2.gz NUMZJVANVKYKSQ-CZUORRHYSA-N 1 0 267.482 5.178 10 0 CKAERO CCCC[C@H](CC)[C@@H]([NH2+]CC)c1ccc(CC)s1 ZINC000035537456 172244260 /nfs/dbraw/zinc/24/42/60/172244260.db2.gz NUMZJVANVKYKSQ-XJKSGUPXSA-N 1 0 267.482 5.178 10 0 CKAERO CC[NH2+][C@@H](C[C@@H](C)CC(C)(C)C)c1ccc(Cl)cc1 ZINC000035540201 172246128 /nfs/dbraw/zinc/24/61/28/172246128.db2.gz PNIFDZLAPSUZTH-CJNGLKHVSA-N 1 0 281.871 5.453 10 0 CKAERO CC[NH2+][C@H](C[C@@H](C)CC(C)(C)C)c1ccc(Cl)cc1 ZINC000035540202 172246481 /nfs/dbraw/zinc/24/64/81/172246481.db2.gz PNIFDZLAPSUZTH-CZUORRHYSA-N 1 0 281.871 5.453 10 0 CKAERO CC[NH2+][C@@H](C[C@H](C)CC(C)(C)C)c1ccc(Cl)cc1 ZINC000035540204 172246113 /nfs/dbraw/zinc/24/61/13/172246113.db2.gz PNIFDZLAPSUZTH-BBRMVZONSA-N 1 0 281.871 5.453 10 0 CKAERO CC[NH2+][C@H](C[C@H](C)CC(C)(C)C)c1ccc(Cl)cc1 ZINC000035540205 172246495 /nfs/dbraw/zinc/24/64/95/172246495.db2.gz PNIFDZLAPSUZTH-XJKSGUPXSA-N 1 0 281.871 5.453 10 0 CKAERO CCCC[C@@H](CC)[C@H]([NH2+]CC)c1ccc(Cl)cc1 ZINC000035540208 172246580 /nfs/dbraw/zinc/24/65/80/172246580.db2.gz HEMBICUHHBCHKM-CJNGLKHVSA-N 1 0 267.844 5.207 10 0 CKAERO CCCC[C@H](CC)[C@H]([NH2+]CC)c1ccc(Cl)cc1 ZINC000035540209 172246374 /nfs/dbraw/zinc/24/63/74/172246374.db2.gz HEMBICUHHBCHKM-BBRMVZONSA-N 1 0 267.844 5.207 10 0 CKAERO CCCC[C@@H](CC)[C@@H]([NH2+]CC)c1ccc(Cl)cc1 ZINC000035540210 172246566 /nfs/dbraw/zinc/24/65/66/172246566.db2.gz HEMBICUHHBCHKM-CZUORRHYSA-N 1 0 267.844 5.207 10 0 CKAERO CCCC[C@H](CC)[C@@H]([NH2+]CC)c1ccc(Cl)cc1 ZINC000035540211 172246591 /nfs/dbraw/zinc/24/65/91/172246591.db2.gz HEMBICUHHBCHKM-XJKSGUPXSA-N 1 0 267.844 5.207 10 0 CKAERO CC[NH2+][C@@H](CCC1CCCCC1)c1ccc(C)cc1 ZINC000035541070 172248007 /nfs/dbraw/zinc/24/80/07/172248007.db2.gz MEKVUAIHNUNECZ-SFHVURJKSA-N 1 0 259.437 5.006 10 0 CKAERO CC[NH2+][C@H](CCC1CCCCC1)c1ccc(C)cc1 ZINC000035541071 172248212 /nfs/dbraw/zinc/24/82/12/172248212.db2.gz MEKVUAIHNUNECZ-GOSISDBHSA-N 1 0 259.437 5.006 10 0 CKAERO CC[NH2+][C@@H](c1ccc(C)cc1)c1cccc(Cl)c1Cl ZINC000035541171 172248635 /nfs/dbraw/zinc/24/86/35/172248635.db2.gz WRHLYZLNQIDHCM-INIZCTEOSA-N 1 0 294.225 5.001 10 0 CKAERO CC[NH2+][C@H](c1ccc(C)cc1)c1cccc(Cl)c1Cl ZINC000035541172 172248440 /nfs/dbraw/zinc/24/84/40/172248440.db2.gz WRHLYZLNQIDHCM-MRXNPFEDSA-N 1 0 294.225 5.001 10 0 CKAERO CCCCC[C@H]([NH2+]CC)c1ccc([C@@H](C)CC)cc1 ZINC000035544120 172251856 /nfs/dbraw/zinc/25/18/56/172251856.db2.gz PCKJUBMZAKTFJK-YJBOKZPZSA-N 1 0 261.453 5.431 10 0 CKAERO CCCCC[C@@H]([NH2+]CC)c1ccc([C@@H](C)CC)cc1 ZINC000035544122 172251717 /nfs/dbraw/zinc/25/17/17/172251717.db2.gz PCKJUBMZAKTFJK-MAUKXSAKSA-N 1 0 261.453 5.431 10 0 CKAERO CCCCC[C@H]([NH2+]CC)c1ccc([C@H](C)CC)cc1 ZINC000035544124 172251651 /nfs/dbraw/zinc/25/16/51/172251651.db2.gz PCKJUBMZAKTFJK-QAPCUYQASA-N 1 0 261.453 5.431 10 0 CKAERO CCCCC[C@@H]([NH2+]CC)c1ccc([C@H](C)CC)cc1 ZINC000035544126 172251408 /nfs/dbraw/zinc/25/14/08/172251408.db2.gz PCKJUBMZAKTFJK-CRAIPNDOSA-N 1 0 261.453 5.431 10 0 CKAERO CCC[C@@H](C)[C@H]([NH2+]CC)c1ccc([C@@H](C)CC)cc1 ZINC000035544159 172251880 /nfs/dbraw/zinc/25/18/80/172251880.db2.gz OSUCKQNCWZLLEE-DAYGRLMNSA-N 1 0 261.453 5.287 10 0 CKAERO CCC[C@H](C)[C@H]([NH2+]CC)c1ccc([C@@H](C)CC)cc1 ZINC000035544161 172251972 /nfs/dbraw/zinc/25/19/72/172251972.db2.gz OSUCKQNCWZLLEE-MPGHIAIKSA-N 1 0 261.453 5.287 10 0 CKAERO CCC[C@@H](C)[C@@H]([NH2+]CC)c1ccc([C@@H](C)CC)cc1 ZINC000035544163 172251424 /nfs/dbraw/zinc/25/14/24/172251424.db2.gz OSUCKQNCWZLLEE-HDMKZQKVSA-N 1 0 261.453 5.287 10 0 CKAERO CCC[C@H](C)[C@@H]([NH2+]CC)c1ccc([C@@H](C)CC)cc1 ZINC000035544166 172251748 /nfs/dbraw/zinc/25/17/48/172251748.db2.gz OSUCKQNCWZLLEE-RLFYNMQTSA-N 1 0 261.453 5.287 10 0 CKAERO CC[NH2+][C@@H](c1ccc([C@H](C)CC)cc1)C1CCCC1 ZINC000035544383 172252634 /nfs/dbraw/zinc/25/26/34/172252634.db2.gz AMHHCPUTBMNEEE-RDTXWAMCSA-N 1 0 259.437 5.041 10 0 CKAERO CC[NH2+][C@@H](c1ccc([C@@H](C)CC)cc1)C1CCCC1 ZINC000035544386 172252416 /nfs/dbraw/zinc/25/24/16/172252416.db2.gz AMHHCPUTBMNEEE-KBXCAEBGSA-N 1 0 259.437 5.041 10 0 CKAERO CC[NH2+][C@H](c1ccc([C@H](C)CC)cc1)C1CCCC1 ZINC000035544389 172252742 /nfs/dbraw/zinc/25/27/42/172252742.db2.gz AMHHCPUTBMNEEE-KDOFPFPSSA-N 1 0 259.437 5.041 10 0 CKAERO CC[NH2+][C@H](c1ccc([C@@H](C)CC)cc1)C1CCCC1 ZINC000035544391 172252695 /nfs/dbraw/zinc/25/26/95/172252695.db2.gz AMHHCPUTBMNEEE-KSSFIOAISA-N 1 0 259.437 5.041 10 0 CKAERO CCCC[C@@H](CC)[C@H]([NH2+]CC)c1cc(C)ccc1C ZINC000035546402 172254150 /nfs/dbraw/zinc/25/41/50/172254150.db2.gz UXXLJBTVAAPMMT-AEFFLSMTSA-N 1 0 261.453 5.170 10 0 CKAERO CCCC[C@H](CC)[C@H]([NH2+]CC)c1cc(C)ccc1C ZINC000035546405 172254241 /nfs/dbraw/zinc/25/42/41/172254241.db2.gz UXXLJBTVAAPMMT-WMZOPIPTSA-N 1 0 261.453 5.170 10 0 CKAERO CCCC[C@@H](CC)[C@@H]([NH2+]CC)c1cc(C)ccc1C ZINC000035546408 172254035 /nfs/dbraw/zinc/25/40/35/172254035.db2.gz UXXLJBTVAAPMMT-SJLPKXTDSA-N 1 0 261.453 5.170 10 0 CKAERO CCCC[C@H](CC)[C@@H]([NH2+]CC)c1cc(C)ccc1C ZINC000035546411 172254011 /nfs/dbraw/zinc/25/40/11/172254011.db2.gz UXXLJBTVAAPMMT-FUHWJXTLSA-N 1 0 261.453 5.170 10 0 CKAERO CC[NH2+][C@@H](CCC(C)C)c1c(C)c(C)cc(C)c1C ZINC000035547109 172255469 /nfs/dbraw/zinc/25/54/69/172255469.db2.gz UCKKJZMRFWFRMM-KRWDZBQOSA-N 1 0 261.453 5.007 10 0 CKAERO CC[NH2+][C@H](CCC(C)C)c1c(C)c(C)cc(C)c1C ZINC000035547111 172255326 /nfs/dbraw/zinc/25/53/26/172255326.db2.gz UCKKJZMRFWFRMM-QGZVFWFLSA-N 1 0 261.453 5.007 10 0 CKAERO CC[NH2+][C@H](c1c(C)c(C)cc(C)c1C)C(CC)CC ZINC000035547222 172255107 /nfs/dbraw/zinc/25/51/07/172255107.db2.gz OQOZIUKHCMUSGV-SFHVURJKSA-N 1 0 261.453 5.007 10 0 CKAERO CC[NH2+][C@@H](c1c(C)c(C)cc(C)c1C)C(CC)CC ZINC000035547224 172255149 /nfs/dbraw/zinc/25/51/49/172255149.db2.gz OQOZIUKHCMUSGV-GOSISDBHSA-N 1 0 261.453 5.007 10 0 CKAERO CCCCc1ccc([C@H]([NH2+]CC)[C@@H](C)CCC)cc1 ZINC000035548080 172255753 /nfs/dbraw/zinc/25/57/53/172255753.db2.gz LHMUBKMTAWBPRQ-MAUKXSAKSA-N 1 0 261.453 5.116 10 0 CKAERO CCCCc1ccc([C@@H]([NH2+]CC)[C@@H](C)CCC)cc1 ZINC000035548082 172255683 /nfs/dbraw/zinc/25/56/83/172255683.db2.gz LHMUBKMTAWBPRQ-YJBOKZPZSA-N 1 0 261.453 5.116 10 0 CKAERO CCCCc1ccc([C@H]([NH2+]CC)[C@H](C)CCC)cc1 ZINC000035548084 172256038 /nfs/dbraw/zinc/25/60/38/172256038.db2.gz LHMUBKMTAWBPRQ-CRAIPNDOSA-N 1 0 261.453 5.116 10 0 CKAERO CCCCc1ccc([C@@H]([NH2+]CC)[C@H](C)CCC)cc1 ZINC000035548086 172255514 /nfs/dbraw/zinc/25/55/14/172255514.db2.gz LHMUBKMTAWBPRQ-QAPCUYQASA-N 1 0 261.453 5.116 10 0 CKAERO CCCCC[C@H]([NH2+]CC)c1ccc(C(C)(C)C)cc1 ZINC000035548271 172256595 /nfs/dbraw/zinc/25/65/95/172256595.db2.gz HMVSRLUIJIUJMV-KRWDZBQOSA-N 1 0 261.453 5.215 10 0 CKAERO CCCCC[C@@H]([NH2+]CC)c1ccc(C(C)(C)C)cc1 ZINC000035548273 172257078 /nfs/dbraw/zinc/25/70/78/172257078.db2.gz HMVSRLUIJIUJMV-QGZVFWFLSA-N 1 0 261.453 5.215 10 0 CKAERO CC[NH2+][C@@H](CCC(C)C)c1ccc(C(C)(C)C)cc1 ZINC000035548295 172256549 /nfs/dbraw/zinc/25/65/49/172256549.db2.gz HGBLSUBUZAPRTE-KRWDZBQOSA-N 1 0 261.453 5.071 10 0 CKAERO CC[NH2+][C@H](CCC(C)C)c1ccc(C(C)(C)C)cc1 ZINC000035548297 172256512 /nfs/dbraw/zinc/25/65/12/172256512.db2.gz HGBLSUBUZAPRTE-QGZVFWFLSA-N 1 0 261.453 5.071 10 0 CKAERO CC[NH2+][C@@H](CC(C)(C)C)c1ccc(C(C)(C)C)cc1 ZINC000035548322 172256772 /nfs/dbraw/zinc/25/67/72/172256772.db2.gz QHOBJZZYQUCJRP-INIZCTEOSA-N 1 0 261.453 5.071 10 0 CKAERO CC[NH2+][C@H](CC(C)(C)C)c1ccc(C(C)(C)C)cc1 ZINC000035548325 172256479 /nfs/dbraw/zinc/25/64/79/172256479.db2.gz QHOBJZZYQUCJRP-MRXNPFEDSA-N 1 0 261.453 5.071 10 0 CKAERO CC[NH2+][C@H](c1ccc(C(C)(C)C)cc1)C(CC)CC ZINC000035548421 172256419 /nfs/dbraw/zinc/25/64/19/172256419.db2.gz DHQBDHSGNITHJT-KRWDZBQOSA-N 1 0 261.453 5.071 10 0 CKAERO CC[NH2+][C@@H](c1ccc(C(C)(C)C)cc1)C(CC)CC ZINC000035548424 172256695 /nfs/dbraw/zinc/25/66/95/172256695.db2.gz DHQBDHSGNITHJT-QGZVFWFLSA-N 1 0 261.453 5.071 10 0 CKAERO CC[NH2+][C@@H](C[C@@H](C)CC(C)(C)C)c1cc(C)sc1C ZINC000035552105 172259269 /nfs/dbraw/zinc/25/92/69/172259269.db2.gz ZXLOZYKCCXVUOX-WBMJQRKESA-N 1 0 281.509 5.478 10 0 CKAERO CC[NH2+][C@H](C[C@@H](C)CC(C)(C)C)c1cc(C)sc1C ZINC000035552108 172259421 /nfs/dbraw/zinc/25/94/21/172259421.db2.gz ZXLOZYKCCXVUOX-MLGOLLRUSA-N 1 0 281.509 5.478 10 0 CKAERO CC[NH2+][C@@H](C[C@H](C)CC(C)(C)C)c1cc(C)sc1C ZINC000035552109 172259564 /nfs/dbraw/zinc/25/95/64/172259564.db2.gz ZXLOZYKCCXVUOX-LRDDRELGSA-N 1 0 281.509 5.478 10 0 CKAERO CC[NH2+][C@H](C[C@H](C)CC(C)(C)C)c1cc(C)sc1C ZINC000035552112 172259436 /nfs/dbraw/zinc/25/94/36/172259436.db2.gz ZXLOZYKCCXVUOX-BLLLJJGKSA-N 1 0 281.509 5.478 10 0 CKAERO CCCC[C@@H](CC)[C@H]([NH2+]CC)c1cc(C)sc1C ZINC000035552119 172258853 /nfs/dbraw/zinc/25/88/53/172258853.db2.gz OZRMSMLGMXOQII-ZBFHGGJFSA-N 1 0 267.482 5.232 10 0 CKAERO CCCC[C@H](CC)[C@H]([NH2+]CC)c1cc(C)sc1C ZINC000035552122 172259343 /nfs/dbraw/zinc/25/93/43/172259343.db2.gz OZRMSMLGMXOQII-HOCLYGCPSA-N 1 0 267.482 5.232 10 0 CKAERO CCCC[C@@H](CC)[C@@H]([NH2+]CC)c1cc(C)sc1C ZINC000035552125 172259423 /nfs/dbraw/zinc/25/94/23/172259423.db2.gz OZRMSMLGMXOQII-GDBMZVCRSA-N 1 0 267.482 5.232 10 0 CKAERO CCCC[C@H](CC)[C@@H]([NH2+]CC)c1cc(C)sc1C ZINC000035552128 172259240 /nfs/dbraw/zinc/25/92/40/172259240.db2.gz OZRMSMLGMXOQII-GOEBONIOSA-N 1 0 267.482 5.232 10 0 CKAERO CC[NH2+][C@@H](C[C@@H](C)CC(C)(C)C)c1ccc(Cl)s1 ZINC000035552998 172259990 /nfs/dbraw/zinc/25/99/90/172259990.db2.gz BYPJIXGJKQVPJM-NEPJUHHUSA-N 1 0 287.900 5.515 10 0 CKAERO CC[NH2+][C@H](C[C@@H](C)CC(C)(C)C)c1ccc(Cl)s1 ZINC000035553001 172260376 /nfs/dbraw/zinc/26/03/76/172260376.db2.gz BYPJIXGJKQVPJM-VXGBXAGGSA-N 1 0 287.900 5.515 10 0 CKAERO CC[NH2+][C@@H](C[C@H](C)CC(C)(C)C)c1ccc(Cl)s1 ZINC000035553005 172260258 /nfs/dbraw/zinc/26/02/58/172260258.db2.gz BYPJIXGJKQVPJM-RYUDHWBXSA-N 1 0 287.900 5.515 10 0 CKAERO CC[NH2+][C@H](C[C@H](C)CC(C)(C)C)c1ccc(Cl)s1 ZINC000035553008 172260365 /nfs/dbraw/zinc/26/03/65/172260365.db2.gz BYPJIXGJKQVPJM-NWDGAFQWSA-N 1 0 287.900 5.515 10 0 CKAERO CCCC[C@@H](CC)[C@H]([NH2+]CC)c1ccc(Cl)s1 ZINC000035553017 172260396 /nfs/dbraw/zinc/26/03/96/172260396.db2.gz AFRWZTFEZAPMMV-RISCZKNCSA-N 1 0 273.873 5.269 10 0 CKAERO CCCC[C@H](CC)[C@H]([NH2+]CC)c1ccc(Cl)s1 ZINC000035553020 172260273 /nfs/dbraw/zinc/26/02/73/172260273.db2.gz AFRWZTFEZAPMMV-FZMZJTMJSA-N 1 0 273.873 5.269 10 0 CKAERO CCCC[C@@H](CC)[C@@H]([NH2+]CC)c1ccc(Cl)s1 ZINC000035553023 172259680 /nfs/dbraw/zinc/25/96/80/172259680.db2.gz AFRWZTFEZAPMMV-BXUZGUMPSA-N 1 0 273.873 5.269 10 0 CKAERO CCCC[C@H](CC)[C@@H]([NH2+]CC)c1ccc(Cl)s1 ZINC000035553027 172259760 /nfs/dbraw/zinc/25/97/60/172259760.db2.gz AFRWZTFEZAPMMV-SMDDNHRTSA-N 1 0 273.873 5.269 10 0 CKAERO CC[NH2+][C@@H](CC1CCCCC1)c1ccc(Cl)s1 ZINC000035553066 172260144 /nfs/dbraw/zinc/26/01/44/172260144.db2.gz JXZXRJVLDZHVNX-LBPRGKRZSA-N 1 0 271.857 5.023 10 0 CKAERO CC[NH2+][C@H](CC1CCCCC1)c1ccc(Cl)s1 ZINC000035553069 172260099 /nfs/dbraw/zinc/26/00/99/172260099.db2.gz JXZXRJVLDZHVNX-GFCCVEGCSA-N 1 0 271.857 5.023 10 0 CKAERO CC[NH2+][C@H](c1ccc(Cl)s1)c1ccc(C(C)C)cc1 ZINC000035553138 172260372 /nfs/dbraw/zinc/26/03/72/172260372.db2.gz JKTLKOXJTPKREM-INIZCTEOSA-N 1 0 293.863 5.224 10 0 CKAERO CC[NH2+][C@@H](c1ccc(Cl)s1)c1ccc(C(C)C)cc1 ZINC000035553140 172259733 /nfs/dbraw/zinc/25/97/33/172259733.db2.gz JKTLKOXJTPKREM-MRXNPFEDSA-N 1 0 293.863 5.224 10 0 CKAERO CC[NH2+][C@@H](CCC1CCCCC1)c1ccc(Cl)s1 ZINC000035553284 172260412 /nfs/dbraw/zinc/26/04/12/172260412.db2.gz ZUWLRUSGXYBIRL-ZDUSSCGKSA-N 1 0 285.884 5.413 10 0 CKAERO CC[NH2+][C@H](CCC1CCCCC1)c1ccc(Cl)s1 ZINC000035553288 172260310 /nfs/dbraw/zinc/26/03/10/172260310.db2.gz ZUWLRUSGXYBIRL-CYBMUJFWSA-N 1 0 285.884 5.413 10 0 CKAERO CC[NH2+][C@@H](CCC1CCCC1)c1ccc(Cl)s1 ZINC000035553337 172259688 /nfs/dbraw/zinc/25/96/88/172259688.db2.gz TVMONZRADWYHGK-LBPRGKRZSA-N 1 0 271.857 5.023 10 0 CKAERO CCCCC[C@H]([NH2+]CC)c1csc2ccccc12 ZINC000035555027 172261489 /nfs/dbraw/zinc/26/14/89/172261489.db2.gz ZXWSGZILEMOSEU-HNNXBMFYSA-N 1 0 261.434 5.132 10 0 CKAERO CCCCC[C@@H]([NH2+]CC)c1csc2ccccc12 ZINC000035555030 172261982 /nfs/dbraw/zinc/26/19/82/172261982.db2.gz ZXWSGZILEMOSEU-OAHLLOKOSA-N 1 0 261.434 5.132 10 0 CKAERO CC[NH2+][C@@H](c1csc2ccccc12)C1CCCCC1 ZINC000035555218 172262131 /nfs/dbraw/zinc/26/21/31/172262131.db2.gz YLDDFLKDQXMSFW-QGZVFWFLSA-N 1 0 273.445 5.132 10 0 CKAERO CC[NH2+][C@H](c1csc2ccccc12)C1CCCCC1 ZINC000035555221 172261585 /nfs/dbraw/zinc/26/15/85/172261585.db2.gz YLDDFLKDQXMSFW-KRWDZBQOSA-N 1 0 273.445 5.132 10 0 CKAERO CCCCC[C@H]([NH2+]CC)c1ccc(Cl)c(Cl)c1 ZINC000035558029 172263560 /nfs/dbraw/zinc/26/35/60/172263560.db2.gz KQUZUZRLBCGRRA-AWEZNQCLSA-N 1 0 274.235 5.224 10 0 CKAERO CCCCC[C@@H]([NH2+]CC)c1ccc(Cl)c(Cl)c1 ZINC000035558031 172263383 /nfs/dbraw/zinc/26/33/83/172263383.db2.gz KQUZUZRLBCGRRA-CQSZACIVSA-N 1 0 274.235 5.224 10 0 CKAERO CCC[C@@H](C)[C@H]([NH2+]CC)c1ccc(Cl)c(Cl)c1 ZINC000035558058 172263136 /nfs/dbraw/zinc/26/31/36/172263136.db2.gz YUMSTHUPFRPZFO-YGRLFVJLSA-N 1 0 274.235 5.080 10 0 CKAERO CCC[C@H](C)[C@H]([NH2+]CC)c1ccc(Cl)c(Cl)c1 ZINC000035558060 172263645 /nfs/dbraw/zinc/26/36/45/172263645.db2.gz YUMSTHUPFRPZFO-HZMBPMFUSA-N 1 0 274.235 5.080 10 0 CKAERO CCC[C@@H](C)[C@@H]([NH2+]CC)c1ccc(Cl)c(Cl)c1 ZINC000035558062 172263765 /nfs/dbraw/zinc/26/37/65/172263765.db2.gz YUMSTHUPFRPZFO-QMTHXVAHSA-N 1 0 274.235 5.080 10 0 CKAERO CCC[C@H](C)[C@@H]([NH2+]CC)c1ccc(Cl)c(Cl)c1 ZINC000035558065 172263895 /nfs/dbraw/zinc/26/38/95/172263895.db2.gz YUMSTHUPFRPZFO-IINYFYTJSA-N 1 0 274.235 5.080 10 0 CKAERO CC[NH2+][C@@H](CCC(C)C)c1ccc(Cl)c(Cl)c1 ZINC000035558068 172263419 /nfs/dbraw/zinc/26/34/19/172263419.db2.gz AIJFJAUDYWRXMM-AWEZNQCLSA-N 1 0 274.235 5.080 10 0 CKAERO CC[NH2+][C@H](CCC(C)C)c1ccc(Cl)c(Cl)c1 ZINC000035558070 172263208 /nfs/dbraw/zinc/26/32/08/172263208.db2.gz AIJFJAUDYWRXMM-CQSZACIVSA-N 1 0 274.235 5.080 10 0 CKAERO CC[NH2+][C@@H](CC(C)(C)C)c1ccc(Cl)c(Cl)c1 ZINC000035558191 172263225 /nfs/dbraw/zinc/26/32/25/172263225.db2.gz PZEOGRYMTCFEIQ-ZDUSSCGKSA-N 1 0 274.235 5.080 10 0 CKAERO CC[NH2+][C@H](CC(C)(C)C)c1ccc(Cl)c(Cl)c1 ZINC000035558193 172263543 /nfs/dbraw/zinc/26/35/43/172263543.db2.gz PZEOGRYMTCFEIQ-CYBMUJFWSA-N 1 0 274.235 5.080 10 0 CKAERO CC[NH2+][C@@H](c1ccc(Cl)c(Cl)c1)C1CCCCC1 ZINC000035558215 172263646 /nfs/dbraw/zinc/26/36/46/172263646.db2.gz HKNOMUXNNIUZQF-OAHLLOKOSA-N 1 0 286.246 5.224 10 0 CKAERO CC[NH2+][C@H](c1ccc(Cl)c(Cl)c1)C1CCCCC1 ZINC000035558217 172263571 /nfs/dbraw/zinc/26/35/71/172263571.db2.gz HKNOMUXNNIUZQF-HNNXBMFYSA-N 1 0 286.246 5.224 10 0 CKAERO CC[NH2+][C@H](c1ccc(Cl)c(Cl)c1)C(CC)CC ZINC000035558362 172263582 /nfs/dbraw/zinc/26/35/82/172263582.db2.gz KVMUXRXRQPAWSO-AWEZNQCLSA-N 1 0 274.235 5.080 10 0 CKAERO CC[NH2+][C@@H](c1ccc(Cl)c(Cl)c1)C(CC)CC ZINC000035558365 172263393 /nfs/dbraw/zinc/26/33/93/172263393.db2.gz KVMUXRXRQPAWSO-CQSZACIVSA-N 1 0 274.235 5.080 10 0 CKAERO CCCCC[C@H]([NH2+]CC)c1cc(Cl)ccc1Cl ZINC000035558770 172264821 /nfs/dbraw/zinc/26/48/21/172264821.db2.gz WNSQHOXJTDYZFW-AWEZNQCLSA-N 1 0 274.235 5.224 10 0 CKAERO CCCCC[C@@H]([NH2+]CC)c1cc(Cl)ccc1Cl ZINC000035558773 172264568 /nfs/dbraw/zinc/26/45/68/172264568.db2.gz WNSQHOXJTDYZFW-CQSZACIVSA-N 1 0 274.235 5.224 10 0 CKAERO CCC[C@@H](C)[C@H]([NH2+]CC)c1cc(Cl)ccc1Cl ZINC000035558802 172264491 /nfs/dbraw/zinc/26/44/91/172264491.db2.gz YZOGSJCLCJOJKO-YGRLFVJLSA-N 1 0 274.235 5.080 10 0 CKAERO CCC[C@H](C)[C@H]([NH2+]CC)c1cc(Cl)ccc1Cl ZINC000035558805 172264799 /nfs/dbraw/zinc/26/47/99/172264799.db2.gz YZOGSJCLCJOJKO-HZMBPMFUSA-N 1 0 274.235 5.080 10 0 CKAERO CCC[C@@H](C)[C@@H]([NH2+]CC)c1cc(Cl)ccc1Cl ZINC000035558808 172264687 /nfs/dbraw/zinc/26/46/87/172264687.db2.gz YZOGSJCLCJOJKO-QMTHXVAHSA-N 1 0 274.235 5.080 10 0 CKAERO CCC[C@H](C)[C@@H]([NH2+]CC)c1cc(Cl)ccc1Cl ZINC000035558810 172264755 /nfs/dbraw/zinc/26/47/55/172264755.db2.gz YZOGSJCLCJOJKO-IINYFYTJSA-N 1 0 274.235 5.080 10 0 CKAERO CC[NH2+][C@@H](CCC(C)C)c1cc(Cl)ccc1Cl ZINC000035558812 172264105 /nfs/dbraw/zinc/26/41/05/172264105.db2.gz NVRRLHFFYPZWJF-AWEZNQCLSA-N 1 0 274.235 5.080 10 0 CKAERO CC[NH2+][C@H](CCC(C)C)c1cc(Cl)ccc1Cl ZINC000035558815 172264817 /nfs/dbraw/zinc/26/48/17/172264817.db2.gz NVRRLHFFYPZWJF-CQSZACIVSA-N 1 0 274.235 5.080 10 0 CKAERO CC[NH2+][C@@H](CC(C)(C)C)c1cc(Cl)ccc1Cl ZINC000035558950 172264599 /nfs/dbraw/zinc/26/45/99/172264599.db2.gz LJAPOKHHLCFODK-ZDUSSCGKSA-N 1 0 274.235 5.080 10 0 CKAERO CC[NH2+][C@H](CC(C)(C)C)c1cc(Cl)ccc1Cl ZINC000035558953 172264271 /nfs/dbraw/zinc/26/42/71/172264271.db2.gz LJAPOKHHLCFODK-CYBMUJFWSA-N 1 0 274.235 5.080 10 0 CKAERO CC[NH2+][C@@H](c1cc(Cl)ccc1Cl)C1CCCCC1 ZINC000035558978 172264478 /nfs/dbraw/zinc/26/44/78/172264478.db2.gz FUPOOTYOMSFCCM-OAHLLOKOSA-N 1 0 286.246 5.224 10 0 CKAERO CC[NH2+][C@H](c1cc(Cl)ccc1Cl)C1CCCCC1 ZINC000035558980 172264635 /nfs/dbraw/zinc/26/46/35/172264635.db2.gz FUPOOTYOMSFCCM-HNNXBMFYSA-N 1 0 286.246 5.224 10 0 CKAERO CC[NH2+][C@H](c1cc(Cl)ccc1Cl)C(CC)CC ZINC000035559140 172264323 /nfs/dbraw/zinc/26/43/23/172264323.db2.gz YEJFEMBKFPCSHK-AWEZNQCLSA-N 1 0 274.235 5.080 10 0 CKAERO CC[NH2+][C@@H](c1cc(Cl)ccc1Cl)C(CC)CC ZINC000035559143 172264280 /nfs/dbraw/zinc/26/42/80/172264280.db2.gz YEJFEMBKFPCSHK-CQSZACIVSA-N 1 0 274.235 5.080 10 0 CKAERO CCCCC[C@H]([NH2+]CC)c1cc(Cl)sc1Cl ZINC000035559379 172264348 /nfs/dbraw/zinc/26/43/48/172264348.db2.gz KZNHAACRUUIGLG-JTQLQIEISA-N 1 0 280.264 5.286 10 0 CKAERO CCCCC[C@@H]([NH2+]CC)c1cc(Cl)sc1Cl ZINC000035559382 172264794 /nfs/dbraw/zinc/26/47/94/172264794.db2.gz KZNHAACRUUIGLG-SNVBAGLBSA-N 1 0 280.264 5.286 10 0 CKAERO CCC[C@@H](C)[C@H]([NH2+]CC)c1cc(Cl)sc1Cl ZINC000035559418 172264515 /nfs/dbraw/zinc/26/45/15/172264515.db2.gz YYGCLKZSWJYXQO-KCJUWKMLSA-N 1 0 280.264 5.142 10 0 CKAERO CCC[C@H](C)[C@H]([NH2+]CC)c1cc(Cl)sc1Cl ZINC000035559421 172264071 /nfs/dbraw/zinc/26/40/71/172264071.db2.gz YYGCLKZSWJYXQO-KWQFWETISA-N 1 0 280.264 5.142 10 0 CKAERO CCC[C@@H](C)[C@@H]([NH2+]CC)c1cc(Cl)sc1Cl ZINC000035559424 172264379 /nfs/dbraw/zinc/26/43/79/172264379.db2.gz YYGCLKZSWJYXQO-LDYMZIIASA-N 1 0 280.264 5.142 10 0 CKAERO CCC[C@H](C)[C@@H]([NH2+]CC)c1cc(Cl)sc1Cl ZINC000035559427 172264561 /nfs/dbraw/zinc/26/45/61/172264561.db2.gz YYGCLKZSWJYXQO-GZMMTYOYSA-N 1 0 280.264 5.142 10 0 CKAERO CC[NH2+][C@@H](CCC(C)C)c1cc(Cl)sc1Cl ZINC000035559429 172264408 /nfs/dbraw/zinc/26/44/08/172264408.db2.gz VEJWFPFBLWJDEG-JTQLQIEISA-N 1 0 280.264 5.142 10 0 CKAERO CC[NH2+][C@H](CCC(C)C)c1cc(Cl)sc1Cl ZINC000035559432 172264540 /nfs/dbraw/zinc/26/45/40/172264540.db2.gz VEJWFPFBLWJDEG-SNVBAGLBSA-N 1 0 280.264 5.142 10 0 CKAERO CC[NH2+][C@@H](CC(C)(C)C)c1cc(Cl)sc1Cl ZINC000035559626 172264813 /nfs/dbraw/zinc/26/48/13/172264813.db2.gz VQICSSQAHZNAQN-VIFPVBQESA-N 1 0 280.264 5.142 10 0 CKAERO CC[NH2+][C@H](CC(C)(C)C)c1cc(Cl)sc1Cl ZINC000035559629 172264740 /nfs/dbraw/zinc/26/47/40/172264740.db2.gz VQICSSQAHZNAQN-SECBINFHSA-N 1 0 280.264 5.142 10 0 CKAERO CC[NH2+][C@@H](c1cc(Cl)sc1Cl)C1CCCCC1 ZINC000035559661 172264590 /nfs/dbraw/zinc/26/45/90/172264590.db2.gz DDYFPHAALRLJGO-GFCCVEGCSA-N 1 0 292.275 5.286 10 0 CKAERO CC[NH2+][C@H](c1cc(Cl)sc1Cl)C1CCCCC1 ZINC000035559664 172264263 /nfs/dbraw/zinc/26/42/63/172264263.db2.gz DDYFPHAALRLJGO-LBPRGKRZSA-N 1 0 292.275 5.286 10 0 CKAERO CC[NH2+][C@H](c1cc(Cl)sc1Cl)C(CC)CC ZINC000035559909 172264768 /nfs/dbraw/zinc/26/47/68/172264768.db2.gz RDHNFIZDSGNTBF-NSHDSACASA-N 1 0 280.264 5.142 10 0 CKAERO CC[NH2+][C@@H](c1cc(Cl)sc1Cl)C(CC)CC ZINC000035559912 172264353 /nfs/dbraw/zinc/26/43/53/172264353.db2.gz RDHNFIZDSGNTBF-LLVKDONJSA-N 1 0 280.264 5.142 10 0 CKAERO CCCC[C@@H](CC)[C@H]([NH2+]CCC)c1ccc(C)s1 ZINC000035573079 172269260 /nfs/dbraw/zinc/26/92/60/172269260.db2.gz CQKWBGBNWREHEX-ZBFHGGJFSA-N 1 0 267.482 5.314 10 0 CKAERO CCCC[C@H](CC)[C@H]([NH2+]CCC)c1ccc(C)s1 ZINC000035573080 172269203 /nfs/dbraw/zinc/26/92/03/172269203.db2.gz CQKWBGBNWREHEX-HOCLYGCPSA-N 1 0 267.482 5.314 10 0 CKAERO CCCC[C@@H](CC)[C@@H]([NH2+]CCC)c1ccc(C)s1 ZINC000035573081 172269403 /nfs/dbraw/zinc/26/94/03/172269403.db2.gz CQKWBGBNWREHEX-GDBMZVCRSA-N 1 0 267.482 5.314 10 0 CKAERO CCCC[C@H](CC)[C@@H]([NH2+]CCC)c1ccc(C)s1 ZINC000035573082 172269100 /nfs/dbraw/zinc/26/91/00/172269100.db2.gz CQKWBGBNWREHEX-GOEBONIOSA-N 1 0 267.482 5.314 10 0 CKAERO CCC[NH2+][C@@H](CC1CCCCC1)c1ccc(C)s1 ZINC000035573095 172268699 /nfs/dbraw/zinc/26/86/99/172268699.db2.gz OKHVUZLZKWXUSK-HNNXBMFYSA-N 1 0 265.466 5.068 10 0 CKAERO CCC[NH2+][C@H](CC1CCCCC1)c1ccc(C)s1 ZINC000035573096 172268686 /nfs/dbraw/zinc/26/86/86/172268686.db2.gz OKHVUZLZKWXUSK-OAHLLOKOSA-N 1 0 265.466 5.068 10 0 CKAERO CCCCC[C@H]([NH2+]CCC)c1ccc(Br)cc1 ZINC000035574178 172270739 /nfs/dbraw/zinc/27/07/39/172270739.db2.gz PWMFFZFVECENEP-HNNXBMFYSA-N 1 0 298.268 5.070 10 0 CKAERO CCCCC[C@@H]([NH2+]CCC)c1ccc(Br)cc1 ZINC000035574180 172270393 /nfs/dbraw/zinc/27/03/93/172270393.db2.gz PWMFFZFVECENEP-OAHLLOKOSA-N 1 0 298.268 5.070 10 0 CKAERO CCCC[C@@H](CC)[C@H]([NH2+]CCC)c1ccc(Cl)cc1 ZINC000035575194 172271771 /nfs/dbraw/zinc/27/17/71/172271771.db2.gz PKHTXCBWLRIUFP-PBHICJAKSA-N 1 0 281.871 5.597 10 0 CKAERO CCCC[C@H](CC)[C@H]([NH2+]CCC)c1ccc(Cl)cc1 ZINC000035575196 172271889 /nfs/dbraw/zinc/27/18/89/172271889.db2.gz PKHTXCBWLRIUFP-YOEHRIQHSA-N 1 0 281.871 5.597 10 0 CKAERO CCCC[C@@H](CC)[C@@H]([NH2+]CCC)c1ccc(Cl)cc1 ZINC000035575198 172272333 /nfs/dbraw/zinc/27/23/33/172272333.db2.gz PKHTXCBWLRIUFP-RHSMWYFYSA-N 1 0 281.871 5.597 10 0 CKAERO CCCC[C@H](CC)[C@@H]([NH2+]CCC)c1ccc(Cl)cc1 ZINC000035575200 172272252 /nfs/dbraw/zinc/27/22/52/172272252.db2.gz PKHTXCBWLRIUFP-WMLDXEAASA-N 1 0 281.871 5.597 10 0 CKAERO CCC[NH2+][C@@H](CC1CCCCC1)c1ccc(Cl)cc1 ZINC000035575217 172271879 /nfs/dbraw/zinc/27/18/79/172271879.db2.gz GQNHKCDLTPPBGH-KRWDZBQOSA-N 1 0 279.855 5.351 10 0 CKAERO CCC[NH2+][C@H](CC1CCCCC1)c1ccc(Cl)cc1 ZINC000035575219 172272172 /nfs/dbraw/zinc/27/21/72/172272172.db2.gz GQNHKCDLTPPBGH-QGZVFWFLSA-N 1 0 279.855 5.351 10 0 CKAERO CCC[NH2+][C@@H](CCC1CCCC1)c1ccc(Cl)cc1 ZINC000035575347 172272312 /nfs/dbraw/zinc/27/23/12/172272312.db2.gz ZJGQFHUGUVTXDT-KRWDZBQOSA-N 1 0 279.855 5.351 10 0 CKAERO CCC[NH2+][C@H](CCC1CCCC1)c1ccc(Cl)cc1 ZINC000035575349 172272330 /nfs/dbraw/zinc/27/23/30/172272330.db2.gz ZJGQFHUGUVTXDT-QGZVFWFLSA-N 1 0 279.855 5.351 10 0 CKAERO CCC[NH2+][C@@H](CCC1CCCCC1)c1ccccc1 ZINC000035575935 172273236 /nfs/dbraw/zinc/27/32/36/172273236.db2.gz QCELSAAMMTZFKQ-SFHVURJKSA-N 1 0 259.437 5.088 10 0 CKAERO CCC[NH2+][C@H](CCC1CCCCC1)c1ccccc1 ZINC000035575938 172273075 /nfs/dbraw/zinc/27/30/75/172273075.db2.gz QCELSAAMMTZFKQ-GOSISDBHSA-N 1 0 259.437 5.088 10 0 CKAERO CCC[NH2+][C@@H](c1ccccc1)c1c(Cl)cccc1Cl ZINC000035576191 172272623 /nfs/dbraw/zinc/27/26/23/172272623.db2.gz IGUFKYPRYZRGNB-INIZCTEOSA-N 1 0 294.225 5.082 10 0 CKAERO CCC[NH2+][C@H](c1ccccc1)c1c(Cl)cccc1Cl ZINC000035576194 172272660 /nfs/dbraw/zinc/27/26/60/172272660.db2.gz IGUFKYPRYZRGNB-MRXNPFEDSA-N 1 0 294.225 5.082 10 0 CKAERO CCC[NH2+][C@@H](CCC1CCCC1)c1ccc(C)cc1 ZINC000035577187 172273897 /nfs/dbraw/zinc/27/38/97/172273897.db2.gz HBUARUTZLZSDTB-SFHVURJKSA-N 1 0 259.437 5.006 10 0 CKAERO CCC[NH2+][C@H](CCC1CCCC1)c1ccc(C)cc1 ZINC000035577190 172273763 /nfs/dbraw/zinc/27/37/63/172273763.db2.gz HBUARUTZLZSDTB-GOSISDBHSA-N 1 0 259.437 5.006 10 0 CKAERO CCC[NH2+][C@@H](c1ccc([C@@H](C)CC)cc1)[C@@H](C)CC ZINC000035580649 172276145 /nfs/dbraw/zinc/27/61/45/172276145.db2.gz ZWDNGDBJAGXTNU-RLFYNMQTSA-N 1 0 261.453 5.287 10 0 CKAERO CCC[NH2+][C@H](c1ccc([C@@H](C)CC)cc1)[C@@H](C)CC ZINC000035580651 172276280 /nfs/dbraw/zinc/27/62/80/172276280.db2.gz ZWDNGDBJAGXTNU-MPGHIAIKSA-N 1 0 261.453 5.287 10 0 CKAERO CCC[NH2+][C@H](c1ccc([C@H](C)CC)cc1)[C@@H](C)CC ZINC000035580655 172276404 /nfs/dbraw/zinc/27/64/04/172276404.db2.gz ZWDNGDBJAGXTNU-VKJFTORMSA-N 1 0 261.453 5.287 10 0 CKAERO CCC[NH2+][C@@H](c1ccc([C@@H](C)CC)cc1)C1CCC1 ZINC000035580701 172276335 /nfs/dbraw/zinc/27/63/35/172276335.db2.gz URECFSZBFITDME-KBXCAEBGSA-N 1 0 259.437 5.041 10 0 CKAERO CCC[NH2+][C@H](c1ccc([C@@H](C)CC)cc1)C1CCC1 ZINC000035580703 172276323 /nfs/dbraw/zinc/27/63/23/172276323.db2.gz URECFSZBFITDME-KSSFIOAISA-N 1 0 259.437 5.041 10 0 CKAERO CCC[NH2+][C@@H](c1ccc([C@H](C)CC)cc1)C1CCC1 ZINC000035580705 172276375 /nfs/dbraw/zinc/27/63/75/172276375.db2.gz URECFSZBFITDME-RDTXWAMCSA-N 1 0 259.437 5.041 10 0 CKAERO CCC[NH2+][C@H](c1ccc([C@H](C)CC)cc1)C1CCC1 ZINC000035580706 172276796 /nfs/dbraw/zinc/27/67/96/172276796.db2.gz URECFSZBFITDME-KDOFPFPSSA-N 1 0 259.437 5.041 10 0 CKAERO CCC[NH2+][C@@H](C[C@@H](C)CC(C)(C)C)c1cccs1 ZINC000035581134 172277464 /nfs/dbraw/zinc/27/74/64/172277464.db2.gz NTEJNNGQBVHIIM-KGLIPLIRSA-N 1 0 267.482 5.251 10 0 CKAERO CCC[NH2+][C@H](C[C@@H](C)CC(C)(C)C)c1cccs1 ZINC000035581135 172277521 /nfs/dbraw/zinc/27/75/21/172277521.db2.gz NTEJNNGQBVHIIM-ZIAGYGMSSA-N 1 0 267.482 5.251 10 0 CKAERO CCC[NH2+][C@@H](C[C@H](C)CC(C)(C)C)c1cccs1 ZINC000035581136 172276977 /nfs/dbraw/zinc/27/69/77/172276977.db2.gz NTEJNNGQBVHIIM-KBPBESRZSA-N 1 0 267.482 5.251 10 0 CKAERO CCC[NH2+][C@H](C[C@H](C)CC(C)(C)C)c1cccs1 ZINC000035581137 172276962 /nfs/dbraw/zinc/27/69/62/172276962.db2.gz NTEJNNGQBVHIIM-UONOGXRCSA-N 1 0 267.482 5.251 10 0 CKAERO CCCC[C@@H](CC)[C@H]([NH2+]CCC)c1cccs1 ZINC000035581140 172277152 /nfs/dbraw/zinc/27/71/52/172277152.db2.gz UFCVKSBRRCQJIE-HIFRSBDPSA-N 1 0 253.455 5.005 10 0 CKAERO CCCC[C@H](CC)[C@H]([NH2+]CCC)c1cccs1 ZINC000035581142 172277440 /nfs/dbraw/zinc/27/74/40/172277440.db2.gz UFCVKSBRRCQJIE-ZFWWWQNUSA-N 1 0 253.455 5.005 10 0 CKAERO CCCC[C@@H](CC)[C@@H]([NH2+]CCC)c1cccs1 ZINC000035581144 172277477 /nfs/dbraw/zinc/27/74/77/172277477.db2.gz UFCVKSBRRCQJIE-UKRRQHHQSA-N 1 0 253.455 5.005 10 0 CKAERO CCCC[C@H](CC)[C@@H]([NH2+]CCC)c1cccs1 ZINC000035581145 172277004 /nfs/dbraw/zinc/27/70/04/172277004.db2.gz UFCVKSBRRCQJIE-DZGCQCFKSA-N 1 0 253.455 5.005 10 0 CKAERO CCC[NH2+][C@@H](c1c(C)c(C)cc(C)c1C)[C@@H](C)CC ZINC000035581842 172278447 /nfs/dbraw/zinc/27/84/47/172278447.db2.gz UDWLKXSDHPHRME-KPZWWZAWSA-N 1 0 261.453 5.007 10 0 CKAERO CCC[NH2+][C@H](c1c(C)c(C)cc(C)c1C)[C@@H](C)CC ZINC000035581843 172278436 /nfs/dbraw/zinc/27/84/36/172278436.db2.gz UDWLKXSDHPHRME-SGTLLEGYSA-N 1 0 261.453 5.007 10 0 CKAERO CCC[NH2+][C@@H](c1c(C)c(C)cc(C)c1C)[C@H](C)CC ZINC000035581844 172278539 /nfs/dbraw/zinc/27/85/39/172278539.db2.gz UDWLKXSDHPHRME-KZULUSFZSA-N 1 0 261.453 5.007 10 0 CKAERO CCC[NH2+][C@H](c1c(C)c(C)cc(C)c1C)[C@H](C)CC ZINC000035581845 172278717 /nfs/dbraw/zinc/27/87/17/172278717.db2.gz UDWLKXSDHPHRME-XIKOKIGWSA-N 1 0 261.453 5.007 10 0 CKAERO CCCCc1ccc([C@@H](CC(C)C)[NH2+]CCC)cc1 ZINC000035582213 172279748 /nfs/dbraw/zinc/27/97/48/172279748.db2.gz JRXGEGVJKJAUNJ-GOSISDBHSA-N 1 0 261.453 5.116 10 0 CKAERO CCCCc1ccc([C@H](CC(C)C)[NH2+]CCC)cc1 ZINC000035582214 172279359 /nfs/dbraw/zinc/27/93/59/172279359.db2.gz JRXGEGVJKJAUNJ-SFHVURJKSA-N 1 0 261.453 5.116 10 0 CKAERO CCC[NH2+][C@@H](c1ccc(C(C)(C)C)cc1)C(C)(C)C ZINC000035582259 172279215 /nfs/dbraw/zinc/27/92/15/172279215.db2.gz HEYZBLYNIFERII-INIZCTEOSA-N 1 0 261.453 5.071 10 0 CKAERO CCC[NH2+][C@H](c1ccc(C(C)(C)C)cc1)C(C)(C)C ZINC000035582260 172279432 /nfs/dbraw/zinc/27/94/32/172279432.db2.gz HEYZBLYNIFERII-MRXNPFEDSA-N 1 0 261.453 5.071 10 0 CKAERO CCC[NH2+][C@@H](c1ccc(C(C)(C)C)cc1)[C@@H](C)CC ZINC000035582273 172279702 /nfs/dbraw/zinc/27/97/02/172279702.db2.gz CNYCWTKZWXRCIN-WMLDXEAASA-N 1 0 261.453 5.071 10 0 CKAERO CCC[NH2+][C@H](c1ccc(C(C)(C)C)cc1)[C@@H](C)CC ZINC000035582274 172279203 /nfs/dbraw/zinc/27/92/03/172279203.db2.gz CNYCWTKZWXRCIN-YOEHRIQHSA-N 1 0 261.453 5.071 10 0 CKAERO CCC[NH2+][C@@H](c1ccc(C(C)(C)C)cc1)[C@H](C)CC ZINC000035582275 172279593 /nfs/dbraw/zinc/27/95/93/172279593.db2.gz CNYCWTKZWXRCIN-RHSMWYFYSA-N 1 0 261.453 5.071 10 0 CKAERO CCC[NH2+][C@H](c1ccc(C(C)(C)C)cc1)[C@H](C)CC ZINC000035582276 172279242 /nfs/dbraw/zinc/27/92/42/172279242.db2.gz CNYCWTKZWXRCIN-PBHICJAKSA-N 1 0 261.453 5.071 10 0 CKAERO CCCCC[C@H]([NH2+]CCC)c1ccc(CCC)cc1 ZINC000035582824 172280864 /nfs/dbraw/zinc/28/08/64/172280864.db2.gz HCXVSMKCHPNBHO-SFHVURJKSA-N 1 0 261.453 5.260 10 0 CKAERO CCCCC[C@@H]([NH2+]CCC)c1ccc(CCC)cc1 ZINC000035582825 172280983 /nfs/dbraw/zinc/28/09/83/172280983.db2.gz HCXVSMKCHPNBHO-GOSISDBHSA-N 1 0 261.453 5.260 10 0 CKAERO CCC[NH2+][C@H](CCC(C)C)c1ccc(CCC)cc1 ZINC000035582836 172281066 /nfs/dbraw/zinc/28/10/66/172281066.db2.gz CSDHAVJUWIZAMX-GOSISDBHSA-N 1 0 261.453 5.116 10 0 CKAERO CCC[NH2+][C@@H](c1ccc(CCC)cc1)C(CC)CC ZINC000035582892 172280927 /nfs/dbraw/zinc/28/09/27/172280927.db2.gz UNIAVLVRGMGZFM-GOSISDBHSA-N 1 0 261.453 5.116 10 0 CKAERO CCC[NH2+][C@H](c1ccc(CCC)cc1)C(CC)CC ZINC000035582893 172281083 /nfs/dbraw/zinc/28/10/83/172281083.db2.gz UNIAVLVRGMGZFM-SFHVURJKSA-N 1 0 261.453 5.116 10 0 CKAERO CCCC[C@@H](CC)[C@H]([NH2+]CCC)c1ccc(Cl)s1 ZINC000035583542 172281985 /nfs/dbraw/zinc/28/19/85/172281985.db2.gz DMECBQZKXUKUKZ-DOMZBBRYSA-N 1 0 287.900 5.659 10 0 CKAERO CCCC[C@H](CC)[C@H]([NH2+]CCC)c1ccc(Cl)s1 ZINC000035583543 172281697 /nfs/dbraw/zinc/28/16/97/172281697.db2.gz DMECBQZKXUKUKZ-WFASDCNBSA-N 1 0 287.900 5.659 10 0 CKAERO CCCC[C@@H](CC)[C@@H]([NH2+]CCC)c1ccc(Cl)s1 ZINC000035583544 172281704 /nfs/dbraw/zinc/28/17/04/172281704.db2.gz DMECBQZKXUKUKZ-IUODEOHRSA-N 1 0 287.900 5.659 10 0 CKAERO CCCC[C@H](CC)[C@@H]([NH2+]CCC)c1ccc(Cl)s1 ZINC000035583545 172281654 /nfs/dbraw/zinc/28/16/54/172281654.db2.gz DMECBQZKXUKUKZ-SWLSCSKDSA-N 1 0 287.900 5.659 10 0 CKAERO CCCCC[C@H]([NH2+]CCC)c1ccc(Cl)s1 ZINC000035583546 172281815 /nfs/dbraw/zinc/28/18/15/172281815.db2.gz PFSXARXLPQPPPY-NSHDSACASA-N 1 0 259.846 5.023 10 0 CKAERO CCCCC[C@@H]([NH2+]CCC)c1ccc(Cl)s1 ZINC000035583547 172281712 /nfs/dbraw/zinc/28/17/12/172281712.db2.gz PFSXARXLPQPPPY-LLVKDONJSA-N 1 0 259.846 5.023 10 0 CKAERO CCC[NH2+][C@@H](CC1CCCCC1)c1ccc(Cl)s1 ZINC000035583558 172281641 /nfs/dbraw/zinc/28/16/41/172281641.db2.gz QPBRFXAMCZPWLW-ZDUSSCGKSA-N 1 0 285.884 5.413 10 0 CKAERO CCC[NH2+][C@H](CC1CCCCC1)c1ccc(Cl)s1 ZINC000035583559 172281671 /nfs/dbraw/zinc/28/16/71/172281671.db2.gz QPBRFXAMCZPWLW-CYBMUJFWSA-N 1 0 285.884 5.413 10 0 CKAERO CCC[NH2+][C@H](c1ccc(Cl)s1)c1ccc(CC)cc1 ZINC000035583580 172281937 /nfs/dbraw/zinc/28/19/37/172281937.db2.gz NAQJKQSSLKGLTH-INIZCTEOSA-N 1 0 293.863 5.053 10 0 CKAERO CCC[NH2+][C@@H](c1ccc(Cl)s1)c1ccc(CC)cc1 ZINC000035583581 172281631 /nfs/dbraw/zinc/28/16/31/172281631.db2.gz NAQJKQSSLKGLTH-MRXNPFEDSA-N 1 0 293.863 5.053 10 0 CKAERO CCC[NH2+][C@@H](c1ccc(Cl)s1)C1CCCCC1 ZINC000035583648 172281802 /nfs/dbraw/zinc/28/18/02/172281802.db2.gz ZUSLYJGLTCFDGN-CQSZACIVSA-N 1 0 271.857 5.023 10 0 CKAERO CCC[NH2+][C@H](c1ccc(Cl)s1)C1CCCCC1 ZINC000035583649 172282028 /nfs/dbraw/zinc/28/20/28/172282028.db2.gz ZUSLYJGLTCFDGN-AWEZNQCLSA-N 1 0 271.857 5.023 10 0 CKAERO CCC[NH2+][C@@H](c1cccs1)c1csc2ccccc12 ZINC000035583982 172282358 /nfs/dbraw/zinc/28/23/58/172282358.db2.gz HMDOTMIMRFTCBD-MRXNPFEDSA-N 1 0 287.453 5.052 10 0 CKAERO CCC[NH2+][C@H](c1cccs1)c1csc2ccccc12 ZINC000035583983 172282447 /nfs/dbraw/zinc/28/24/47/172282447.db2.gz HMDOTMIMRFTCBD-INIZCTEOSA-N 1 0 287.453 5.052 10 0 CKAERO CCCC[C@H]([NH2+]CCC)c1csc2ccccc12 ZINC000035583988 172282863 /nfs/dbraw/zinc/28/28/63/172282863.db2.gz LKCQCAXFUXJXGV-HNNXBMFYSA-N 1 0 261.434 5.132 10 0 CKAERO CCCC[C@@H]([NH2+]CCC)c1csc2ccccc12 ZINC000035583989 172282379 /nfs/dbraw/zinc/28/23/79/172282379.db2.gz LKCQCAXFUXJXGV-OAHLLOKOSA-N 1 0 261.434 5.132 10 0 CKAERO CCC[NH2+][C@H](c1csc2ccccc21)[C@H](C)CCC ZINC000035584018 172282360 /nfs/dbraw/zinc/28/23/60/172282360.db2.gz CQMANVWFEPQWOM-DYVFJYSZSA-N 1 0 275.461 5.378 10 0 CKAERO CCC[NH2+][C@H](c1csc2ccccc12)[C@@H](C)CCC ZINC000035584019 172282660 /nfs/dbraw/zinc/28/26/60/172282660.db2.gz CQMANVWFEPQWOM-GUYCJALGSA-N 1 0 275.461 5.378 10 0 CKAERO CCC[NH2+][C@@H](c1csc2ccccc12)[C@H](C)CCC ZINC000035584020 172282584 /nfs/dbraw/zinc/28/25/84/172282584.db2.gz CQMANVWFEPQWOM-CXAGYDPISA-N 1 0 275.461 5.378 10 0 CKAERO CCC[NH2+][C@@H](c1csc2ccccc12)[C@@H](C)CCC ZINC000035584021 172282475 /nfs/dbraw/zinc/28/24/75/172282475.db2.gz CQMANVWFEPQWOM-SUMWQHHRSA-N 1 0 275.461 5.378 10 0 CKAERO CCC[NH2+][C@@H](CCC(C)C)c1csc2ccccc21 ZINC000035584022 172282364 /nfs/dbraw/zinc/28/23/64/172282364.db2.gz ZOTGIXAJPWSUSV-INIZCTEOSA-N 1 0 275.461 5.378 10 0 CKAERO CCC[NH2+][C@H](CCC(C)C)c1csc2ccccc21 ZINC000035584023 172282719 /nfs/dbraw/zinc/28/27/19/172282719.db2.gz ZOTGIXAJPWSUSV-MRXNPFEDSA-N 1 0 275.461 5.378 10 0 CKAERO CCCC[C@H]([NH2+]CCC)c1ccc(Cl)c(Cl)c1 ZINC000035584827 172284340 /nfs/dbraw/zinc/28/43/40/172284340.db2.gz XGECDKUBJVCSLA-AWEZNQCLSA-N 1 0 274.235 5.224 10 0 CKAERO CCCC[C@@H]([NH2+]CCC)c1ccc(Cl)c(Cl)c1 ZINC000035584828 172283850 /nfs/dbraw/zinc/28/38/50/172283850.db2.gz XGECDKUBJVCSLA-CQSZACIVSA-N 1 0 274.235 5.224 10 0 CKAERO CCC[NH2+][C@@H](c1ccc(Cl)c(Cl)c1)C(C)(C)C ZINC000035584839 172284002 /nfs/dbraw/zinc/28/40/02/172284002.db2.gz FUHGEMXOOUTKLE-ZDUSSCGKSA-N 1 0 274.235 5.080 10 0 CKAERO CCC[NH2+][C@H](c1ccc(Cl)c(Cl)c1)C(C)(C)C ZINC000035584840 172284086 /nfs/dbraw/zinc/28/40/86/172284086.db2.gz FUHGEMXOOUTKLE-CYBMUJFWSA-N 1 0 274.235 5.080 10 0 CKAERO CCCCC[C@H]([NH2+]CCC)c1ccc(Cl)c(Cl)c1 ZINC000035584841 172284338 /nfs/dbraw/zinc/28/43/38/172284338.db2.gz LBTKIXBCEGUALN-HNNXBMFYSA-N 1 0 288.262 5.614 10 0 CKAERO CCCCC[C@@H]([NH2+]CCC)c1ccc(Cl)c(Cl)c1 ZINC000035584842 172283989 /nfs/dbraw/zinc/28/39/89/172283989.db2.gz LBTKIXBCEGUALN-OAHLLOKOSA-N 1 0 288.262 5.614 10 0 CKAERO CCC[NH2+][C@H](c1ccc(Cl)c(Cl)c1)[C@H](C)CCC ZINC000035584851 172284118 /nfs/dbraw/zinc/28/41/18/172284118.db2.gz NDSFFMAVUNADTC-ABAIWWIYSA-N 1 0 288.262 5.470 10 0 CKAERO CCC[NH2+][C@H](c1ccc(Cl)c(Cl)c1)[C@@H](C)CCC ZINC000035584852 172284078 /nfs/dbraw/zinc/28/40/78/172284078.db2.gz NDSFFMAVUNADTC-NHYWBVRUSA-N 1 0 288.262 5.470 10 0 CKAERO CCC[NH2+][C@@H](c1ccc(Cl)c(Cl)c1)[C@H](C)CCC ZINC000035584853 172284309 /nfs/dbraw/zinc/28/43/09/172284309.db2.gz NDSFFMAVUNADTC-IAQYHMDHSA-N 1 0 288.262 5.470 10 0 CKAERO CCC[NH2+][C@@H](c1ccc(Cl)c(Cl)c1)[C@@H](C)CCC ZINC000035584854 172283866 /nfs/dbraw/zinc/28/38/66/172283866.db2.gz NDSFFMAVUNADTC-XHDPSFHLSA-N 1 0 288.262 5.470 10 0 CKAERO CCC[NH2+][C@@H](CCC(C)C)c1ccc(Cl)c(Cl)c1 ZINC000035584855 172284215 /nfs/dbraw/zinc/28/42/15/172284215.db2.gz HAHNUSOMMABKNQ-HNNXBMFYSA-N 1 0 288.262 5.470 10 0 CKAERO CCC[NH2+][C@H](CCC(C)C)c1ccc(Cl)c(Cl)c1 ZINC000035584856 172283955 /nfs/dbraw/zinc/28/39/55/172283955.db2.gz HAHNUSOMMABKNQ-OAHLLOKOSA-N 1 0 288.262 5.470 10 0 CKAERO CCC[NH2+][C@@H](c1ccc(Cl)c(Cl)c1)[C@@H](C)CC ZINC000035584883 172284365 /nfs/dbraw/zinc/28/43/65/172284365.db2.gz ZDTOLUSDCYVAAY-IINYFYTJSA-N 1 0 274.235 5.080 10 0 CKAERO CCC[NH2+][C@H](c1ccc(Cl)c(Cl)c1)[C@@H](C)CC ZINC000035584884 172284361 /nfs/dbraw/zinc/28/43/61/172284361.db2.gz ZDTOLUSDCYVAAY-HZMBPMFUSA-N 1 0 274.235 5.080 10 0 CKAERO CCC[NH2+][C@@H](c1ccc(Cl)c(Cl)c1)[C@H](C)CC ZINC000035584885 172283902 /nfs/dbraw/zinc/28/39/02/172283902.db2.gz ZDTOLUSDCYVAAY-QMTHXVAHSA-N 1 0 274.235 5.080 10 0 CKAERO CCC[NH2+][C@H](c1ccc(Cl)c(Cl)c1)[C@H](C)CC ZINC000035584886 172284284 /nfs/dbraw/zinc/28/42/84/172284284.db2.gz ZDTOLUSDCYVAAY-YGRLFVJLSA-N 1 0 274.235 5.080 10 0 CKAERO CCC[NH2+][C@@H](CC(C)(C)C)c1ccc(Cl)c(Cl)c1 ZINC000035584889 172284346 /nfs/dbraw/zinc/28/43/46/172284346.db2.gz YKZQPRZEBYCVFM-AWEZNQCLSA-N 1 0 288.262 5.470 10 0 CKAERO CCC[NH2+][C@H](CC(C)(C)C)c1ccc(Cl)c(Cl)c1 ZINC000035584890 172284383 /nfs/dbraw/zinc/28/43/83/172284383.db2.gz YKZQPRZEBYCVFM-CQSZACIVSA-N 1 0 288.262 5.470 10 0 CKAERO CCC[NH2+][C@@H](CC(C)C)c1ccc(Cl)c(Cl)c1 ZINC000035584906 172283965 /nfs/dbraw/zinc/28/39/65/172283965.db2.gz SWOIPHXSDLMXKH-AWEZNQCLSA-N 1 0 274.235 5.080 10 0 CKAERO CCC[NH2+][C@H](CC(C)C)c1ccc(Cl)c(Cl)c1 ZINC000035584907 172284282 /nfs/dbraw/zinc/28/42/82/172284282.db2.gz SWOIPHXSDLMXKH-CQSZACIVSA-N 1 0 274.235 5.080 10 0 CKAERO CCC[NH2+][C@@H](c1ccc(Cl)c(Cl)c1)C1CCCC1 ZINC000035584938 172284295 /nfs/dbraw/zinc/28/42/95/172284295.db2.gz SEBHARKTKQKQKQ-OAHLLOKOSA-N 1 0 286.246 5.224 10 0 CKAERO CCC[NH2+][C@H](c1ccc(Cl)c(Cl)c1)C1CCCC1 ZINC000035584939 172284204 /nfs/dbraw/zinc/28/42/04/172284204.db2.gz SEBHARKTKQKQKQ-HNNXBMFYSA-N 1 0 286.246 5.224 10 0 CKAERO CCC[NH2+][C@@H](c1ccc(Cl)c(Cl)c1)C(CC)CC ZINC000035584950 172284207 /nfs/dbraw/zinc/28/42/07/172284207.db2.gz WWKPYAYZKCZOJD-OAHLLOKOSA-N 1 0 288.262 5.470 10 0 CKAERO CCC[NH2+][C@H](c1ccc(Cl)c(Cl)c1)C(CC)CC ZINC000035584951 172284314 /nfs/dbraw/zinc/28/43/14/172284314.db2.gz WWKPYAYZKCZOJD-HNNXBMFYSA-N 1 0 288.262 5.470 10 0 CKAERO CCCC[C@H]([NH2+]CCC)c1cc(Cl)ccc1Cl ZINC000035585052 172284710 /nfs/dbraw/zinc/28/47/10/172284710.db2.gz IZPCVJDTEGEIQY-AWEZNQCLSA-N 1 0 274.235 5.224 10 0 CKAERO CCCC[C@@H]([NH2+]CCC)c1cc(Cl)ccc1Cl ZINC000035585053 172285095 /nfs/dbraw/zinc/28/50/95/172285095.db2.gz IZPCVJDTEGEIQY-CQSZACIVSA-N 1 0 274.235 5.224 10 0 CKAERO CCC[NH2+][C@@H](c1cc(Cl)ccc1Cl)C(C)(C)C ZINC000035585064 172284822 /nfs/dbraw/zinc/28/48/22/172284822.db2.gz AQPYJRAAPHDFMY-ZDUSSCGKSA-N 1 0 274.235 5.080 10 0 CKAERO CCC[NH2+][C@H](c1cc(Cl)ccc1Cl)C(C)(C)C ZINC000035585065 172284630 /nfs/dbraw/zinc/28/46/30/172284630.db2.gz AQPYJRAAPHDFMY-CYBMUJFWSA-N 1 0 274.235 5.080 10 0 CKAERO CCCCC[C@H]([NH2+]CCC)c1cc(Cl)ccc1Cl ZINC000035585066 172284742 /nfs/dbraw/zinc/28/47/42/172284742.db2.gz RQPBCVXXQKIXCH-HNNXBMFYSA-N 1 0 288.262 5.614 10 0 CKAERO CCCCC[C@@H]([NH2+]CCC)c1cc(Cl)ccc1Cl ZINC000035585067 172284682 /nfs/dbraw/zinc/28/46/82/172284682.db2.gz RQPBCVXXQKIXCH-OAHLLOKOSA-N 1 0 288.262 5.614 10 0 CKAERO CCC[NH2+][C@H](c1cc(Cl)ccc1Cl)[C@H](C)CCC ZINC000035585076 172284847 /nfs/dbraw/zinc/28/48/47/172284847.db2.gz STCKZVKAXDZTST-ABAIWWIYSA-N 1 0 288.262 5.470 10 0 CKAERO CCC[NH2+][C@H](c1cc(Cl)ccc1Cl)[C@@H](C)CCC ZINC000035585077 172284572 /nfs/dbraw/zinc/28/45/72/172284572.db2.gz STCKZVKAXDZTST-NHYWBVRUSA-N 1 0 288.262 5.470 10 0 CKAERO CCC[NH2+][C@@H](c1cc(Cl)ccc1Cl)[C@H](C)CCC ZINC000035585078 172284575 /nfs/dbraw/zinc/28/45/75/172284575.db2.gz STCKZVKAXDZTST-IAQYHMDHSA-N 1 0 288.262 5.470 10 0 CKAERO CCC[NH2+][C@@H](c1cc(Cl)ccc1Cl)[C@@H](C)CCC ZINC000035585079 172284542 /nfs/dbraw/zinc/28/45/42/172284542.db2.gz STCKZVKAXDZTST-XHDPSFHLSA-N 1 0 288.262 5.470 10 0 CKAERO CCC[NH2+][C@@H](CCC(C)C)c1cc(Cl)ccc1Cl ZINC000035585080 172284851 /nfs/dbraw/zinc/28/48/51/172284851.db2.gz XPHOQWUMMMNHAM-HNNXBMFYSA-N 1 0 288.262 5.470 10 0 CKAERO CCC[NH2+][C@H](CCC(C)C)c1cc(Cl)ccc1Cl ZINC000035585081 172284486 /nfs/dbraw/zinc/28/44/86/172284486.db2.gz XPHOQWUMMMNHAM-OAHLLOKOSA-N 1 0 288.262 5.470 10 0 CKAERO CCC[NH2+][C@@H](c1cc(Cl)ccc1Cl)[C@@H](C)CC ZINC000035585116 172284798 /nfs/dbraw/zinc/28/47/98/172284798.db2.gz ZKFTVTQYIHXSNO-IINYFYTJSA-N 1 0 274.235 5.080 10 0 CKAERO CCC[NH2+][C@H](c1cc(Cl)ccc1Cl)[C@@H](C)CC ZINC000035585118 172284983 /nfs/dbraw/zinc/28/49/83/172284983.db2.gz ZKFTVTQYIHXSNO-HZMBPMFUSA-N 1 0 274.235 5.080 10 0 CKAERO CCC[NH2+][C@@H](c1cc(Cl)ccc1Cl)[C@H](C)CC ZINC000035585120 172284463 /nfs/dbraw/zinc/28/44/63/172284463.db2.gz ZKFTVTQYIHXSNO-QMTHXVAHSA-N 1 0 274.235 5.080 10 0 CKAERO CCC[NH2+][C@H](c1cc(Cl)ccc1Cl)[C@H](C)CC ZINC000035585122 172284954 /nfs/dbraw/zinc/28/49/54/172284954.db2.gz ZKFTVTQYIHXSNO-YGRLFVJLSA-N 1 0 274.235 5.080 10 0 CKAERO CCC[NH2+][C@@H](CC(C)(C)C)c1cc(Cl)ccc1Cl ZINC000035585128 172284601 /nfs/dbraw/zinc/28/46/01/172284601.db2.gz VRKCHVZHVUHZPR-AWEZNQCLSA-N 1 0 288.262 5.470 10 0 CKAERO CCC[NH2+][C@H](CC(C)(C)C)c1cc(Cl)ccc1Cl ZINC000035585130 172284952 /nfs/dbraw/zinc/28/49/52/172284952.db2.gz VRKCHVZHVUHZPR-CQSZACIVSA-N 1 0 288.262 5.470 10 0 CKAERO CCC[NH2+][C@@H](CC(C)C)c1cc(Cl)ccc1Cl ZINC000035585161 172284914 /nfs/dbraw/zinc/28/49/14/172284914.db2.gz QUYFCWKETLFATI-AWEZNQCLSA-N 1 0 274.235 5.080 10 0 CKAERO CCC[NH2+][C@H](CC(C)C)c1cc(Cl)ccc1Cl ZINC000035585163 172284714 /nfs/dbraw/zinc/28/47/14/172284714.db2.gz QUYFCWKETLFATI-CQSZACIVSA-N 1 0 274.235 5.080 10 0 CKAERO CCC[NH2+][C@@H](c1cc(Cl)ccc1Cl)C1CCCC1 ZINC000035585225 172284645 /nfs/dbraw/zinc/28/46/45/172284645.db2.gz OAZJYBYIJIZODZ-OAHLLOKOSA-N 1 0 286.246 5.224 10 0 CKAERO CCC[NH2+][C@@H](c1cc(Cl)ccc1Cl)C(CC)CC ZINC000035585247 172284718 /nfs/dbraw/zinc/28/47/18/172284718.db2.gz DIMIHFSDEAQCGP-OAHLLOKOSA-N 1 0 288.262 5.470 10 0 CKAERO CCC[NH2+][C@H](c1cc(Cl)ccc1Cl)C(CC)CC ZINC000035585249 172284451 /nfs/dbraw/zinc/28/44/51/172284451.db2.gz DIMIHFSDEAQCGP-HNNXBMFYSA-N 1 0 288.262 5.470 10 0 CKAERO CCCC[C@H]([NH2+]CCC)c1cc(Cl)sc1Cl ZINC000035585332 172285060 /nfs/dbraw/zinc/28/50/60/172285060.db2.gz ZIHCBDIWTVIMTC-JTQLQIEISA-N 1 0 280.264 5.286 10 0 CKAERO CCCC[C@@H]([NH2+]CCC)c1cc(Cl)sc1Cl ZINC000035585333 172284657 /nfs/dbraw/zinc/28/46/57/172284657.db2.gz ZIHCBDIWTVIMTC-SNVBAGLBSA-N 1 0 280.264 5.286 10 0 CKAERO CCC[NH2+][C@@H](c1cc(Cl)sc1Cl)C(C)(C)C ZINC000035585355 172284786 /nfs/dbraw/zinc/28/47/86/172284786.db2.gz SUEYAEJSONFQNX-JTQLQIEISA-N 1 0 280.264 5.142 10 0 CKAERO CCC[NH2+][C@H](c1cc(Cl)sc1Cl)C(C)(C)C ZINC000035585356 172284721 /nfs/dbraw/zinc/28/47/21/172284721.db2.gz SUEYAEJSONFQNX-SNVBAGLBSA-N 1 0 280.264 5.142 10 0 CKAERO CCCCC[C@H]([NH2+]CCC)c1cc(Cl)sc1Cl ZINC000035585362 172285071 /nfs/dbraw/zinc/28/50/71/172285071.db2.gz ZDSGWZGDFLKOTF-NSHDSACASA-N 1 0 294.291 5.676 10 0 CKAERO CCCCC[C@@H]([NH2+]CCC)c1cc(Cl)sc1Cl ZINC000035585364 172284475 /nfs/dbraw/zinc/28/44/75/172284475.db2.gz ZDSGWZGDFLKOTF-LLVKDONJSA-N 1 0 294.291 5.676 10 0 CKAERO CCC[NH2+][C@H](c1cc(Cl)sc1Cl)[C@H](C)CCC ZINC000035585387 172285038 /nfs/dbraw/zinc/28/50/38/172285038.db2.gz UAOZXYYFCWUYGL-SKDRFNHKSA-N 1 0 294.291 5.532 10 0 CKAERO CCC[NH2+][C@H](c1cc(Cl)sc1Cl)[C@@H](C)CCC ZINC000035585389 172284672 /nfs/dbraw/zinc/28/46/72/172284672.db2.gz UAOZXYYFCWUYGL-CABZTGNLSA-N 1 0 294.291 5.532 10 0 CKAERO CCC[NH2+][C@@H](c1cc(Cl)sc1Cl)[C@H](C)CCC ZINC000035585391 172284588 /nfs/dbraw/zinc/28/45/88/172284588.db2.gz UAOZXYYFCWUYGL-BXKDBHETSA-N 1 0 294.291 5.532 10 0 CKAERO CCC[NH2+][C@@H](c1cc(Cl)sc1Cl)[C@@H](C)CCC ZINC000035585393 172285082 /nfs/dbraw/zinc/28/50/82/172285082.db2.gz UAOZXYYFCWUYGL-JOYOIKCWSA-N 1 0 294.291 5.532 10 0 CKAERO CCC[NH2+][C@@H](CCC(C)C)c1cc(Cl)sc1Cl ZINC000035585395 172284996 /nfs/dbraw/zinc/28/49/96/172284996.db2.gz NZADBWYJHPYKJK-NSHDSACASA-N 1 0 294.291 5.532 10 0 CKAERO CCC[NH2+][C@H](CCC(C)C)c1cc(Cl)sc1Cl ZINC000035585396 172284694 /nfs/dbraw/zinc/28/46/94/172284694.db2.gz NZADBWYJHPYKJK-LLVKDONJSA-N 1 0 294.291 5.532 10 0 CKAERO CCC[NH2+][C@@H](c1cc(Cl)sc1Cl)[C@@H](C)CC ZINC000035585477 172285077 /nfs/dbraw/zinc/28/50/77/172285077.db2.gz GUQGBIJMLRHQBL-GZMMTYOYSA-N 1 0 280.264 5.142 10 0 CKAERO CCC[NH2+][C@H](c1cc(Cl)sc1Cl)[C@@H](C)CC ZINC000035585478 172285122 /nfs/dbraw/zinc/28/51/22/172285122.db2.gz GUQGBIJMLRHQBL-KWQFWETISA-N 1 0 280.264 5.142 10 0 CKAERO CCC[NH2+][C@@H](c1cc(Cl)sc1Cl)[C@H](C)CC ZINC000035585479 172284834 /nfs/dbraw/zinc/28/48/34/172284834.db2.gz GUQGBIJMLRHQBL-LDYMZIIASA-N 1 0 280.264 5.142 10 0 CKAERO CCC[NH2+][C@H](c1cc(Cl)sc1Cl)[C@H](C)CC ZINC000035585481 172284894 /nfs/dbraw/zinc/28/48/94/172284894.db2.gz GUQGBIJMLRHQBL-KCJUWKMLSA-N 1 0 280.264 5.142 10 0 CKAERO CCC[NH2+][C@@H](CC(C)(C)C)c1cc(Cl)sc1Cl ZINC000035585488 172284489 /nfs/dbraw/zinc/28/44/89/172284489.db2.gz SJNVYEZUGOSGQB-JTQLQIEISA-N 1 0 294.291 5.532 10 0 CKAERO CCC[NH2+][C@H](CC(C)(C)C)c1cc(Cl)sc1Cl ZINC000035585490 172284908 /nfs/dbraw/zinc/28/49/08/172284908.db2.gz SJNVYEZUGOSGQB-SNVBAGLBSA-N 1 0 294.291 5.532 10 0 CKAERO CCC[NH2+][C@@H](CC(C)C)c1cc(Cl)sc1Cl ZINC000035585516 172284607 /nfs/dbraw/zinc/28/46/07/172284607.db2.gz YFLJIOBCJFJEQZ-JTQLQIEISA-N 1 0 280.264 5.142 10 0 CKAERO CCC[NH2+][C@H](CC(C)C)c1cc(Cl)sc1Cl ZINC000035585517 172284726 /nfs/dbraw/zinc/28/47/26/172284726.db2.gz YFLJIOBCJFJEQZ-SNVBAGLBSA-N 1 0 280.264 5.142 10 0 CKAERO CCC[NH2+][C@@H](c1cc(Cl)sc1Cl)C1CCCC1 ZINC000035585598 172284516 /nfs/dbraw/zinc/28/45/16/172284516.db2.gz YJIVZAXFNIOEAJ-GFCCVEGCSA-N 1 0 292.275 5.286 10 0 CKAERO CCC[NH2+][C@H](c1cc(Cl)sc1Cl)C1CCCC1 ZINC000035585600 172284827 /nfs/dbraw/zinc/28/48/27/172284827.db2.gz YJIVZAXFNIOEAJ-LBPRGKRZSA-N 1 0 292.275 5.286 10 0 CKAERO CCC[NH2+][C@@H](c1cc(Cl)sc1Cl)C(CC)CC ZINC000035585643 172284513 /nfs/dbraw/zinc/28/45/13/172284513.db2.gz FXLFFFWEMDGSBG-GFCCVEGCSA-N 1 0 294.291 5.532 10 0 CKAERO CCC[NH2+][C@H](c1cc(Cl)sc1Cl)C(CC)CC ZINC000035585644 172284919 /nfs/dbraw/zinc/28/49/19/172284919.db2.gz FXLFFFWEMDGSBG-LBPRGKRZSA-N 1 0 294.291 5.532 10 0 CKAERO CC[C@H]([NH2+]C1CCCCC1)c1ccc(Cl)cc1Cl ZINC000035624788 172304896 /nfs/dbraw/zinc/30/48/96/172304896.db2.gz WMODVBLCBCZVNK-HNNXBMFYSA-N 1 0 286.246 5.367 10 0 CKAERO CC[C@@H]([NH2+]C1CCCCC1)c1ccc(Cl)cc1Cl ZINC000035624790 172304800 /nfs/dbraw/zinc/30/48/00/172304800.db2.gz WMODVBLCBCZVNK-OAHLLOKOSA-N 1 0 286.246 5.367 10 0 CKAERO CCC(CC)[NH2+][C@@H](CC)c1ccc(Cl)cc1Cl ZINC000035624820 172305083 /nfs/dbraw/zinc/30/50/83/172305083.db2.gz RIELNSDVPGXWRN-AWEZNQCLSA-N 1 0 274.235 5.223 10 0 CKAERO CCC(CC)[NH2+][C@H](CC)c1ccc(Cl)cc1Cl ZINC000035624821 172304658 /nfs/dbraw/zinc/30/46/58/172304658.db2.gz RIELNSDVPGXWRN-CQSZACIVSA-N 1 0 274.235 5.223 10 0 CKAERO CCCCC[NH2+][C@@H](CC)c1ccc(Cl)cc1Cl ZINC000035624853 172304625 /nfs/dbraw/zinc/30/46/25/172304625.db2.gz RASINOTULQBUPS-AWEZNQCLSA-N 1 0 274.235 5.224 10 0 CKAERO CCCCC[NH2+][C@H](CC)c1ccc(Cl)cc1Cl ZINC000035624854 172305105 /nfs/dbraw/zinc/30/51/05/172305105.db2.gz RASINOTULQBUPS-CQSZACIVSA-N 1 0 274.235 5.224 10 0 CKAERO CCC[C@@H](C)[NH2+][C@@H](CC)c1ccc(Cl)cc1Cl ZINC000035624864 172304811 /nfs/dbraw/zinc/30/48/11/172304811.db2.gz AOPKSVMILRSUBA-YGRLFVJLSA-N 1 0 274.235 5.223 10 0 CKAERO CCC[C@H](C)[NH2+][C@@H](CC)c1ccc(Cl)cc1Cl ZINC000035624866 172304645 /nfs/dbraw/zinc/30/46/45/172304645.db2.gz AOPKSVMILRSUBA-HZMBPMFUSA-N 1 0 274.235 5.223 10 0 CKAERO CCC[C@@H](C)[NH2+][C@H](CC)c1ccc(Cl)cc1Cl ZINC000035624868 172304981 /nfs/dbraw/zinc/30/49/81/172304981.db2.gz AOPKSVMILRSUBA-QMTHXVAHSA-N 1 0 274.235 5.223 10 0 CKAERO CCC[C@H](C)[NH2+][C@H](CC)c1ccc(Cl)cc1Cl ZINC000035624870 172304601 /nfs/dbraw/zinc/30/46/01/172304601.db2.gz AOPKSVMILRSUBA-IINYFYTJSA-N 1 0 274.235 5.223 10 0 CKAERO CC[C@H]([NH2+]CCC(C)C)c1ccc(Cl)cc1Cl ZINC000035624934 172305177 /nfs/dbraw/zinc/30/51/77/172305177.db2.gz GNKKYYMXXHWHCN-AWEZNQCLSA-N 1 0 274.235 5.080 10 0 CKAERO CC[C@@H]([NH2+]CCC(C)C)c1ccc(Cl)cc1Cl ZINC000035624936 172305003 /nfs/dbraw/zinc/30/50/03/172305003.db2.gz GNKKYYMXXHWHCN-CQSZACIVSA-N 1 0 274.235 5.080 10 0 CKAERO CCCCCC[NH2+][C@@H](CC)c1ccc(Cl)cc1Cl ZINC000035625325 172304952 /nfs/dbraw/zinc/30/49/52/172304952.db2.gz KPWUWAATNXWZLX-HNNXBMFYSA-N 1 0 288.262 5.614 10 0 CKAERO CCCCCC[NH2+][C@H](CC)c1ccc(Cl)cc1Cl ZINC000035625327 172304970 /nfs/dbraw/zinc/30/49/70/172304970.db2.gz KPWUWAATNXWZLX-OAHLLOKOSA-N 1 0 288.262 5.614 10 0 CKAERO CC[C@H]([NH2+][C@@H](C)C(C)C)c1ccc(Cl)cc1Cl ZINC000035625493 172305040 /nfs/dbraw/zinc/30/50/40/172305040.db2.gz UUSKCQJOIQKWAI-HZMBPMFUSA-N 1 0 274.235 5.079 10 0 CKAERO CC[C@@H]([NH2+][C@@H](C)C(C)C)c1ccc(Cl)cc1Cl ZINC000035625495 172304596 /nfs/dbraw/zinc/30/45/96/172304596.db2.gz UUSKCQJOIQKWAI-IINYFYTJSA-N 1 0 274.235 5.079 10 0 CKAERO CC[C@H]([NH2+][C@H](C)C(C)C)c1ccc(Cl)cc1Cl ZINC000035625497 172305102 /nfs/dbraw/zinc/30/51/02/172305102.db2.gz UUSKCQJOIQKWAI-YGRLFVJLSA-N 1 0 274.235 5.079 10 0 CKAERO CC[C@@H]([NH2+][C@H](C)C(C)C)c1ccc(Cl)cc1Cl ZINC000035625499 172305029 /nfs/dbraw/zinc/30/50/29/172305029.db2.gz UUSKCQJOIQKWAI-QMTHXVAHSA-N 1 0 274.235 5.079 10 0 CKAERO CC[C@H]([NH2+]CC1CCCC1)c1ccc(Cl)cc1Cl ZINC000035625560 172305058 /nfs/dbraw/zinc/30/50/58/172305058.db2.gz OSKPBSWCZCIGGF-HNNXBMFYSA-N 1 0 286.246 5.224 10 0 CKAERO CC[C@@H]([NH2+]CC1CCCC1)c1ccc(Cl)cc1Cl ZINC000035625562 172304750 /nfs/dbraw/zinc/30/47/50/172304750.db2.gz OSKPBSWCZCIGGF-OAHLLOKOSA-N 1 0 286.246 5.224 10 0 CKAERO CC[C@@H]([NH2+][C@@H](C)CC(C)C)c1ccc(Cl)cc1Cl ZINC000035625570 172304928 /nfs/dbraw/zinc/30/49/28/172304928.db2.gz HWWGKLYCFWFDJI-XHDPSFHLSA-N 1 0 288.262 5.469 10 0 CKAERO CC[C@H]([NH2+][C@H](C)CC(C)C)c1ccc(Cl)cc1Cl ZINC000035625572 172304961 /nfs/dbraw/zinc/30/49/61/172304961.db2.gz HWWGKLYCFWFDJI-ABAIWWIYSA-N 1 0 288.262 5.469 10 0 CKAERO CC[C@@H]([NH2+][C@H](C)CC(C)C)c1ccc(Cl)cc1Cl ZINC000035625574 172304679 /nfs/dbraw/zinc/30/46/79/172304679.db2.gz HWWGKLYCFWFDJI-IAQYHMDHSA-N 1 0 288.262 5.469 10 0 CKAERO C[C@@H]([NH3+])c1c(F)cccc1Sc1ccc2ccccc2c1 ZINC000035676527 172347531 /nfs/dbraw/zinc/34/75/31/172347531.db2.gz ZJWCLTBJASZONQ-GFCCVEGCSA-N 1 0 297.398 5.150 10 0 CKAERO C[C@H]([NH3+])c1ccc(Sc2ccc3ccccc3c2)cc1 ZINC000035676528 172347178 /nfs/dbraw/zinc/34/71/78/172347178.db2.gz XDRGBEKOEAIHTK-ZDUSSCGKSA-N 1 0 279.408 5.011 10 0 CKAERO C[C@@H]([NH3+])c1cc(F)ccc1Sc1ccc2ccccc2c1 ZINC000035676531 172347283 /nfs/dbraw/zinc/34/72/83/172347283.db2.gz QIUQYDBVXMPGHQ-GFCCVEGCSA-N 1 0 297.398 5.150 10 0 CKAERO C[C@@H]([NH3+])c1ccc(Sc2ccc3ccccc3c2)c(F)c1 ZINC000035676533 172347204 /nfs/dbraw/zinc/34/72/04/172347204.db2.gz KWDGJQXYNVLMOL-GFCCVEGCSA-N 1 0 297.398 5.150 10 0 CKAERO C[C@H]([NH3+])c1ccccc1Sc1ccc2ccccc2c1 ZINC000035676534 172347181 /nfs/dbraw/zinc/34/71/81/172347181.db2.gz OWKPAJFNKXTSEL-ZDUSSCGKSA-N 1 0 279.408 5.011 10 0 CKAERO C[C@H]([NH2+][C@@H](c1ccccc1)C1CCCCC1)c1ccco1 ZINC000035738638 172392323 /nfs/dbraw/zinc/39/23/23/172392323.db2.gz JSOJFUSZBNMCEI-KXBFYZLASA-N 1 0 283.415 5.252 10 0 CKAERO C[C@@H]([NH2+][C@@H](c1ccccc1)C1CCCCC1)c1ccco1 ZINC000035738639 172392824 /nfs/dbraw/zinc/39/28/24/172392824.db2.gz JSOJFUSZBNMCEI-BEFAXECRSA-N 1 0 283.415 5.252 10 0 CKAERO C[C@H]([NH2+][C@H](c1ccccc1)C1CCCCC1)c1ccco1 ZINC000035738640 172392818 /nfs/dbraw/zinc/39/28/18/172392818.db2.gz JSOJFUSZBNMCEI-HNAYVOBHSA-N 1 0 283.415 5.252 10 0 CKAERO C[C@@H]([NH2+][C@H](c1ccccc1)C1CCCCC1)c1ccco1 ZINC000035738641 172392585 /nfs/dbraw/zinc/39/25/85/172392585.db2.gz JSOJFUSZBNMCEI-DNVCBOLYSA-N 1 0 283.415 5.252 10 0 CKAERO CCCC[C@H]([NH2+][C@@H](C)c1ccco1)c1ccc(F)cc1 ZINC000035738650 172392362 /nfs/dbraw/zinc/39/23/62/172392362.db2.gz UCJJPULVVIOTRY-BBRMVZONSA-N 1 0 275.367 5.001 10 0 CKAERO CCCC[C@@H]([NH2+][C@@H](C)c1ccco1)c1ccc(F)cc1 ZINC000035738651 172392857 /nfs/dbraw/zinc/39/28/57/172392857.db2.gz UCJJPULVVIOTRY-XJKSGUPXSA-N 1 0 275.367 5.001 10 0 CKAERO CCCC[C@H]([NH2+][C@H](C)c1ccco1)c1ccc(F)cc1 ZINC000035738652 172392733 /nfs/dbraw/zinc/39/27/33/172392733.db2.gz UCJJPULVVIOTRY-CJNGLKHVSA-N 1 0 275.367 5.001 10 0 CKAERO CCCC[C@@H]([NH2+][C@H](C)c1ccco1)c1ccc(F)cc1 ZINC000035738653 172392552 /nfs/dbraw/zinc/39/25/52/172392552.db2.gz UCJJPULVVIOTRY-CZUORRHYSA-N 1 0 275.367 5.001 10 0 CKAERO CCC[C@H]([NH2+][C@@H](C)c1ccco1)c1ccc(Cl)cc1 ZINC000035738654 172392803 /nfs/dbraw/zinc/39/28/03/172392803.db2.gz JGTXFTDEQNGPBD-WFASDCNBSA-N 1 0 277.795 5.125 10 0 CKAERO CCC[C@@H]([NH2+][C@@H](C)c1ccco1)c1ccc(Cl)cc1 ZINC000035738655 172392806 /nfs/dbraw/zinc/39/28/06/172392806.db2.gz JGTXFTDEQNGPBD-SWLSCSKDSA-N 1 0 277.795 5.125 10 0 CKAERO CCC[C@H]([NH2+][C@H](C)c1ccco1)c1ccc(Cl)cc1 ZINC000035738656 172392763 /nfs/dbraw/zinc/39/27/63/172392763.db2.gz JGTXFTDEQNGPBD-DOMZBBRYSA-N 1 0 277.795 5.125 10 0 CKAERO CCC[C@@H]([NH2+][C@H](C)c1ccco1)c1ccc(Cl)cc1 ZINC000035738657 172392412 /nfs/dbraw/zinc/39/24/12/172392412.db2.gz JGTXFTDEQNGPBD-IUODEOHRSA-N 1 0 277.795 5.125 10 0 CKAERO [NH3+][C@H](c1ccc(-c2cc(Cl)ccc2Cl)s1)C1CC1 ZINC000036666703 172646133 /nfs/dbraw/zinc/64/61/33/172646133.db2.gz GZUIFDPSSNYSNL-AWEZNQCLSA-N 1 0 298.238 5.132 10 0 CKAERO Cc1cc(Cl)ccc1-c1ccc([C@H]([NH3+])C(C)C)s1 ZINC000036666829 172646123 /nfs/dbraw/zinc/64/61/23/172646123.db2.gz QYAXYVDCTKUEGZ-OAHLLOKOSA-N 1 0 279.836 5.033 10 0 CKAERO Cc1cc(Cl)ccc1-c1ccc([C@@H]([NH3+])C(C)C)s1 ZINC000036666830 172646251 /nfs/dbraw/zinc/64/62/51/172646251.db2.gz QYAXYVDCTKUEGZ-HNNXBMFYSA-N 1 0 279.836 5.033 10 0 CKAERO [NH3+][C@@H](c1ccc(-c2cc(Cl)cc(Cl)c2)s1)C1CC1 ZINC000036666851 172646312 /nfs/dbraw/zinc/64/63/12/172646312.db2.gz FGTFHNHFKDJGNA-CQSZACIVSA-N 1 0 298.238 5.132 10 0 CKAERO CCCCC[C@@H](C)[NH2+][C@@H](CC)c1ccc(CC)cc1 ZINC000036792068 172710614 /nfs/dbraw/zinc/71/06/14/172710614.db2.gz CNWXLHTZYIAISY-QAPCUYQASA-N 1 0 261.453 5.259 10 0 CKAERO CCCCC[C@H](C)[NH2+][C@H](CC)c1ccc(CC)cc1 ZINC000036792071 172710646 /nfs/dbraw/zinc/71/06/46/172710646.db2.gz CNWXLHTZYIAISY-MAUKXSAKSA-N 1 0 261.453 5.259 10 0 CKAERO CCCCC[C@@H](C)[NH2+][C@@H](C)c1ccc(SC)cc1 ZINC000036792196 172710532 /nfs/dbraw/zinc/71/05/32/172710532.db2.gz NPTJYHYZJFWKQX-KGLIPLIRSA-N 1 0 265.466 5.028 10 0 CKAERO CCCCC[C@H](C)[NH2+][C@H](C)c1ccccc1Br ZINC000036792379 172710786 /nfs/dbraw/zinc/71/07/86/172710786.db2.gz XSKCMHXEPFFPAZ-QWHCGFSZSA-N 1 0 298.268 5.069 10 0 CKAERO CCCCC[C@@H](C)[NH2+][C@@H](CC)c1cccc(Cl)c1 ZINC000036792380 172710754 /nfs/dbraw/zinc/71/07/54/172710754.db2.gz DHKMMALWBDTNRG-CJNGLKHVSA-N 1 0 267.844 5.350 10 0 CKAERO CCCCC[C@@H](C)[NH2+][C@H](CC)c1cccc(Cl)c1 ZINC000036792382 172711010 /nfs/dbraw/zinc/71/10/10/172711010.db2.gz DHKMMALWBDTNRG-CZUORRHYSA-N 1 0 267.844 5.350 10 0 CKAERO CCCCC[C@H](C)[NH2+][C@H](CC)c1cccc(Cl)c1 ZINC000036792383 172710894 /nfs/dbraw/zinc/71/08/94/172710894.db2.gz DHKMMALWBDTNRG-XJKSGUPXSA-N 1 0 267.844 5.350 10 0 CKAERO CCCCC[C@@H](C)[NH2+][C@@H](CC)c1ccc(Cl)cc1 ZINC000036792416 172711360 /nfs/dbraw/zinc/71/13/60/172711360.db2.gz AEQGCVOFGPTWSD-CJNGLKHVSA-N 1 0 267.844 5.350 10 0 CKAERO CCCCC[C@H](C)[NH2+][C@@H](CC)c1ccc(Cl)cc1 ZINC000036792417 172711546 /nfs/dbraw/zinc/71/15/46/172711546.db2.gz AEQGCVOFGPTWSD-BBRMVZONSA-N 1 0 267.844 5.350 10 0 CKAERO CCCCC[C@H](C)[NH2+][C@@H](C)c1c(C)cc(C)cc1C ZINC000036792425 172711433 /nfs/dbraw/zinc/71/14/33/172711433.db2.gz PCQWYBUZRIEYCI-IRXDYDNUSA-N 1 0 261.453 5.231 10 0 CKAERO CC(C)c1ccc([C@@H]([NH3+])c2cc(Cl)cc(Cl)c2)cc1 ZINC000036819723 172731994 /nfs/dbraw/zinc/73/19/94/172731994.db2.gz PZFOOGXWUHTJMQ-MRXNPFEDSA-N 1 0 294.225 5.165 10 0 CKAERO CCCCC[C@H](C)[NH2+]C1CC(c2ccccc2Cl)C1 ZINC000036850162 172748157 /nfs/dbraw/zinc/74/81/57/172748157.db2.gz BXBISWFFMRRJFY-NFOMZHRRSA-N 1 0 279.855 5.144 10 0 CKAERO CC[C@@H]([NH2+]C1CCC(CC)CC1)c1cccc(Cl)c1 ZINC000036921305 172804743 /nfs/dbraw/zinc/80/47/43/172804743.db2.gz JKXNJCXVAMNPDQ-QWFMPGPPSA-N 1 0 279.855 5.350 10 0 CKAERO CC[C@@H]([NH2+][C@@H](C)c1ccc(C)s1)c1cccc(Cl)c1 ZINC000036921427 172805130 /nfs/dbraw/zinc/80/51/30/172805130.db2.gz SDIIOPDPZFMDNI-SWLSCSKDSA-N 1 0 293.863 5.512 10 0 CKAERO Cc1ccc(C[NH2+][C@H](C)c2ccc(C(C)(C)C)cc2)s1 ZINC000036921598 330313893 /nfs/dbraw/zinc/31/38/93/330313893.db2.gz WBQVJTOBOCSQFP-CQSZACIVSA-N 1 0 287.472 5.205 10 0 CKAERO CCC(CC)C[NH2+][C@@H](C)c1ccc(C(C)(C)C)cc1 ZINC000036921630 172804999 /nfs/dbraw/zinc/80/49/99/172804999.db2.gz XYEHTAFEOULFNQ-AWEZNQCLSA-N 1 0 261.453 5.071 10 0 CKAERO CCC(CC)C[NH2+][C@H](C)c1ccc(C(C)(C)C)cc1 ZINC000036921631 172804981 /nfs/dbraw/zinc/80/49/81/172804981.db2.gz XYEHTAFEOULFNQ-CQSZACIVSA-N 1 0 261.453 5.071 10 0 CKAERO CC(C)c1cccc(-c2ccc([C@@H]([NH3+])C(C)C)s2)c1 ZINC000036927592 172809664 /nfs/dbraw/zinc/80/96/64/172809664.db2.gz KQLIFKBLPIVMNT-KRWDZBQOSA-N 1 0 273.445 5.194 10 0 CKAERO Cc1c(Cl)cccc1-c1ccc([C@H]([NH3+])C(C)C)s1 ZINC000036927714 172810107 /nfs/dbraw/zinc/81/01/07/172810107.db2.gz ZZHJQNMZJNNQNJ-OAHLLOKOSA-N 1 0 279.836 5.033 10 0 CKAERO CCC[C@@H]([NH3+])c1ccc(-c2ccc(C)cc2Cl)s1 ZINC000036927726 172810236 /nfs/dbraw/zinc/81/02/36/172810236.db2.gz KARNSEFIIAUMAX-CYBMUJFWSA-N 1 0 279.836 5.177 10 0 CKAERO CCc1ccc([C@@H](C)[NH2+][C@@H](CC)c2cccs2)cc1 ZINC000036958363 326875345 /nfs/dbraw/zinc/87/53/45/326875345.db2.gz KFSMVJPELZBELK-CJNGLKHVSA-N 1 0 273.445 5.112 10 0 CKAERO CCc1ccc([C@H](C)[NH2+][C@@H](CC)c2cccs2)cc1 ZINC000036958364 326875069 /nfs/dbraw/zinc/87/50/69/326875069.db2.gz KFSMVJPELZBELK-BBRMVZONSA-N 1 0 273.445 5.112 10 0 CKAERO CCc1ccc([C@@H](C)[NH2+][C@H](CC)c2cccs2)cc1 ZINC000036958365 326875131 /nfs/dbraw/zinc/87/51/31/326875131.db2.gz KFSMVJPELZBELK-CZUORRHYSA-N 1 0 273.445 5.112 10 0 CKAERO CCc1ccc([C@@H](C)[NH2+][C@@H](CC)c2ccc(F)cc2)cc1 ZINC000036958526 326875730 /nfs/dbraw/zinc/87/57/30/326875730.db2.gz DHJMAWKDESEOQB-KUHUBIRLSA-N 1 0 285.406 5.190 10 0 CKAERO CCc1ccc([C@@H](C)[NH2+][C@H](CC)c2ccc(F)cc2)cc1 ZINC000036958528 326875651 /nfs/dbraw/zinc/87/56/51/326875651.db2.gz DHJMAWKDESEOQB-AUUYWEPGSA-N 1 0 285.406 5.190 10 0 CKAERO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc3ccccc3c2)o1 ZINC000036960286 326890645 /nfs/dbraw/zinc/89/06/45/326890645.db2.gz BCKDUIRWTNLNGS-LSDHHAIUSA-N 1 0 279.383 5.153 10 0 CKAERO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc3ccccc3c2)o1 ZINC000036960288 326891123 /nfs/dbraw/zinc/89/11/23/326891123.db2.gz BCKDUIRWTNLNGS-GJZGRUSLSA-N 1 0 279.383 5.153 10 0 CKAERO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccc3ccccc3c2)o1 ZINC000036960293 326891678 /nfs/dbraw/zinc/89/16/78/326891678.db2.gz BCKDUIRWTNLNGS-CABCVRRESA-N 1 0 279.383 5.153 10 0 CKAERO CC[C@H](C)C[C@H](CC)[NH2+][C@@H](c1ccccc1)C(C)C ZINC000036967500 172836315 /nfs/dbraw/zinc/83/63/15/172836315.db2.gz ZLNSPZRXNJEUBZ-RYQLBKOJSA-N 1 0 261.453 5.188 10 0 CKAERO CC[C@@H]([NH2+][C@H](CC)c1ccc(Cl)cc1)c1cccs1 ZINC000036978998 172845736 /nfs/dbraw/zinc/84/57/36/172845736.db2.gz STOSZJHVEGFXGF-HUUCEWRRSA-N 1 0 293.863 5.594 10 0 CKAERO CC[C@@H](C)C[C@@H](CC)[NH2+][C@@H](CC)c1ccc(Cl)cc1 ZINC000036979217 172846524 /nfs/dbraw/zinc/84/65/24/172846524.db2.gz LJDREKUEHUDWLS-XYPHTWIQSA-N 1 0 281.871 5.596 10 0 CKAERO Cc1ccc(C)c([C@@H](C)[NH2+][C@@H](C)c2ccc(Cl)s2)c1 ZINC000036992095 172854479 /nfs/dbraw/zinc/85/44/79/172854479.db2.gz KLLWXHOZFILTQM-OLZOCXBDSA-N 1 0 293.863 5.430 10 0 CKAERO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(Cl)s2)cc1C ZINC000036992175 172854381 /nfs/dbraw/zinc/85/43/81/172854381.db2.gz UIEGOFWGZGDFOB-STQMWFEESA-N 1 0 293.863 5.430 10 0 CKAERO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2ccc(Cl)s2)c(C)o1 ZINC000036992453 328638879 /nfs/dbraw/zinc/63/88/79/328638879.db2.gz AFBLSKQSRYVSKH-ZJUUUORDSA-N 1 0 283.824 5.023 10 0 CKAERO Cc1cc([C@@H](C)[NH2+][C@H](C)c2ccc(Cl)s2)c(C)o1 ZINC000036992455 328638937 /nfs/dbraw/zinc/63/89/37/328638937.db2.gz AFBLSKQSRYVSKH-NXEZZACHSA-N 1 0 283.824 5.023 10 0 CKAERO Cc1cc([C@H](C)[NH2+][C@H](C)c2ccc(Cl)s2)c(C)o1 ZINC000036992456 328638814 /nfs/dbraw/zinc/63/88/14/328638814.db2.gz AFBLSKQSRYVSKH-VHSXEESVSA-N 1 0 283.824 5.023 10 0 CKAERO CC[C@@H]1CCCC[C@@H]1[NH2+][C@@H](C)c1ccc(F)c(Cl)c1 ZINC000037031375 172899049 /nfs/dbraw/zinc/89/90/49/172899049.db2.gz QRGWHBYFEWDCRG-OZVIIMIRSA-N 1 0 283.818 5.099 10 0 CKAERO CC[C@H]1CCCC[C@@H]1[NH2+][C@@H](C)c1ccc(F)c(Cl)c1 ZINC000037031376 172899126 /nfs/dbraw/zinc/89/91/26/172899126.db2.gz QRGWHBYFEWDCRG-MKBNYLNASA-N 1 0 283.818 5.099 10 0 CKAERO CC[C@H]1CCCC[C@H]1[NH2+][C@@H](C)c1ccc(F)c(Cl)c1 ZINC000037031378 172899397 /nfs/dbraw/zinc/89/93/97/172899397.db2.gz QRGWHBYFEWDCRG-MQIPJXDCSA-N 1 0 283.818 5.099 10 0 CKAERO CC[C@@H]1CCCC[C@H]1[NH2+][C@@H]1CCCC[C@@H]1C(C)(C)C ZINC000037031559 172898990 /nfs/dbraw/zinc/89/89/90/172898990.db2.gz YOWWMABWZNTBCN-YYIAUSFCSA-N 1 0 265.485 5.150 10 0 CKAERO CC[C@@H]1CCCC[C@@H]1[NH2+][C@@H](C)c1ccc(SC)cc1 ZINC000037031715 172899316 /nfs/dbraw/zinc/89/93/16/172899316.db2.gz VOPUNBKSTAGUKN-VBQJREDUSA-N 1 0 277.477 5.028 10 0 CKAERO CC[C@H]([NH2+][C@H]1CCCC[C@@H]1CC)c1ccc(C)cc1 ZINC000037032170 172899972 /nfs/dbraw/zinc/89/99/72/172899972.db2.gz ZSHFGBMDOIMBQD-SZMVWBNQSA-N 1 0 259.437 5.005 10 0 CKAERO CC[C@@H](C)C[C@H](CC)[NH2+][C@@H](CC)c1ccc(C)cc1 ZINC000037048138 172914451 /nfs/dbraw/zinc/91/44/51/172914451.db2.gz LRRJPSLIKZDUSL-JLSDUUJJSA-N 1 0 261.453 5.251 10 0 CKAERO CC[C@H](C)C[C@H](CC)[NH2+][C@@H](CC)c1ccc(C)cc1 ZINC000037048139 172914341 /nfs/dbraw/zinc/91/43/41/172914341.db2.gz LRRJPSLIKZDUSL-WBAXXEDZSA-N 1 0 261.453 5.251 10 0 CKAERO CCCCCC[C@@H](C)[NH2+][C@@H](CCC)c1ccccc1 ZINC000037062465 172926786 /nfs/dbraw/zinc/92/67/86/172926786.db2.gz SVQWQIBELJLMTL-AEFFLSMTSA-N 1 0 261.453 5.476 10 0 CKAERO CCCCCC[C@H](C)[NH2+][C@H](CCC)c1ccccc1 ZINC000037062468 172926734 /nfs/dbraw/zinc/92/67/34/172926734.db2.gz SVQWQIBELJLMTL-FUHWJXTLSA-N 1 0 261.453 5.476 10 0 CKAERO CCC[C@@H]([NH2+][C@@H](CC)C[C@@H](C)CC)c1ccccc1 ZINC000037062470 172926523 /nfs/dbraw/zinc/92/65/23/172926523.db2.gz CUIHPRHWHBKMPR-RYQLBKOJSA-N 1 0 261.453 5.332 10 0 CKAERO CCC[C@H]([NH2+][C@H](CC)C[C@@H](C)CC)c1ccccc1 ZINC000037062471 172926773 /nfs/dbraw/zinc/92/67/73/172926773.db2.gz CUIHPRHWHBKMPR-JQHSSLGASA-N 1 0 261.453 5.332 10 0 CKAERO CC(C)CC(CC(C)C)[NH2+][C@@H](c1cccs1)C(C)C ZINC000037072430 172932692 /nfs/dbraw/zinc/93/26/92/172932692.db2.gz INOBXISIWYDHCU-QGZVFWFLSA-N 1 0 281.509 5.496 10 0 CKAERO CCCCCC[C@H](C)[NH2+]C1CCC(C(F)(F)F)CC1 ZINC000037092554 172947282 /nfs/dbraw/zinc/94/72/82/172947282.db2.gz PVJZTTRIYVGAKY-HSBZDZAISA-N 1 0 279.390 5.056 10 0 CKAERO CCC[C@H]([NH2+]C(C)(C)CC(C)(C)C)c1ccccc1 ZINC000037100649 172955117 /nfs/dbraw/zinc/95/51/17/172955117.db2.gz MZQODCYFSXMRKR-INIZCTEOSA-N 1 0 261.453 5.332 10 0 CKAERO CC(C)(C)CC(C)(C)[NH2+][C@@H]1CCSc2ccccc21 ZINC000037100697 172955089 /nfs/dbraw/zinc/95/50/89/172955089.db2.gz KFALNQWHGHIWGS-CQSZACIVSA-N 1 0 277.477 5.028 10 0 CKAERO CC(C)(C)CC(C)(C)[NH2+][C@H]1CCSc2ccccc21 ZINC000037100698 172955036 /nfs/dbraw/zinc/95/50/36/172955036.db2.gz KFALNQWHGHIWGS-AWEZNQCLSA-N 1 0 277.477 5.028 10 0 CKAERO CC[C@H]([NH2+]C(C)(C)CC(C)(C)C)c1cccc(Cl)c1 ZINC000037100847 172955027 /nfs/dbraw/zinc/95/50/27/172955027.db2.gz ZKUSVCLLCZRHRB-HNNXBMFYSA-N 1 0 281.871 5.596 10 0 CKAERO CC[C@@H]([NH2+]C(C)(C)CC(C)(C)C)c1cccc(Cl)c1 ZINC000037100848 172955151 /nfs/dbraw/zinc/95/51/51/172955151.db2.gz ZKUSVCLLCZRHRB-OAHLLOKOSA-N 1 0 281.871 5.596 10 0 CKAERO CC[C@@H]([NH2+]C(C)(C)CC(C)(C)C)c1ccc(C)cc1 ZINC000037100876 172954935 /nfs/dbraw/zinc/95/49/35/172954935.db2.gz FHZXCCSGIOLBEC-MRXNPFEDSA-N 1 0 261.453 5.251 10 0 CKAERO CCC(CC)C[NH2+][C@@H](c1ccccc1)C(CC)CC ZINC000037107722 172959484 /nfs/dbraw/zinc/95/94/84/172959484.db2.gz UKCVPUBJFVEERM-GOSISDBHSA-N 1 0 261.453 5.190 10 0 CKAERO CC[C@H](C[C@@H](C)CC)[NH2+][C@@H]1CCSc2ccccc21 ZINC000037128068 172973121 /nfs/dbraw/zinc/97/31/21/172973121.db2.gz FYSXJPRDGZWSFQ-SQWLQELKSA-N 1 0 277.477 5.028 10 0 CKAERO Cc1ccsc1C[NH2+][C@@H](c1cccs1)C1CCCC1 ZINC000037128756 172973562 /nfs/dbraw/zinc/97/35/62/172973562.db2.gz HURHERNVHLLFPY-MRXNPFEDSA-N 1 0 291.485 5.139 10 0 CKAERO C[C@H]([NH2+][C@H](c1cccs1)C1CCCC1)c1cccs1 ZINC000037128847 172973635 /nfs/dbraw/zinc/97/36/35/172973635.db2.gz QNKQSYFHGAQSKJ-LRDDRELGSA-N 1 0 291.485 5.392 10 0 CKAERO CCC(CC)[NH2+][C@@H](CC)c1ccc(Cl)c(Cl)c1 ZINC000037186956 173017713 /nfs/dbraw/zinc/01/77/13/173017713.db2.gz WPUBKWDSIHTCPW-AWEZNQCLSA-N 1 0 274.235 5.223 10 0 CKAERO CCC(CC)[NH2+][C@H](CC)c1ccc(Cl)c(Cl)c1 ZINC000037186957 173017409 /nfs/dbraw/zinc/01/74/09/173017409.db2.gz WPUBKWDSIHTCPW-CQSZACIVSA-N 1 0 274.235 5.223 10 0 CKAERO CCC(CC)[NH2+][C@@H](C)c1ccc(Cl)c(Cl)c1Cl ZINC000037186978 173017203 /nfs/dbraw/zinc/01/72/03/173017203.db2.gz REXXOYOFVHZWNV-QMMMGPOBSA-N 1 0 294.653 5.486 10 0 CKAERO CCC(CC)[NH2+][C@H](C)c1ccc(Cl)c(Cl)c1Cl ZINC000037186979 173017729 /nfs/dbraw/zinc/01/77/29/173017729.db2.gz REXXOYOFVHZWNV-MRVPVSSYSA-N 1 0 294.653 5.486 10 0 CKAERO CCC(CC)[NH2+][C@@H](C)c1sc2ccccc2c1C ZINC000037187003 173017400 /nfs/dbraw/zinc/01/74/00/173017400.db2.gz PFUGDDZMYRVAPH-LBPRGKRZSA-N 1 0 261.434 5.049 10 0 CKAERO CCC(CC)[NH2+][C@H](C)c1sc2ccccc2c1C ZINC000037187004 173017387 /nfs/dbraw/zinc/01/73/87/173017387.db2.gz PFUGDDZMYRVAPH-GFCCVEGCSA-N 1 0 261.434 5.049 10 0 CKAERO CCC(CC)[NH2+][C@@H](c1cccs1)c1ccc(Cl)s1 ZINC000037187010 173017539 /nfs/dbraw/zinc/01/75/39/173017539.db2.gz UFBQNJJOHRRART-AWEZNQCLSA-N 1 0 299.892 5.331 10 0 CKAERO CCC(CC)[NH2+][C@H](c1cccs1)c1ccc(Cl)s1 ZINC000037187011 173017073 /nfs/dbraw/zinc/01/70/73/173017073.db2.gz UFBQNJJOHRRART-CQSZACIVSA-N 1 0 299.892 5.331 10 0 CKAERO CCCC[C@H]([NH2+]C1CCC(C)CC1)c1ccccc1 ZINC000037201538 173025184 /nfs/dbraw/zinc/02/51/84/173025184.db2.gz LQDWZOQLXMKSSB-VJFUWPCTSA-N 1 0 259.437 5.086 10 0 CKAERO CCCC[C@@H]([NH2+]C1CCC(C)CC1)c1ccccc1 ZINC000037201539 173025216 /nfs/dbraw/zinc/02/52/16/173025216.db2.gz LQDWZOQLXMKSSB-VMWRSERWSA-N 1 0 259.437 5.086 10 0 CKAERO C[C@@H]1CCCC[C@@H]1[NH2+]C(c1cccs1)c1cccs1 ZINC000037211501 173032951 /nfs/dbraw/zinc/03/29/51/173032951.db2.gz FEQWQLBXKNMTQV-OLZOCXBDSA-N 1 0 291.485 5.067 10 0 CKAERO C[C@H]1CCCC[C@@H]1[NH2+]C(c1cccs1)c1cccs1 ZINC000037211502 173032584 /nfs/dbraw/zinc/03/25/84/173032584.db2.gz FEQWQLBXKNMTQV-STQMWFEESA-N 1 0 291.485 5.067 10 0 CKAERO C[C@@H]1CCCC[C@H]1[NH2+]C(c1cccs1)c1cccs1 ZINC000037211503 173032742 /nfs/dbraw/zinc/03/27/42/173032742.db2.gz FEQWQLBXKNMTQV-CHWSQXEVSA-N 1 0 291.485 5.067 10 0 CKAERO Cc1cccc([C@@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2)c1 ZINC000037218029 173036068 /nfs/dbraw/zinc/03/60/68/173036068.db2.gz YGPRINSCAKBLRG-UONOGXRCSA-N 1 0 273.807 5.060 10 0 CKAERO Cc1cccc([C@H](C)[NH2+][C@@H](C)c2ccc(Cl)cc2)c1 ZINC000037218030 173035970 /nfs/dbraw/zinc/03/59/70/173035970.db2.gz YGPRINSCAKBLRG-KBPBESRZSA-N 1 0 273.807 5.060 10 0 CKAERO Cc1cccc([C@@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2)c1 ZINC000037218031 173035922 /nfs/dbraw/zinc/03/59/22/173035922.db2.gz YGPRINSCAKBLRG-ZIAGYGMSSA-N 1 0 273.807 5.060 10 0 CKAERO Cc1cccc([C@H](C)[NH2+][C@H](C)c2ccc(Cl)cc2)c1 ZINC000037218032 173036089 /nfs/dbraw/zinc/03/60/89/173036089.db2.gz YGPRINSCAKBLRG-KGLIPLIRSA-N 1 0 273.807 5.060 10 0 CKAERO Cc1cccc([C@@H](C)[NH2+][C@@H](C)c2cccc(Cl)c2)c1 ZINC000037219259 173037230 /nfs/dbraw/zinc/03/72/30/173037230.db2.gz ZBHWXSHWXXSNCT-KGLIPLIRSA-N 1 0 273.807 5.060 10 0 CKAERO Cc1cccc([C@H](C)[NH2+][C@@H](C)c2cccc(Cl)c2)c1 ZINC000037219260 173036986 /nfs/dbraw/zinc/03/69/86/173036986.db2.gz ZBHWXSHWXXSNCT-KBPBESRZSA-N 1 0 273.807 5.060 10 0 CKAERO CCc1ccc([C@@H](CC)[NH2+]C2CCCCCC2)cc1 ZINC000037223953 173044446 /nfs/dbraw/zinc/04/44/46/173044446.db2.gz IWKHGTFBWAKFMM-GOSISDBHSA-N 1 0 259.437 5.013 10 0 CKAERO CCc1ccc([C@H](CC)[NH2+]C2CCCCCC2)cc1 ZINC000037223954 173044692 /nfs/dbraw/zinc/04/46/92/173044692.db2.gz IWKHGTFBWAKFMM-SFHVURJKSA-N 1 0 259.437 5.013 10 0 CKAERO CCc1ccc([C@@H](CC)[NH2+][C@@H](C)c2cccs2)cc1 ZINC000037224153 173045003 /nfs/dbraw/zinc/04/50/03/173045003.db2.gz BPADMYCITJQDJS-XJKSGUPXSA-N 1 0 273.445 5.112 10 0 CKAERO CCc1ccc([C@H](CC)[NH2+][C@@H](C)c2cccs2)cc1 ZINC000037224154 173044725 /nfs/dbraw/zinc/04/47/25/173044725.db2.gz BPADMYCITJQDJS-BBRMVZONSA-N 1 0 273.445 5.112 10 0 CKAERO CCc1ccc([C@@H](CC)[NH2+][C@H](C)c2cccs2)cc1 ZINC000037224155 173045077 /nfs/dbraw/zinc/04/50/77/173045077.db2.gz BPADMYCITJQDJS-CZUORRHYSA-N 1 0 273.445 5.112 10 0 CKAERO CC[C@H]([NH2+]C(C1CC1)C1CC1)c1ccc(Cl)c(Cl)c1 ZINC000037230150 173049849 /nfs/dbraw/zinc/04/98/49/173049849.db2.gz ZVCNHPAHXYJRLU-HNNXBMFYSA-N 1 0 298.257 5.223 10 0 CKAERO CC[C@@H]([NH2+]C(C1CC1)C1CC1)c1ccc(Cl)c(Cl)c1 ZINC000037230152 173050521 /nfs/dbraw/zinc/05/05/21/173050521.db2.gz ZVCNHPAHXYJRLU-OAHLLOKOSA-N 1 0 298.257 5.223 10 0 CKAERO CCCCCC[NH2+][C@@H](c1ccco1)c1ccc(Cl)s1 ZINC000037232617 173051513 /nfs/dbraw/zinc/05/15/13/173051513.db2.gz HINJEVJHJVIOMN-HNNXBMFYSA-N 1 0 297.851 5.254 10 0 CKAERO CCCCCC[NH2+][C@H](c1ccco1)c1ccc(Cl)s1 ZINC000037232618 173051159 /nfs/dbraw/zinc/05/11/59/173051159.db2.gz HINJEVJHJVIOMN-OAHLLOKOSA-N 1 0 297.851 5.254 10 0 CKAERO C[C@H]([NH2+][C@@H](C)c1ccc(F)cc1Cl)c1cccc(F)c1 ZINC000037234852 333522235 /nfs/dbraw/zinc/52/22/35/333522235.db2.gz MZBYFFNTPXKDNF-QWRGUYRKSA-N 1 0 295.760 5.030 10 0 CKAERO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1Cl)c1cccc(F)c1 ZINC000037234854 333522098 /nfs/dbraw/zinc/52/20/98/333522098.db2.gz MZBYFFNTPXKDNF-MNOVXSKESA-N 1 0 295.760 5.030 10 0 CKAERO C[C@@H]([NH2+][C@H](C)c1ccc(F)cc1Cl)c1cccc(F)c1 ZINC000037234858 333522249 /nfs/dbraw/zinc/52/22/49/333522249.db2.gz MZBYFFNTPXKDNF-GHMZBOCLSA-N 1 0 295.760 5.030 10 0 CKAERO CCC(C)(C)C1CCC([NH2+]CC2CCCCC2)CC1 ZINC000037248301 173061229 /nfs/dbraw/zinc/06/12/29/173061229.db2.gz KKLWJNUXDAZOQL-UHFFFAOYSA-N 1 0 265.485 5.151 10 0 CKAERO CCC(C)(C)C1CCC([NH2+][C@@H]2CCC[C@H](C)C2)CC1 ZINC000037249093 173060950 /nfs/dbraw/zinc/06/09/50/173060950.db2.gz LNLZFCDFXVXDJW-ZGRYLRDCSA-N 1 0 265.485 5.150 10 0 CKAERO CCC(C)(C)C1CCC([NH2+][C@H]2CCC[C@H](C)C2)CC1 ZINC000037249095 173061523 /nfs/dbraw/zinc/06/15/23/173061523.db2.gz LNLZFCDFXVXDJW-OTBWCIGPSA-N 1 0 265.485 5.150 10 0 CKAERO CCC(C)(C)C1CCC([NH2+][C@@H]2CCC[C@@H](C)C2)CC1 ZINC000037249097 173060844 /nfs/dbraw/zinc/06/08/44/173060844.db2.gz LNLZFCDFXVXDJW-RDHHWEPZSA-N 1 0 265.485 5.150 10 0 CKAERO CCC(C)(C)C1CCC([NH2+][C@H]2CCC[C@@H](C)C2)CC1 ZINC000037249099 173060722 /nfs/dbraw/zinc/06/07/22/173060722.db2.gz LNLZFCDFXVXDJW-VXLLPVPCSA-N 1 0 265.485 5.150 10 0 CKAERO CC(C)C[C@@H](C)[NH2+][C@@H](c1ccco1)c1ccc(Cl)s1 ZINC000037255799 173066670 /nfs/dbraw/zinc/06/66/70/173066670.db2.gz UXODJSWQGOQEHH-ABAIWWIYSA-N 1 0 297.851 5.108 10 0 CKAERO CC(C)C[C@H](C)[NH2+][C@@H](c1ccco1)c1ccc(Cl)s1 ZINC000037255801 173067097 /nfs/dbraw/zinc/06/70/97/173067097.db2.gz UXODJSWQGOQEHH-NHYWBVRUSA-N 1 0 297.851 5.108 10 0 CKAERO CC(C)C[C@@H](C)[NH2+][C@H](c1ccco1)c1ccc(Cl)s1 ZINC000037255803 173066783 /nfs/dbraw/zinc/06/67/83/173066783.db2.gz UXODJSWQGOQEHH-IAQYHMDHSA-N 1 0 297.851 5.108 10 0 CKAERO CC(C)C[C@H](C)[NH2+][C@H](c1ccco1)c1ccc(Cl)s1 ZINC000037255804 173067121 /nfs/dbraw/zinc/06/71/21/173067121.db2.gz UXODJSWQGOQEHH-XHDPSFHLSA-N 1 0 297.851 5.108 10 0 CKAERO CC(C)C[C@@H](C)[NH2+][C@@H](Cc1cccs1)c1cccs1 ZINC000037256015 173066895 /nfs/dbraw/zinc/06/68/95/173066895.db2.gz CPKLDACTPFVQHW-HIFRSBDPSA-N 1 0 293.501 5.118 10 0 CKAERO CC(C)C[C@H](C)[NH2+][C@@H](Cc1cccs1)c1cccs1 ZINC000037256017 173066574 /nfs/dbraw/zinc/06/65/74/173066574.db2.gz CPKLDACTPFVQHW-ZFWWWQNUSA-N 1 0 293.501 5.118 10 0 CKAERO CC(C)C[C@@H](C)[NH2+][C@H](Cc1cccs1)c1cccs1 ZINC000037256019 173066941 /nfs/dbraw/zinc/06/69/41/173066941.db2.gz CPKLDACTPFVQHW-UKRRQHHQSA-N 1 0 293.501 5.118 10 0 CKAERO CC(C)C[C@H](C)[NH2+][C@H](Cc1cccs1)c1cccs1 ZINC000037256021 173066588 /nfs/dbraw/zinc/06/65/88/173066588.db2.gz CPKLDACTPFVQHW-DZGCQCFKSA-N 1 0 293.501 5.118 10 0 CKAERO CCC[C@H]([NH2+]CC1CCCCC1)c1ccc(Cl)cc1 ZINC000037259348 173069005 /nfs/dbraw/zinc/06/90/05/173069005.db2.gz RSYMFQLICQQMFA-KRWDZBQOSA-N 1 0 279.855 5.351 10 0 CKAERO CCC[C@@H]([NH2+]CC1CCCCC1)c1ccc(Cl)cc1 ZINC000037259350 173069446 /nfs/dbraw/zinc/06/94/46/173069446.db2.gz RSYMFQLICQQMFA-QGZVFWFLSA-N 1 0 279.855 5.351 10 0 CKAERO CC[C@H]([NH2+][C@@H](C)c1ccco1)c1ccc(Cl)c(Cl)c1 ZINC000037260226 173069986 /nfs/dbraw/zinc/06/99/86/173069986.db2.gz RCSGFPXRWPMXOZ-HZMBPMFUSA-N 1 0 298.213 5.388 10 0 CKAERO CC[C@@H]([NH2+][C@@H](C)c1ccco1)c1ccc(Cl)c(Cl)c1 ZINC000037260228 173070030 /nfs/dbraw/zinc/07/00/30/173070030.db2.gz RCSGFPXRWPMXOZ-IINYFYTJSA-N 1 0 298.213 5.388 10 0 CKAERO CC[C@H]([NH2+][C@H](C)c1ccco1)c1ccc(Cl)c(Cl)c1 ZINC000037260230 173069734 /nfs/dbraw/zinc/06/97/34/173069734.db2.gz RCSGFPXRWPMXOZ-YGRLFVJLSA-N 1 0 298.213 5.388 10 0 CKAERO CC[C@@H]([NH2+][C@H](C)c1ccco1)c1ccc(Cl)c(Cl)c1 ZINC000037260232 173069896 /nfs/dbraw/zinc/06/98/96/173069896.db2.gz RCSGFPXRWPMXOZ-QMTHXVAHSA-N 1 0 298.213 5.388 10 0 CKAERO CC(C)C[C@@H](C)[NH2+][C@@H](C)c1cc(Cl)ccc1Cl ZINC000037261166 173070540 /nfs/dbraw/zinc/07/05/40/173070540.db2.gz CQQNRVSWACRNAU-MNOVXSKESA-N 1 0 274.235 5.079 10 0 CKAERO CC(C)C[C@H](C)[NH2+][C@@H](C)c1cc(Cl)ccc1Cl ZINC000037261168 173070436 /nfs/dbraw/zinc/07/04/36/173070436.db2.gz CQQNRVSWACRNAU-QWRGUYRKSA-N 1 0 274.235 5.079 10 0 CKAERO CC(C)C[C@@H](C)[NH2+][C@H](C)c1cc(Cl)ccc1Cl ZINC000037261171 173070818 /nfs/dbraw/zinc/07/08/18/173070818.db2.gz CQQNRVSWACRNAU-GHMZBOCLSA-N 1 0 274.235 5.079 10 0 CKAERO CC(C)C[C@H](C)[NH2+][C@H](C)c1cc(Cl)ccc1Cl ZINC000037261172 173070412 /nfs/dbraw/zinc/07/04/12/173070412.db2.gz CQQNRVSWACRNAU-WDEREUQCSA-N 1 0 274.235 5.079 10 0 CKAERO CCCCC[C@@H](C)[NH2+][C@@H](CCCC)c1ccccc1 ZINC000037267274 173077898 /nfs/dbraw/zinc/07/78/98/173077898.db2.gz KFNLZJVEOOIYNI-AEFFLSMTSA-N 1 0 261.453 5.476 10 0 CKAERO CCCCC[C@H](C)[NH2+][C@@H](CCCC)c1ccccc1 ZINC000037267276 173077047 /nfs/dbraw/zinc/07/70/47/173077047.db2.gz KFNLZJVEOOIYNI-WMZOPIPTSA-N 1 0 261.453 5.476 10 0 CKAERO CCCCC[C@@H](C)[NH2+][C@H](CCCC)c1ccccc1 ZINC000037267278 173078080 /nfs/dbraw/zinc/07/80/80/173078080.db2.gz KFNLZJVEOOIYNI-SJLPKXTDSA-N 1 0 261.453 5.476 10 0 CKAERO CCCCC[C@H](C)[NH2+][C@H](CCCC)c1ccccc1 ZINC000037267280 173076945 /nfs/dbraw/zinc/07/69/45/173076945.db2.gz KFNLZJVEOOIYNI-FUHWJXTLSA-N 1 0 261.453 5.476 10 0 CKAERO C[C@H]([NH2+][C@@H]1CCCC[C@@H]1C(C)(C)C)C1CCCCC1 ZINC000037271887 173083558 /nfs/dbraw/zinc/08/35/58/173083558.db2.gz CNWFUJRALNGKDY-BHYGNILZSA-N 1 0 265.485 5.150 10 0 CKAERO C[C@@H]([NH2+][C@@H]1CCCC[C@@H]1C(C)(C)C)C1CCCCC1 ZINC000037271889 173083270 /nfs/dbraw/zinc/08/32/70/173083270.db2.gz CNWFUJRALNGKDY-HYVNUMGLSA-N 1 0 265.485 5.150 10 0 CKAERO C[C@H]([NH2+][C@H]1CCCC[C@@H]1C(C)(C)C)C1CCCCC1 ZINC000037271891 173083224 /nfs/dbraw/zinc/08/32/24/173083224.db2.gz CNWFUJRALNGKDY-XIRDDKMYSA-N 1 0 265.485 5.150 10 0 CKAERO C[C@@H]([NH2+][C@H]1CCCC[C@@H]1C(C)(C)C)C1CCCCC1 ZINC000037271894 173083089 /nfs/dbraw/zinc/08/30/89/173083089.db2.gz CNWFUJRALNGKDY-PVAVHDDUSA-N 1 0 265.485 5.150 10 0 CKAERO CCCC[C@@H](C)[NH2+][C@@H](C)c1ccc(CC(C)C)cc1 ZINC000037278002 173087909 /nfs/dbraw/zinc/08/79/09/173087909.db2.gz NDFWRAAMEKHZRA-CVEARBPZSA-N 1 0 261.453 5.114 10 0 CKAERO CCCC[C@H](C)[NH2+][C@@H](C)c1ccc(CC(C)C)cc1 ZINC000037278004 173088064 /nfs/dbraw/zinc/08/80/64/173088064.db2.gz NDFWRAAMEKHZRA-HOTGVXAUSA-N 1 0 261.453 5.114 10 0 CKAERO CCCC[C@@H](C)[NH2+][C@H](C)c1ccc(CC(C)C)cc1 ZINC000037278005 173088465 /nfs/dbraw/zinc/08/84/65/173088465.db2.gz NDFWRAAMEKHZRA-HZPDHXFCSA-N 1 0 261.453 5.114 10 0 CKAERO CCCC[C@H](C)[NH2+][C@H](C)c1ccc(CC(C)C)cc1 ZINC000037278007 173088238 /nfs/dbraw/zinc/08/82/38/173088238.db2.gz NDFWRAAMEKHZRA-JKSUJKDBSA-N 1 0 261.453 5.114 10 0 CKAERO CC[C@H]([NH2+][C@@H](C)C1CCCCC1)c1ccc(Cl)cc1 ZINC000037283037 173090890 /nfs/dbraw/zinc/09/08/90/173090890.db2.gz ZIPFSYXEKKIXKV-GUYCJALGSA-N 1 0 279.855 5.350 10 0 CKAERO CC[C@@H]([NH2+][C@@H](C)C1CCCCC1)c1ccc(Cl)cc1 ZINC000037283038 173090983 /nfs/dbraw/zinc/09/09/83/173090983.db2.gz ZIPFSYXEKKIXKV-SUMWQHHRSA-N 1 0 279.855 5.350 10 0 CKAERO CC[C@H]([NH2+][C@H](C)C1CCCCC1)c1ccc(Cl)cc1 ZINC000037283039 173090633 /nfs/dbraw/zinc/09/06/33/173090633.db2.gz ZIPFSYXEKKIXKV-DYVFJYSZSA-N 1 0 279.855 5.350 10 0 CKAERO CC[C@@H]([NH2+][C@H](C)C1CCCCC1)c1ccc(Cl)cc1 ZINC000037283040 173091262 /nfs/dbraw/zinc/09/12/62/173091262.db2.gz ZIPFSYXEKKIXKV-CXAGYDPISA-N 1 0 279.855 5.350 10 0 CKAERO Cc1cccc([C@@H](C)[NH2+][C@@H](C)c2ccc(Cl)s2)c1 ZINC000037284625 333531151 /nfs/dbraw/zinc/53/11/51/333531151.db2.gz KFRDKTBDGLPVTN-NEPJUHHUSA-N 1 0 279.836 5.122 10 0 CKAERO Cc1cccc([C@H](C)[NH2+][C@@H](C)c2ccc(Cl)s2)c1 ZINC000037284626 333531137 /nfs/dbraw/zinc/53/11/37/333531137.db2.gz KFRDKTBDGLPVTN-RYUDHWBXSA-N 1 0 279.836 5.122 10 0 CKAERO Cc1cccc([C@@H](C)[NH2+][C@H](C)c2ccc(Cl)s2)c1 ZINC000037284627 333531140 /nfs/dbraw/zinc/53/11/40/333531140.db2.gz KFRDKTBDGLPVTN-VXGBXAGGSA-N 1 0 279.836 5.122 10 0 CKAERO Cc1cccc([C@H](C)[NH2+][C@H](C)c2ccc(Cl)s2)c1 ZINC000037284628 333531208 /nfs/dbraw/zinc/53/12/08/333531208.db2.gz KFRDKTBDGLPVTN-NWDGAFQWSA-N 1 0 279.836 5.122 10 0 CKAERO Cc1cccc([C@H](C)[NH2+][C@H](C)c2cc(C)ccc2C)c1 ZINC000037313327 333531771 /nfs/dbraw/zinc/53/17/71/333531771.db2.gz WQFWGURZAPUPJU-DLBZAZTESA-N 1 0 267.416 5.024 10 0 CKAERO CCCc1ccc(-c2ccc([C@H]([NH3+])C(C)C)s2)cc1 ZINC000037335582 173137055 /nfs/dbraw/zinc/13/70/55/173137055.db2.gz GUUJEKNINWLAFI-QGZVFWFLSA-N 1 0 273.445 5.023 10 0 CKAERO CCCc1ccc(-c2ccc([C@@H]([NH3+])C(C)C)s2)cc1 ZINC000037335584 173137032 /nfs/dbraw/zinc/13/70/32/173137032.db2.gz GUUJEKNINWLAFI-KRWDZBQOSA-N 1 0 273.445 5.023 10 0 CKAERO CC(C)c1ccccc1-c1ccc([C@H]([NH3+])C(C)C)s1 ZINC000037335626 173136974 /nfs/dbraw/zinc/13/69/74/173136974.db2.gz WGEKGYRVENMENJ-QGZVFWFLSA-N 1 0 273.445 5.194 10 0 CKAERO CC(C)c1ccccc1-c1ccc([C@@H]([NH3+])C(C)C)s1 ZINC000037335628 173136301 /nfs/dbraw/zinc/13/63/01/173136301.db2.gz WGEKGYRVENMENJ-KRWDZBQOSA-N 1 0 273.445 5.194 10 0 CKAERO CCC[C@H]([NH3+])c1ccc(-c2ccccc2C(C)C)s1 ZINC000037335630 173136243 /nfs/dbraw/zinc/13/62/43/173136243.db2.gz HUHMUDBQRYLGPA-HNNXBMFYSA-N 1 0 273.445 5.338 10 0 CKAERO CCC[C@@H]([NH3+])c1ccc(-c2ccccc2C(C)C)s1 ZINC000037335632 173136337 /nfs/dbraw/zinc/13/63/37/173136337.db2.gz HUHMUDBQRYLGPA-OAHLLOKOSA-N 1 0 273.445 5.338 10 0 CKAERO CC(C)c1ccc(-c2ccc([C@H]([NH3+])C(C)C)s2)cc1 ZINC000037335666 173137104 /nfs/dbraw/zinc/13/71/04/173137104.db2.gz PQBLCTLMLVYPQI-QGZVFWFLSA-N 1 0 273.445 5.194 10 0 CKAERO CC(C)c1ccc(-c2ccc([C@@H]([NH3+])C(C)C)s2)cc1 ZINC000037335668 173136861 /nfs/dbraw/zinc/13/68/61/173136861.db2.gz PQBLCTLMLVYPQI-KRWDZBQOSA-N 1 0 273.445 5.194 10 0 CKAERO [NH3+][C@H](CCC1CCCCC1)c1ccc(Cl)c(Cl)c1 ZINC000037377968 173166207 /nfs/dbraw/zinc/16/62/07/173166207.db2.gz WCJRSHCGIXWAET-OAHLLOKOSA-N 1 0 286.246 5.354 10 0 CKAERO [NH3+][C@@H](CCC1CCCCC1)c1ccc(Cl)c(Cl)c1 ZINC000037377971 173166640 /nfs/dbraw/zinc/16/66/40/173166640.db2.gz 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C[C@@H](Nc1cc[nH+]c2ccccc12)c1ccccc1Cl ZINC000049509563 328366706 /nfs/dbraw/zinc/36/67/06/328366706.db2.gz LWKVXNFXAOMOJX-GFCCVEGCSA-N 1 0 282.774 5.061 10 0 CKAERO C[C@H](Nc1cc[nH+]c2ccccc12)c1ccc(Cl)cc1 ZINC000049526156 328367646 /nfs/dbraw/zinc/36/76/46/328367646.db2.gz HTTLPRQUQNBNCE-LBPRGKRZSA-N 1 0 282.774 5.061 10 0 CKAERO C[C@@H](Nc1cc[nH+]c2ccccc12)c1ccc(Cl)cc1 ZINC000049526157 328367673 /nfs/dbraw/zinc/36/76/73/328367673.db2.gz HTTLPRQUQNBNCE-GFCCVEGCSA-N 1 0 282.774 5.061 10 0 CKAERO CC[C@H]([NH2+][C@@H](C)c1ccc(C)c(C)c1)c1cccs1 ZINC000049529128 328367731 /nfs/dbraw/zinc/36/77/31/328367731.db2.gz PLCFJQAUSYWJLY-HOCLYGCPSA-N 1 0 273.445 5.167 10 0 CKAERO CC[C@@H]([NH2+][C@@H](C)c1ccc(C)c(C)c1)c1cccs1 ZINC000049529129 328367809 /nfs/dbraw/zinc/36/78/09/328367809.db2.gz PLCFJQAUSYWJLY-GOEBONIOSA-N 1 0 273.445 5.167 10 0 CKAERO CC[C@H]([NH2+][C@H](C)c1ccc(C)c(C)c1)c1cccs1 ZINC000049529130 328367843 /nfs/dbraw/zinc/36/78/43/328367843.db2.gz PLCFJQAUSYWJLY-ZBFHGGJFSA-N 1 0 273.445 5.167 10 0 CKAERO CC[C@@H]([NH2+][C@H](C)c1ccc(C)c(C)c1)c1cccs1 ZINC000049529131 328367739 /nfs/dbraw/zinc/36/77/39/328367739.db2.gz PLCFJQAUSYWJLY-GDBMZVCRSA-N 1 0 273.445 5.167 10 0 CKAERO CC[C@H]([NH2+][C@@H](C)c1ccc(F)c(Cl)c1)c1cccs1 ZINC000049529149 328367837 /nfs/dbraw/zinc/36/78/37/328367837.db2.gz ZURCXXCMBXVJDB-HZMBPMFUSA-N 1 0 297.826 5.343 10 0 CKAERO CC[C@@H]([NH2+][C@@H](C)c1ccc(F)c(Cl)c1)c1cccs1 ZINC000049529150 328367649 /nfs/dbraw/zinc/36/76/49/328367649.db2.gz ZURCXXCMBXVJDB-IINYFYTJSA-N 1 0 297.826 5.343 10 0 CKAERO CC[C@H]([NH2+][C@H](C)c1ccc(F)c(Cl)c1)c1cccs1 ZINC000049529151 328367656 /nfs/dbraw/zinc/36/76/56/328367656.db2.gz ZURCXXCMBXVJDB-YGRLFVJLSA-N 1 0 297.826 5.343 10 0 CKAERO CC[C@@H]([NH2+][C@H](C)c1ccc(F)c(Cl)c1)c1cccs1 ZINC000049529152 328367760 /nfs/dbraw/zinc/36/77/60/328367760.db2.gz ZURCXXCMBXVJDB-QMTHXVAHSA-N 1 0 297.826 5.343 10 0 CKAERO CC[C@H]([NH2+][C@@H](C)c1ccc(F)cc1Cl)c1cccs1 ZINC000049529500 328367968 /nfs/dbraw/zinc/36/79/68/328367968.db2.gz IKXZIWBVGGRKPK-HZMBPMFUSA-N 1 0 297.826 5.343 10 0 CKAERO CC[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1Cl)c1cccs1 ZINC000049529501 328368014 /nfs/dbraw/zinc/36/80/14/328368014.db2.gz IKXZIWBVGGRKPK-IINYFYTJSA-N 1 0 297.826 5.343 10 0 CKAERO CC[C@H]([NH2+][C@H](C)c1ccc(F)cc1Cl)c1cccs1 ZINC000049529502 328367932 /nfs/dbraw/zinc/36/79/32/328367932.db2.gz IKXZIWBVGGRKPK-YGRLFVJLSA-N 1 0 297.826 5.343 10 0 CKAERO CC[C@@H]([NH2+][C@H](C)c1ccc(F)cc1Cl)c1cccs1 ZINC000049529503 328368157 /nfs/dbraw/zinc/36/81/57/328368157.db2.gz IKXZIWBVGGRKPK-QMTHXVAHSA-N 1 0 297.826 5.343 10 0 CKAERO CCC[C@H]([NH2+]Cc1ccc(Cl)cc1)c1cccs1 ZINC000049540857 521163681 /nfs/dbraw/zinc/16/36/81/521163681.db2.gz BEVWMDIEYQALPV-AWEZNQCLSA-N 1 0 279.836 5.033 10 0 CKAERO CCC[C@@H]([NH2+]Cc1ccc(Cl)cc1)c1cccs1 ZINC000049540858 520780400 /nfs/dbraw/zinc/78/04/00/520780400.db2.gz BEVWMDIEYQALPV-CQSZACIVSA-N 1 0 279.836 5.033 10 0 CKAERO CCC[C@H]([NH2+][C@@H](C)c1cccs1)c1cccs1 ZINC000049541029 521171231 /nfs/dbraw/zinc/17/12/31/521171231.db2.gz HMDMULBUNDQZQF-RYUDHWBXSA-N 1 0 265.447 5.002 10 0 CKAERO CCC[C@@H]([NH2+][C@@H](C)c1cccs1)c1cccs1 ZINC000049541030 520787867 /nfs/dbraw/zinc/78/78/67/520787867.db2.gz HMDMULBUNDQZQF-NWDGAFQWSA-N 1 0 265.447 5.002 10 0 CKAERO CCC[C@@H]([NH2+][C@H](C)c1cccs1)c1cccs1 ZINC000049541032 520794260 /nfs/dbraw/zinc/79/42/60/520794260.db2.gz HMDMULBUNDQZQF-VXGBXAGGSA-N 1 0 265.447 5.002 10 0 CKAERO CCC[C@H]([NH2+][C@@H](C)c1ccc(C)s1)c1cccs1 ZINC000049541249 521170682 /nfs/dbraw/zinc/17/06/82/521170682.db2.gz QIQISXDUPDCWMM-STQMWFEESA-N 1 0 279.474 5.310 10 0 CKAERO CCC[C@@H]([NH2+][C@@H](C)c1ccc(C)s1)c1cccs1 ZINC000049541250 520788902 /nfs/dbraw/zinc/78/89/02/520788902.db2.gz QIQISXDUPDCWMM-QWHCGFSZSA-N 1 0 279.474 5.310 10 0 CKAERO CCC[C@@H]([NH2+][C@H](C)c1ccc(C)s1)c1cccs1 ZINC000049541252 520791214 /nfs/dbraw/zinc/79/12/14/520791214.db2.gz QIQISXDUPDCWMM-CHWSQXEVSA-N 1 0 279.474 5.310 10 0 CKAERO CCC[C@@H]([NH2+][C@H](CC)c1cccs1)c1cccs1 ZINC000049541332 520793936 /nfs/dbraw/zinc/79/39/36/520793936.db2.gz UQJVMLGIBCBFOD-CHWSQXEVSA-N 1 0 279.474 5.392 10 0 CKAERO CCC[C@H]([NH2+][C@@H](C)c1ccc(Cl)s1)c1cccs1 ZINC000049541459 521169665 /nfs/dbraw/zinc/16/96/65/521169665.db2.gz IHEOUPPLCWUUHG-QWRGUYRKSA-N 1 0 299.892 5.655 10 0 CKAERO CCC[C@@H]([NH2+][C@@H](C)c1ccc(Cl)s1)c1cccs1 ZINC000049541460 520788167 /nfs/dbraw/zinc/78/81/67/520788167.db2.gz IHEOUPPLCWUUHG-WDEREUQCSA-N 1 0 299.892 5.655 10 0 CKAERO CCC[C@@H]([NH2+][C@H](C)c1ccc(Cl)s1)c1cccs1 ZINC000049541462 520794028 /nfs/dbraw/zinc/79/40/28/520794028.db2.gz IHEOUPPLCWUUHG-GHMZBOCLSA-N 1 0 299.892 5.655 10 0 CKAERO Cc1ccccc1[C@@H](C)[NH2+]Cc1csc2ccccc12 ZINC000049943239 328379539 /nfs/dbraw/zinc/37/95/39/328379539.db2.gz YPPIPIZXBKDKIW-CQSZACIVSA-N 1 0 281.424 5.061 10 0 CKAERO Cc1ccccc1[C@H](C)[NH2+]Cc1csc2ccccc12 ZINC000049943240 328379360 /nfs/dbraw/zinc/37/93/60/328379360.db2.gz YPPIPIZXBKDKIW-AWEZNQCLSA-N 1 0 281.424 5.061 10 0 CKAERO CC[C@H]([NH2+]Cc1ccc2ccccc2c1)c1ccccc1 ZINC000050198501 328391506 /nfs/dbraw/zinc/39/15/06/328391506.db2.gz FAUMRGSIXQGDRB-FQEVSTJZSA-N 1 0 275.395 5.081 10 0 CKAERO CC[C@@H]([NH2+]Cc1ccc2ccccc2c1)c1ccccc1 ZINC000050198503 328391470 /nfs/dbraw/zinc/39/14/70/328391470.db2.gz FAUMRGSIXQGDRB-HXUWFJFHSA-N 1 0 275.395 5.081 10 0 CKAERO CCC[C@@H]([NH2+][C@@H](C)c1ccsc1)c1cccs1 ZINC000050344719 520789157 /nfs/dbraw/zinc/78/91/57/520789157.db2.gz LGCXEHOXZGPTRN-WCQYABFASA-N 1 0 265.447 5.002 10 0 CKAERO Cc1cc(F)ccc1C[NH2+][C@H](C)c1ccc(C(C)C)cc1 ZINC000050575484 328444799 /nfs/dbraw/zinc/44/47/99/328444799.db2.gz QDHVRCBBTHEERS-OAHLLOKOSA-N 1 0 285.406 5.108 10 0 CKAERO CC[C@@H]([NH2+][C@@H](CC)c1ccccc1)c1ccc(F)cc1 ZINC000051626416 260953454 /nfs/dbraw/zinc/95/34/54/260953454.db2.gz SYYJJHBFTZBSEG-ZWKOTPCHSA-N 1 0 271.379 5.018 10 0 CKAERO CC[C@@H]([NH2+][C@@H](C)c1ccc(C)c(C)c1)c1ccccc1 ZINC000051626501 328626117 /nfs/dbraw/zinc/62/61/17/328626117.db2.gz GQNOPEYCMZVPCC-QFBILLFUSA-N 1 0 267.416 5.105 10 0 CKAERO CC[C@H]([NH2+][C@@H](C)c1ccc(F)c(Cl)c1)c1ccccc1 ZINC000051626742 328625902 /nfs/dbraw/zinc/62/59/02/328625902.db2.gz ZRVRPBHCPVFGHB-SJCJKPOMSA-N 1 0 291.797 5.281 10 0 CKAERO CC[C@H]([NH2+][C@H](C)c1ccc(F)c(Cl)c1)c1ccccc1 ZINC000051626746 328625933 /nfs/dbraw/zinc/62/59/33/328625933.db2.gz ZRVRPBHCPVFGHB-PXAZEXFGSA-N 1 0 291.797 5.281 10 0 CKAERO CC[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1Cl)c1ccccc1 ZINC000051627009 328626109 /nfs/dbraw/zinc/62/61/09/328626109.db2.gz PQTJVVIKYPLYAA-YVEFUNNKSA-N 1 0 291.797 5.281 10 0 CKAERO CC[C@H]([NH2+][C@H](C)c1ccc(F)cc1Cl)c1ccccc1 ZINC000051627011 328626120 /nfs/dbraw/zinc/62/61/20/328626120.db2.gz PQTJVVIKYPLYAA-PXAZEXFGSA-N 1 0 291.797 5.281 10 0 CKAERO CC[C@@H]([NH2+][C@H](C)c1ccc(F)cc1Cl)c1ccccc1 ZINC000051627013 328625960 /nfs/dbraw/zinc/62/59/60/328625960.db2.gz PQTJVVIKYPLYAA-SJKOYZFVSA-N 1 0 291.797 5.281 10 0 CKAERO CCc1ccc([C@H](C)[NH2+][C@@H](CC)c2ccccc2)s1 ZINC000051627200 328625958 /nfs/dbraw/zinc/62/59/58/328625958.db2.gz DVBKWZLCBRQSBZ-BBRMVZONSA-N 1 0 273.445 5.112 10 0 CKAERO CCc1ccc([C@@H](C)[NH2+][C@H](CC)c2ccccc2)s1 ZINC000051627202 328625972 /nfs/dbraw/zinc/62/59/72/328625972.db2.gz DVBKWZLCBRQSBZ-CZUORRHYSA-N 1 0 273.445 5.112 10 0 CKAERO CC[C@H]([NH2+][C@@H](CC)c1cccc(Cl)c1)c1ccco1 ZINC000054084186 522707028 /nfs/dbraw/zinc/70/70/28/522707028.db2.gz WPNHYEXFAYCVDG-GJZGRUSLSA-N 1 0 277.795 5.125 10 0 CKAERO CC(C)[C@H]1CCCC[C@H]1[NH2+][C@H]1CCCC[C@H]1C(C)C ZINC000057218633 175590112 /nfs/dbraw/zinc/59/01/12/175590112.db2.gz LDFZMJRVNWWMIX-USTZCAOPSA-N 1 0 265.485 5.006 10 0 CKAERO CC(C)[C@H]1CCCC[C@H]1[NH2+][C@H]1CCCC[C@@H]1C(C)C ZINC000057218634 567894623 /nfs/dbraw/zinc/89/46/23/567894623.db2.gz LDFZMJRVNWWMIX-TVFCKZIOSA-N 1 0 265.485 5.006 10 0 CKAERO CC(C)[C@H]1CCCC[C@H]1[NH2+][C@@H]1CCCC[C@H]1C(C)C ZINC000057218635 567894503 /nfs/dbraw/zinc/89/45/03/567894503.db2.gz LDFZMJRVNWWMIX-XMTFNYHQSA-N 1 0 265.485 5.006 10 0 CKAERO CC(C)[C@H]1CCCC[C@H]1[NH2+][C@@H]1CCCC[C@@H]1C(C)C ZINC000057218636 567894655 /nfs/dbraw/zinc/89/46/55/567894655.db2.gz LDFZMJRVNWWMIX-BRSBDYLESA-N 1 0 265.485 5.006 10 0 CKAERO CCC[C@H]([NH2+][C@@H](C)c1ccsc1)c1ccc(Cl)cc1 ZINC000061360907 521169529 /nfs/dbraw/zinc/16/95/29/521169529.db2.gz MNOURISVTFSXJW-LRDDRELGSA-N 1 0 293.863 5.594 10 0 CKAERO CCC[C@@H]([NH2+][C@@H](C)c1ccsc1)c1ccc(Cl)cc1 ZINC000061360908 520788715 /nfs/dbraw/zinc/78/87/15/520788715.db2.gz MNOURISVTFSXJW-BLLLJJGKSA-N 1 0 293.863 5.594 10 0 CKAERO CCC[C@H]([NH2+][C@H](C)c1ccsc1)c1ccc(Cl)cc1 ZINC000061360909 521175285 /nfs/dbraw/zinc/17/52/85/521175285.db2.gz MNOURISVTFSXJW-WBMJQRKESA-N 1 0 293.863 5.594 10 0 CKAERO CCC[C@@H]([NH2+][C@H](C)c1ccsc1)c1ccc(Cl)cc1 ZINC000061360910 520794014 /nfs/dbraw/zinc/79/40/14/520794014.db2.gz MNOURISVTFSXJW-MLGOLLRUSA-N 1 0 293.863 5.594 10 0 CKAERO Cc1ccc(Cl)c(Oc2ccc([C@H](C)[NH3+])cc2Cl)c1 ZINC000061699372 524716486 /nfs/dbraw/zinc/71/64/86/524716486.db2.gz DACLDONBJQCNPY-JTQLQIEISA-N 1 0 296.197 5.114 10 0 CKAERO CCCCC1CCC(C[NH2+]C2CCCCCC2)CC1 ZINC000062435064 519919521 /nfs/dbraw/zinc/91/95/21/519919521.db2.gz FXSBWCNPIALLTD-UHFFFAOYSA-N 1 0 265.485 5.295 10 0 CKAERO CCC(CC)C[NH2+]C1CCCCCCCCCCC1 ZINC000062453432 521532803 /nfs/dbraw/zinc/53/28/03/521532803.db2.gz KHHJZUCKXDHWSN-UHFFFAOYSA-N 1 0 267.501 5.686 10 0 CKAERO CCc1ccc2[nH+]ccc(Nc3ccccc3CC)c2c1 ZINC000065005417 524061061 /nfs/dbraw/zinc/06/10/61/524061061.db2.gz CIOTUHXSMANMGR-UHFFFAOYSA-N 1 0 276.383 5.103 10 0 CKAERO Cc1ccccc1[C@@H](C)[NH2+][C@@H](C)c1cnc2ccsc2c1 ZINC000068690552 333722721 /nfs/dbraw/zinc/72/27/21/333722721.db2.gz KYRPTQVZOLYGFQ-UONOGXRCSA-N 1 0 296.439 5.017 10 0 CKAERO Cc1ccccc1[C@H](C)[NH2+][C@@H](C)c1cnc2ccsc2c1 ZINC000068690553 333722736 /nfs/dbraw/zinc/72/27/36/333722736.db2.gz KYRPTQVZOLYGFQ-KBPBESRZSA-N 1 0 296.439 5.017 10 0 CKAERO Cc1ccccc1[C@@H](C)[NH2+][C@H](C)c1cnc2ccsc2c1 ZINC000068690554 333722837 /nfs/dbraw/zinc/72/28/37/333722837.db2.gz KYRPTQVZOLYGFQ-ZIAGYGMSSA-N 1 0 296.439 5.017 10 0 CKAERO Cc1ccccc1[C@H](C)[NH2+][C@H](C)c1cnc2ccsc2c1 ZINC000068690555 333722673 /nfs/dbraw/zinc/72/26/73/333722673.db2.gz KYRPTQVZOLYGFQ-KGLIPLIRSA-N 1 0 296.439 5.017 10 0 CKAERO [NH3+][C@]1(CC2CCCC2)CCCC[C@H]1C1CCCCC1 ZINC000070071249 527422483 /nfs/dbraw/zinc/42/24/83/527422483.db2.gz KISNOKWIVAGOLM-ROUUACIJSA-N 1 0 263.469 5.035 10 0 CKAERO Cc1ccsc1[C@@H](C)[NH2+][C@@H](C)c1ccc(Cl)cc1 ZINC000070089854 328382963 /nfs/dbraw/zinc/38/29/63/328382963.db2.gz GJYLAGQDOPAHAL-NWDGAFQWSA-N 1 0 279.836 5.122 10 0 CKAERO Cc1ccsc1[C@H](C)[NH2+][C@@H](C)c1ccc(Cl)cc1 ZINC000070089855 328382952 /nfs/dbraw/zinc/38/29/52/328382952.db2.gz GJYLAGQDOPAHAL-RYUDHWBXSA-N 1 0 279.836 5.122 10 0 CKAERO Cc1ccsc1[C@@H](C)[NH2+][C@H](C)c1ccc(Cl)cc1 ZINC000070089856 328382989 /nfs/dbraw/zinc/38/29/89/328382989.db2.gz GJYLAGQDOPAHAL-VXGBXAGGSA-N 1 0 279.836 5.122 10 0 CKAERO Cc1ccsc1[C@H](C)[NH2+][C@H](C)c1ccc(Cl)cc1 ZINC000070089857 328382929 /nfs/dbraw/zinc/38/29/29/328382929.db2.gz GJYLAGQDOPAHAL-NEPJUHHUSA-N 1 0 279.836 5.122 10 0 CKAERO Cc1ccsc1[C@H](C)[NH2+][C@H](C)c1ccc(Cl)s1 ZINC000070090736 333798819 /nfs/dbraw/zinc/79/88/19/333798819.db2.gz IVPKNYDXIZNQCM-ZJUUUORDSA-N 1 0 285.865 5.183 10 0 CKAERO Cc1ccsc1[C@H](C)[NH2+][C@H](C)c1ccc(C)cc1C ZINC000070091618 328386772 /nfs/dbraw/zinc/38/67/72/328386772.db2.gz QWXVWEPELBNPCE-CABCVRRESA-N 1 0 273.445 5.085 10 0 CKAERO Cc1ccsc1[C@H](C)[NH2+][C@@H](C)c1ccc(C)cc1C ZINC000070091619 328386790 /nfs/dbraw/zinc/38/67/90/328386790.db2.gz QWXVWEPELBNPCE-GJZGRUSLSA-N 1 0 273.445 5.085 10 0 CKAERO Cc1ccsc1[C@@H](C)[NH2+][C@H](C)c1ccc(C)cc1C ZINC000070091620 328386818 /nfs/dbraw/zinc/38/68/18/328386818.db2.gz QWXVWEPELBNPCE-HUUCEWRRSA-N 1 0 273.445 5.085 10 0 CKAERO Cc1ccsc1[C@@H](C)[NH2+][C@@H](C)c1ccc(C)cc1C ZINC000070091621 328386840 /nfs/dbraw/zinc/38/68/40/328386840.db2.gz QWXVWEPELBNPCE-LSDHHAIUSA-N 1 0 273.445 5.085 10 0 CKAERO Fc1ccc(C[NH2+]C2CCCCCCCCCCC2)cc1 ZINC000070137369 526337978 /nfs/dbraw/zinc/33/79/78/526337978.db2.gz VMIVLJFDELYBIA-UHFFFAOYSA-N 1 0 291.454 5.589 10 0 CKAERO C[C@@H]1CCCC[C@@H]1[NH2+]Cc1sc2ccccc2c1Cl ZINC000070137386 524144045 /nfs/dbraw/zinc/14/40/45/524144045.db2.gz VZNAMLISLDAFLB-YPMHNXCESA-N 1 0 293.863 5.223 10 0 CKAERO C[C@H]1CCCC[C@H]1[NH2+]Cc1sc2ccccc2c1Cl ZINC000070137389 526262317 /nfs/dbraw/zinc/26/23/17/526262317.db2.gz VZNAMLISLDAFLB-WCQYABFASA-N 1 0 293.863 5.223 10 0 CKAERO Cc1ccc(C[NH2+]C2CCCCCCCCCCC2)cc1 ZINC000070137403 524572145 /nfs/dbraw/zinc/57/21/45/524572145.db2.gz RDQBTDQLVXCSCW-UHFFFAOYSA-N 1 0 287.491 5.758 10 0 CKAERO CCCC[C@](CC)(CCC(C)C)C[NH2+]C(C)(C)C ZINC000070533255 175974836 /nfs/dbraw/zinc/97/48/36/175974836.db2.gz VLZIDLRUSPICJV-QGZVFWFLSA-N 1 0 255.490 5.397 10 0 CKAERO CC(C)c1ccc(C[NH2+]CCC2CCC(C)CC2)cc1 ZINC000070547635 567888962 /nfs/dbraw/zinc/88/89/62/567888962.db2.gz WAIJVLBRRGLFGV-UHFFFAOYSA-N 1 0 273.464 5.116 10 0 CKAERO CCCCC[C@H]([NH2+]CC)c1cccc2ccccc21 ZINC000070941514 176015149 /nfs/dbraw/zinc/01/51/49/176015149.db2.gz GDRYZIAUSKGKIO-SFHVURJKSA-N 1 0 255.405 5.071 10 0 CKAERO CCCCC[C@@H]([NH2+]CC)c1cccc2ccccc21 ZINC000070941515 176015226 /nfs/dbraw/zinc/01/52/26/176015226.db2.gz GDRYZIAUSKGKIO-GOSISDBHSA-N 1 0 255.405 5.071 10 0 CKAERO CCCC[C@H]([NH2+]CCC)c1cccc2ccccc21 ZINC000070941524 176015457 /nfs/dbraw/zinc/01/54/57/176015457.db2.gz IFPLZDDMFZTMHD-SFHVURJKSA-N 1 0 255.405 5.071 10 0 CKAERO CCCC[C@@H]([NH2+]CCC)c1cccc2ccccc21 ZINC000070941525 176015288 /nfs/dbraw/zinc/01/52/88/176015288.db2.gz IFPLZDDMFZTMHD-GOSISDBHSA-N 1 0 255.405 5.071 10 0 CKAERO C[NH2+][C@@H](C)c1ccc(Oc2ccc(Cl)c(Cl)c2)cc1 ZINC000071651056 176241297 /nfs/dbraw/zinc/24/12/97/176241297.db2.gz VVWGSWXAHKPQSZ-JTQLQIEISA-N 1 0 296.197 5.066 10 0 CKAERO C[NH2+][C@H](C)c1ccc(Oc2ccc(Cl)c(Cl)c2)cc1 ZINC000071651057 176241296 /nfs/dbraw/zinc/24/12/96/176241296.db2.gz VVWGSWXAHKPQSZ-SNVBAGLBSA-N 1 0 296.197 5.066 10 0 CKAERO CC(C)C[NH2+]Cc1oc2c(cccc2Cl)c1C(C)(C)C ZINC000077068933 177183994 /nfs/dbraw/zinc/18/39/94/177183994.db2.gz HPXLZCVKRQMUPQ-UHFFFAOYSA-N 1 0 293.838 5.129 10 0 CKAERO CC(C)C[NH2+]Cc1oc2ccc(Cl)cc2c1C(C)(C)C ZINC000077069698 177184868 /nfs/dbraw/zinc/18/48/68/177184868.db2.gz GBTIQRVVHKVFBE-UHFFFAOYSA-N 1 0 293.838 5.129 10 0 CKAERO CCc1ccc([C@H]([NH3+])c2oc3ccc(Cl)cc3c2C)cc1 ZINC000077069819 177184842 /nfs/dbraw/zinc/18/48/42/177184842.db2.gz RMPQRUILGBUZGV-KRWDZBQOSA-N 1 0 299.801 5.005 10 0 CKAERO CCc1ccc([C@@H]([NH3+])c2oc3ccc(Cl)cc3c2C)cc1 ZINC000077069820 177184937 /nfs/dbraw/zinc/18/49/37/177184937.db2.gz RMPQRUILGBUZGV-QGZVFWFLSA-N 1 0 299.801 5.005 10 0 CKAERO Cc1c2cc(Cl)ccc2oc1[C@@H]([NH3+])c1ccc(C)cc1C ZINC000077069821 177184710 /nfs/dbraw/zinc/18/47/10/177184710.db2.gz VYKLGFCCOQKAEC-KRWDZBQOSA-N 1 0 299.801 5.060 10 0 CKAERO Cc1c2cc(Cl)ccc2oc1[C@H]([NH3+])c1ccc(C)cc1C ZINC000077069822 177184733 /nfs/dbraw/zinc/18/47/33/177184733.db2.gz VYKLGFCCOQKAEC-QGZVFWFLSA-N 1 0 299.801 5.060 10 0 CKAERO Cc1c2cc(Cl)ccc2oc1[C@@H]([NH3+])c1ccc(C)c(C)c1 ZINC000077069823 177184657 /nfs/dbraw/zinc/18/46/57/177184657.db2.gz UDXNHZGXTZNVQW-KRWDZBQOSA-N 1 0 299.801 5.060 10 0 CKAERO Cc1c2cc(Cl)ccc2oc1[C@H]([NH3+])c1ccc(C)c(C)c1 ZINC000077069824 177185073 /nfs/dbraw/zinc/18/50/73/177185073.db2.gz UDXNHZGXTZNVQW-QGZVFWFLSA-N 1 0 299.801 5.060 10 0 CKAERO Cc1c2cc(Cl)ccc2oc1[C@@H]([NH3+])c1cc(C)ccc1C ZINC000077069825 177184675 /nfs/dbraw/zinc/18/46/75/177184675.db2.gz MYZRFWXAZJDSTK-KRWDZBQOSA-N 1 0 299.801 5.060 10 0 CKAERO Cc1c2cc(Cl)ccc2oc1[C@H]([NH3+])c1cc(C)ccc1C ZINC000077069826 177185029 /nfs/dbraw/zinc/18/50/29/177185029.db2.gz MYZRFWXAZJDSTK-QGZVFWFLSA-N 1 0 299.801 5.060 10 0 CKAERO Cc1ccc2c(oc(C[NH2+]CC(C)C)c2C(C)(C)C)c1C ZINC000077070237 177185336 /nfs/dbraw/zinc/18/53/36/177185336.db2.gz UHTGEJLTTNFQNY-UHFFFAOYSA-N 1 0 287.447 5.093 10 0 CKAERO CCc1ccc2oc(C[NH2+]CC(C)C)c(C(C)(C)C)c2c1 ZINC000077070683 177185894 /nfs/dbraw/zinc/18/58/94/177185894.db2.gz HRXMRSSQRZWKAR-UHFFFAOYSA-N 1 0 287.447 5.038 10 0 CKAERO Cc1cc2c(oc(C[NH2+]CC(C)C)c2C(C)(C)C)c(C)c1 ZINC000077071041 177186421 /nfs/dbraw/zinc/18/64/21/177186421.db2.gz IYUXJNJKNXSWCH-UHFFFAOYSA-N 1 0 287.447 5.093 10 0 CKAERO Cc1cc2oc(C[NH2+]CC(C)C)c(C(C)(C)C)c2c(C)c1 ZINC000077071415 177186863 /nfs/dbraw/zinc/18/68/63/177186863.db2.gz HIONGHCZKLBAOR-UHFFFAOYSA-N 1 0 287.447 5.093 10 0 CKAERO CCc1c(C[NH2+]CC(C)C)oc2cc(C)c(Cl)c(C)c21 ZINC000077071560 177187574 /nfs/dbraw/zinc/18/75/74/177187574.db2.gz GGMBJRKZJYGHRW-UHFFFAOYSA-N 1 0 293.838 5.011 10 0 CKAERO Cc1cc2oc(C[NH2+]C(C)C)c(C(C)C)c2c(C)c1Cl ZINC000077071588 177187810 /nfs/dbraw/zinc/18/78/10/177187810.db2.gz MIWFVRQYSYPBCL-UHFFFAOYSA-N 1 0 293.838 5.324 10 0 CKAERO CCC[NH2+]Cc1oc2cc(C)c(Cl)c(C)c2c1C(C)C ZINC000077071589 177187854 /nfs/dbraw/zinc/18/78/54/177187854.db2.gz MSJPLBXIKMZBJS-UHFFFAOYSA-N 1 0 293.838 5.326 10 0 CKAERO Cc1cc2oc(C[NH2+]C3CC3)c(C(C)C)c2c(C)c1Cl ZINC000077071590 177187657 /nfs/dbraw/zinc/18/76/57/177187657.db2.gz MFJVFQMRZIBWTP-UHFFFAOYSA-N 1 0 291.822 5.078 10 0 CKAERO CCCc1c(C[NH2+]C(C)C)oc2cc(C)c(Cl)c(C)c21 ZINC000077071614 177187691 /nfs/dbraw/zinc/18/76/91/177187691.db2.gz XGXSVLCXJBCAKA-UHFFFAOYSA-N 1 0 293.838 5.154 10 0 CKAERO CCC[NH2+]Cc1oc2cc(C)c(Cl)c(C)c2c1CCC ZINC000077071615 177187623 /nfs/dbraw/zinc/18/76/23/177187623.db2.gz OLTQDNIJHVUKNA-UHFFFAOYSA-N 1 0 293.838 5.155 10 0 CKAERO Cc1cc2oc(C[NH2+]C(C)C)c(C3CC3)c2c(C)c1Cl ZINC000077071639 177187492 /nfs/dbraw/zinc/18/74/92/177187492.db2.gz UJLUVTQNYGRYCY-UHFFFAOYSA-N 1 0 291.822 5.078 10 0 CKAERO CCC[NH2+]Cc1oc2cc(C)c(Cl)c(C)c2c1C1CC1 ZINC000077071640 177187429 /nfs/dbraw/zinc/18/74/29/177187429.db2.gz JJWNYVNGBVCDQI-UHFFFAOYSA-N 1 0 291.822 5.080 10 0 CKAERO CC[NH2+]Cc1oc2cc(C)c(Cl)c(C)c2c1C(C)(C)C ZINC000077071664 177187591 /nfs/dbraw/zinc/18/75/91/177187591.db2.gz OKRVATWCRSBMGE-UHFFFAOYSA-N 1 0 293.838 5.110 10 0 CKAERO CC(C)[NH2+]Cc1oc2c(cc(Cl)cc2Cl)c1C1CC1 ZINC000077071758 177187733 /nfs/dbraw/zinc/18/77/33/177187733.db2.gz JJFRWQKRVZKAPB-UHFFFAOYSA-N 1 0 298.213 5.115 10 0 CKAERO CCC[NH2+]Cc1oc2c(cc(Cl)cc2Cl)c1C1CC1 ZINC000077071759 177187699 /nfs/dbraw/zinc/18/76/99/177187699.db2.gz NDAHMNOPUIMYGK-UHFFFAOYSA-N 1 0 298.213 5.117 10 0 CKAERO CC(C)c1c2cc(Cl)cc(Cl)c2oc1C[NH2+]C1CC1 ZINC000077071802 177188089 /nfs/dbraw/zinc/18/80/89/177188089.db2.gz JJDAUPVMAGGNCZ-UHFFFAOYSA-N 1 0 298.213 5.115 10 0 CKAERO CC(C)[NH2+]Cc1oc2c(ccc3ccccc23)c1C(C)C ZINC000077072165 177188437 /nfs/dbraw/zinc/18/84/37/177188437.db2.gz UEVCPEGRPXRDFO-UHFFFAOYSA-N 1 0 281.399 5.207 10 0 CKAERO CCC[NH2+]Cc1oc2c(ccc3ccccc23)c1C(C)C ZINC000077072166 177188534 /nfs/dbraw/zinc/18/85/34/177188534.db2.gz PCXKSUGMZVBBET-UHFFFAOYSA-N 1 0 281.399 5.209 10 0 CKAERO CCCc1c2ccc3ccccc3c2oc1C[NH2+]C(C)C ZINC000077072200 177188569 /nfs/dbraw/zinc/18/85/69/177188569.db2.gz NFQQBRUJRNTHOO-UHFFFAOYSA-N 1 0 281.399 5.037 10 0 CKAERO CCC[NH2+]Cc1oc2c(ccc3ccccc23)c1CCC ZINC000077072201 177188367 /nfs/dbraw/zinc/18/83/67/177188367.db2.gz LBRTULIBUXOFGS-UHFFFAOYSA-N 1 0 281.399 5.038 10 0 CKAERO CC[C@H]([NH3+])c1ccc(-c2ccc(C(C)(C)C)cc2)cc1 ZINC000082708168 178217166 /nfs/dbraw/zinc/21/71/66/178217166.db2.gz DIVRLHPQMNXBBS-SFHVURJKSA-N 1 0 267.416 5.061 10 0 CKAERO CC[C@@H]([NH3+])c1ccc(-c2ccc(C(C)(C)C)cc2)cc1 ZINC000082708169 178217182 /nfs/dbraw/zinc/21/71/82/178217182.db2.gz DIVRLHPQMNXBBS-GOSISDBHSA-N 1 0 267.416 5.061 10 0 CKAERO CC[C@H]([NH3+])c1ccc(-c2cc(Cl)cc(Cl)c2)cc1 ZINC000082708410 178217792 /nfs/dbraw/zinc/21/77/92/178217792.db2.gz UJADBMCPDRMBBR-HNNXBMFYSA-N 1 0 280.198 5.070 10 0 CKAERO CC[C@@H]([NH3+])c1ccc(-c2cc(Cl)cc(Cl)c2)cc1 ZINC000082708411 178217668 /nfs/dbraw/zinc/21/76/68/178217668.db2.gz UJADBMCPDRMBBR-OAHLLOKOSA-N 1 0 280.198 5.070 10 0 CKAERO CC[C@H]([NH3+])c1ccc(-c2ccc(Cl)c(Cl)c2)cc1 ZINC000082708442 178217585 /nfs/dbraw/zinc/21/75/85/178217585.db2.gz HRFMNQNJDCCSJP-HNNXBMFYSA-N 1 0 280.198 5.070 10 0 CKAERO CC[C@@H]([NH3+])c1ccc(-c2ccc(Cl)c(Cl)c2)cc1 ZINC000082708443 178217567 /nfs/dbraw/zinc/21/75/67/178217567.db2.gz HRFMNQNJDCCSJP-OAHLLOKOSA-N 1 0 280.198 5.070 10 0 CKAERO CC[C@H]([NH2+]C)c1ccc(-c2ccc(C(C)(C)C)cc2)cc1 ZINC000082710481 178222456 /nfs/dbraw/zinc/22/24/56/178222456.db2.gz WKARIXLSILKSIX-IBGZPJMESA-N 1 0 281.443 5.322 10 0 CKAERO CC[C@@H]([NH2+]C)c1ccc(-c2ccc(C(C)(C)C)cc2)cc1 ZINC000082710482 178222505 /nfs/dbraw/zinc/22/25/05/178222505.db2.gz WKARIXLSILKSIX-LJQANCHMSA-N 1 0 281.443 5.322 10 0 CKAERO C[NH2+][C@@H](C)c1ccc(F)c(-c2ccc(C(C)(C)C)cc2)c1 ZINC000082710483 178222234 /nfs/dbraw/zinc/22/22/34/178222234.db2.gz LEQWFKUTKBMTEN-ZDUSSCGKSA-N 1 0 285.406 5.071 10 0 CKAERO C[NH2+][C@H](C)c1ccc(F)c(-c2ccc(C(C)(C)C)cc2)c1 ZINC000082710484 178222324 /nfs/dbraw/zinc/22/23/24/178222324.db2.gz LEQWFKUTKBMTEN-CYBMUJFWSA-N 1 0 285.406 5.071 10 0 CKAERO CC[C@H]([NH2+]C)c1ccc(-c2ccccc2C(F)(F)F)cc1 ZINC000082710633 178223063 /nfs/dbraw/zinc/22/30/63/178223063.db2.gz QSOPSAJLQCYFQB-INIZCTEOSA-N 1 0 293.332 5.043 10 0 CKAERO CC[C@@H]([NH2+]C)c1ccc(-c2ccccc2C(F)(F)F)cc1 ZINC000082710634 178222969 /nfs/dbraw/zinc/22/29/69/178222969.db2.gz QSOPSAJLQCYFQB-MRXNPFEDSA-N 1 0 293.332 5.043 10 0 CKAERO CC[C@H]([NH2+]C)c1ccc(-c2cccc(C(F)(F)F)c2)cc1 ZINC000082710643 178223017 /nfs/dbraw/zinc/22/30/17/178223017.db2.gz XBMCVXOBAOQQMN-INIZCTEOSA-N 1 0 293.332 5.043 10 0 CKAERO CC[C@@H]([NH2+]C)c1ccc(-c2cccc(C(F)(F)F)c2)cc1 ZINC000082710644 178223169 /nfs/dbraw/zinc/22/31/69/178223169.db2.gz XBMCVXOBAOQQMN-MRXNPFEDSA-N 1 0 293.332 5.043 10 0 CKAERO CC[C@H]([NH2+]C)c1ccc(-c2cc(Cl)cc(Cl)c2)cc1 ZINC000082710657 178222765 /nfs/dbraw/zinc/22/27/65/178222765.db2.gz QTZNHHVRUQAQNT-INIZCTEOSA-N 1 0 294.225 5.331 10 0 CKAERO CC[C@@H]([NH2+]C)c1ccc(-c2cc(Cl)cc(Cl)c2)cc1 ZINC000082710658 178222758 /nfs/dbraw/zinc/22/27/58/178222758.db2.gz QTZNHHVRUQAQNT-MRXNPFEDSA-N 1 0 294.225 5.331 10 0 CKAERO C[NH2+][C@@H](C)c1ccc(F)c(-c2cc(Cl)cc(Cl)c2)c1 ZINC000082710659 178223212 /nfs/dbraw/zinc/22/32/12/178223212.db2.gz OFJVGHJIXKYZAI-VIFPVBQESA-N 1 0 298.188 5.080 10 0 CKAERO C[NH2+][C@H](C)c1ccc(F)c(-c2cc(Cl)cc(Cl)c2)c1 ZINC000082710660 178222956 /nfs/dbraw/zinc/22/29/56/178222956.db2.gz OFJVGHJIXKYZAI-SECBINFHSA-N 1 0 298.188 5.080 10 0 CKAERO CC[C@H]([NH2+]C)c1ccc(-c2cccc(Cl)c2Cl)cc1 ZINC000082710665 178223149 /nfs/dbraw/zinc/22/31/49/178223149.db2.gz JQEFEUBUWXHGMN-HNNXBMFYSA-N 1 0 294.225 5.331 10 0 CKAERO CC[C@@H]([NH2+]C)c1ccc(-c2cccc(Cl)c2Cl)cc1 ZINC000082710666 178223031 /nfs/dbraw/zinc/22/30/31/178223031.db2.gz JQEFEUBUWXHGMN-OAHLLOKOSA-N 1 0 294.225 5.331 10 0 CKAERO C[NH2+][C@@H](C)c1ccc(F)c(-c2cccc(Cl)c2Cl)c1 ZINC000082710667 178223012 /nfs/dbraw/zinc/22/30/12/178223012.db2.gz PZKJDAZFGZCEQS-VIFPVBQESA-N 1 0 298.188 5.080 10 0 CKAERO C[NH2+][C@H](C)c1ccc(F)c(-c2cccc(Cl)c2Cl)c1 ZINC000082710668 178222986 /nfs/dbraw/zinc/22/29/86/178222986.db2.gz PZKJDAZFGZCEQS-SECBINFHSA-N 1 0 298.188 5.080 10 0 CKAERO CC[C@H]([NH2+]C)c1ccc(-c2ccc(Cl)c(Cl)c2)cc1 ZINC000082710677 178223217 /nfs/dbraw/zinc/22/32/17/178223217.db2.gz TUCMKSWZPPCPCW-INIZCTEOSA-N 1 0 294.225 5.331 10 0 CKAERO CC[C@@H]([NH2+]C)c1ccc(-c2ccc(Cl)c(Cl)c2)cc1 ZINC000082710678 178222857 /nfs/dbraw/zinc/22/28/57/178222857.db2.gz TUCMKSWZPPCPCW-MRXNPFEDSA-N 1 0 294.225 5.331 10 0 CKAERO C[NH2+][C@@H](C)c1ccc(F)c(-c2ccc(Cl)c(Cl)c2)c1 ZINC000082710679 178222820 /nfs/dbraw/zinc/22/28/20/178222820.db2.gz FDXQDLFDXGKTEI-VIFPVBQESA-N 1 0 298.188 5.080 10 0 CKAERO C[NH2+][C@H](C)c1ccc(F)c(-c2ccc(Cl)c(Cl)c2)c1 ZINC000082710680 178222811 /nfs/dbraw/zinc/22/28/11/178222811.db2.gz FDXQDLFDXGKTEI-SECBINFHSA-N 1 0 298.188 5.080 10 0 CKAERO CC(C)(C)CC[NH2+]C1CCCCCCCCCCC1 ZINC000083495824 178525585 /nfs/dbraw/zinc/52/55/85/178525585.db2.gz BKHIGMMEABTWGJ-UHFFFAOYSA-N 1 0 267.501 5.686 10 0 CKAERO CC(C)[NH2+]CCCCc1ccc(C2CCCCC2)cc1 ZINC000087730179 179479167 /nfs/dbraw/zinc/47/91/67/179479167.db2.gz VQUNGJVKZNLQDI-UHFFFAOYSA-N 1 0 273.464 5.055 10 0 CKAERO C[C@H]([NH2+][C@@H](C)c1cc(F)cc(F)c1)c1ccc(Cl)cc1 ZINC000094826159 265259910 /nfs/dbraw/zinc/25/99/10/265259910.db2.gz BNLJQZMOBDDWSV-QWRGUYRKSA-N 1 0 295.760 5.030 10 0 CKAERO C[C@@H]([NH2+][C@@H](C)c1cc(F)cc(F)c1)c1ccc(Cl)cc1 ZINC000094826160 265260259 /nfs/dbraw/zinc/26/02/59/265260259.db2.gz BNLJQZMOBDDWSV-MNOVXSKESA-N 1 0 295.760 5.030 10 0 CKAERO C[C@@H]([NH2+][C@@H](C)c1ccc(Cl)cc1)c1cc(F)cc(F)c1 ZINC000094826161 265259444 /nfs/dbraw/zinc/25/94/44/265259444.db2.gz BNLJQZMOBDDWSV-WDEREUQCSA-N 1 0 295.760 5.030 10 0 CKAERO C[C@@H]([NH2+][C@H](C)c1cc(F)cc(F)c1)c1ccc(Cl)cc1 ZINC000094826162 265259479 /nfs/dbraw/zinc/25/94/79/265259479.db2.gz BNLJQZMOBDDWSV-GHMZBOCLSA-N 1 0 295.760 5.030 10 0 CKAERO C[C@H]([NH2+][C@@H](C)c1cc(F)cc(F)c1)c1cccc(Cl)c1 ZINC000094826185 265259429 /nfs/dbraw/zinc/25/94/29/265259429.db2.gz UCEGITMCWLYXDB-QWRGUYRKSA-N 1 0 295.760 5.030 10 0 CKAERO C[C@@H]([NH2+][C@@H](C)c1cccc(Cl)c1)c1cc(F)cc(F)c1 ZINC000094826187 265260109 /nfs/dbraw/zinc/26/01/09/265260109.db2.gz UCEGITMCWLYXDB-WDEREUQCSA-N 1 0 295.760 5.030 10 0 CKAERO CCCCOc1ccc2c3c(cccc31)C(C)=[N+]2CCCC ZINC000096118913 185102124 /nfs/dbraw/zinc/10/21/24/185102124.db2.gz HVZWVKCKVMKUIK-UHFFFAOYSA-N 1 0 296.434 5.285 10 0 CKAERO C[C@H](c1cccc2ccccc21)[N@H+](C)Cc1ccccc1 ZINC000096929788 185132264 /nfs/dbraw/zinc/13/22/64/185132264.db2.gz LFWXWAVDSWFXHT-MRXNPFEDSA-N 1 0 275.395 5.033 10 0 CKAERO CC(C)(C)CC[C@](C)([NH3+])c1cc(F)c(Cl)cc1Cl ZINC000103929323 185863069 /nfs/dbraw/zinc/86/30/69/185863069.db2.gz FOGPFMUORCJZAJ-AWEZNQCLSA-N 1 0 292.225 5.133 10 0 CKAERO CCC[NH2+][C@H](CCC(C)(C)C)C1CCC(C)CC1 ZINC000103929774 185862887 /nfs/dbraw/zinc/86/28/87/185862887.db2.gz XFJAEGMBGWJKGR-UYSNPLJNSA-N 1 0 253.474 5.007 10 0 CKAERO CCC[NH2+][C@H](C)c1oc2c(ccc(Cl)c2Cl)c1C ZINC000103930232 185863171 /nfs/dbraw/zinc/86/31/71/185863171.db2.gz SUMULFPVUKNNJF-SECBINFHSA-N 1 0 286.202 5.109 10 0 CKAERO CCC(C)(C)C1CCC([NH3+])(Cc2ccc(Cl)s2)CC1 ZINC000103930652 185863237 /nfs/dbraw/zinc/86/32/37/185863237.db2.gz HMHVRMJRSYGXCM-UHFFFAOYSA-N 1 0 299.911 5.268 10 0 CKAERO CCC[NH2+][C@@H](C)c1oc2c(c1C)c(Cl)ccc2Cl ZINC000103931665 185864061 /nfs/dbraw/zinc/86/40/61/185864061.db2.gz KTASCAOKOORWRQ-VIFPVBQESA-N 1 0 286.202 5.109 10 0 CKAERO CCCC[C@@H](CC)CC[C@H]([NH2+]CCC)C(C)(C)C ZINC000103931730 185864430 /nfs/dbraw/zinc/86/44/30/185864430.db2.gz UPIUATBKFHIRPB-CVEARBPZSA-N 1 0 255.490 5.397 10 0 CKAERO CCCC[C@H](CC)CC[C@H]([NH2+]CCC)C(C)(C)C ZINC000103931733 185864400 /nfs/dbraw/zinc/86/44/00/185864400.db2.gz UPIUATBKFHIRPB-HOTGVXAUSA-N 1 0 255.490 5.397 10 0 CKAERO CCCC[C@H](CC)CC[C@@H]([NH2+]CCC)C(C)(C)C ZINC000103931739 185863734 /nfs/dbraw/zinc/86/37/34/185863734.db2.gz UPIUATBKFHIRPB-JKSUJKDBSA-N 1 0 255.490 5.397 10 0 CKAERO CCCCC[C@@H]([NH2+]CCC)c1ccc(Cl)cc1F ZINC000103932628 185864358 /nfs/dbraw/zinc/86/43/58/185864358.db2.gz FXPMNHDLAAVLER-OAHLLOKOSA-N 1 0 271.807 5.100 10 0 CKAERO CC[NH2+][C@H](CC)c1ccc(-c2ccc(Cl)cc2Cl)o1 ZINC000103933201 185864394 /nfs/dbraw/zinc/86/43/94/185864394.db2.gz IDJUHNWRHHPXSA-CYBMUJFWSA-N 1 0 298.213 5.314 10 0 CKAERO CCCC[C@H](CC)C[C@@H]([NH2+]C)c1ccc(Cl)cc1 ZINC000103933843 185863805 /nfs/dbraw/zinc/86/38/05/185863805.db2.gz BXTZXDUVDIVGHB-XJKSGUPXSA-N 1 0 267.844 5.207 10 0 CKAERO CC[NH2+][C@@H](CC1CCCCC1)c1ccc(F)c(Cl)c1 ZINC000103934138 185864409 /nfs/dbraw/zinc/86/44/09/185864409.db2.gz JSGLPGVDUBRRGO-INIZCTEOSA-N 1 0 283.818 5.100 10 0 CKAERO CCCCCC[C@H]([NH2+]CCC)c1ccc(Cl)cc1 ZINC000103936370 185864979 /nfs/dbraw/zinc/86/49/79/185864979.db2.gz DPWGQUZMMHGRHK-INIZCTEOSA-N 1 0 267.844 5.351 10 0 CKAERO CCC[NH2+][C@@H](C[C@H](C)CCC)c1ccc(CC)cc1 ZINC000103936412 185864505 /nfs/dbraw/zinc/86/45/05/185864505.db2.gz VTCWOHWYCAKKRH-QAPCUYQASA-N 1 0 261.453 5.116 10 0 CKAERO CCC[NH2+][C@@H](C[C@@H](C)CCC)c1ccc(CC)cc1 ZINC000103936415 185864921 /nfs/dbraw/zinc/86/49/21/185864921.db2.gz VTCWOHWYCAKKRH-YJBOKZPZSA-N 1 0 261.453 5.116 10 0 CKAERO CCC[NH2+][C@H](C[C@H](C)CCC)c1ccc(CC)cc1 ZINC000103936418 185865119 /nfs/dbraw/zinc/86/51/19/185865119.db2.gz VTCWOHWYCAKKRH-CRAIPNDOSA-N 1 0 261.453 5.116 10 0 CKAERO CCC[NH2+][C@H](CC1CCCCC1)c1ccccc1Cl ZINC000103939616 185864827 /nfs/dbraw/zinc/86/48/27/185864827.db2.gz LDDCRBWHJOADEZ-QGZVFWFLSA-N 1 0 279.855 5.351 10 0 CKAERO CCCC[C@H](CC)C[C@@H]1C[C@H](CCC)CC[C@@H]1[NH3+] ZINC000103941607 185866044 /nfs/dbraw/zinc/86/60/44/185866044.db2.gz SDPKJAZJKNEUIO-HZMVEIRTSA-N 1 0 253.474 5.137 10 0 CKAERO CCC[NH2+][C@H](C[C@H](C)CCC)c1ccc(F)c(C)c1 ZINC000103942110 185865513 /nfs/dbraw/zinc/86/55/13/185865513.db2.gz YJPNACQSYGAXEU-CXAGYDPISA-N 1 0 265.416 5.001 10 0 CKAERO CCCC[C@H](CC)C[C@H]1CCCCC[C@@H]1[NH2+]CCC ZINC000103942849 185865562 /nfs/dbraw/zinc/86/55/62/185865562.db2.gz DXGVICGXMKJGAS-KSZLIROESA-N 1 0 267.501 5.541 10 0 CKAERO CCCC1CCC([NH3+])(c2cccc(Cl)c2Cl)CC1 ZINC000103943078 185865961 /nfs/dbraw/zinc/86/59/61/185865961.db2.gz RNJCUKSKCBWGDI-UHFFFAOYSA-N 1 0 286.246 5.138 10 0 CKAERO CCCc1ccccc1-c1ccc([C@H](CC)[NH2+]C)s1 ZINC000103947302 185866439 /nfs/dbraw/zinc/86/64/39/185866439.db2.gz ZLQXZMMASIZSHT-HNNXBMFYSA-N 1 0 273.445 5.038 10 0 CKAERO CC[C@H]([NH2+][C@@H](C)c1sc2ccccc2c1C)C(C)C ZINC000103968138 185870261 /nfs/dbraw/zinc/87/02/61/185870261.db2.gz FXKRSNJUOQGMLS-ZFWWWQNUSA-N 1 0 275.461 5.295 10 0 CKAERO CC[C@@H]([NH2+][C@H](C)c1sc2ccccc2c1C)C(C)C ZINC000103968151 185870287 /nfs/dbraw/zinc/87/02/87/185870287.db2.gz FXKRSNJUOQGMLS-UKRRQHHQSA-N 1 0 275.461 5.295 10 0 CKAERO CC[C@@H]([NH2+][C@@H](CC)C(C)C)c1ccc(Cl)c(Cl)c1 ZINC000103969882 185870977 /nfs/dbraw/zinc/87/09/77/185870977.db2.gz GLESYLJPMPYREM-LSDHHAIUSA-N 1 0 288.262 5.469 10 0 CKAERO CCCC[C@@H](C)[NH2+][C@@H](C)c1cc(F)c(Cl)cc1Cl ZINC000103970050 185871020 /nfs/dbraw/zinc/87/10/20/185871020.db2.gz NCKVKVSYWBWIKX-ZJUUUORDSA-N 1 0 292.225 5.362 10 0 CKAERO CC[C@@H]([NH2+][C@@H]1CCCC[C@@H]1C1CCCCC1)C(C)C ZINC000103971559 185872357 /nfs/dbraw/zinc/87/23/57/185872357.db2.gz BUAQKMVRJNWHOK-KZNAEPCWSA-N 1 0 265.485 5.150 10 0 CKAERO CC[C@@H]([NH2+][C@H]1CCCC[C@@H]1C1CCCCC1)C(C)C ZINC000103971565 185871996 /nfs/dbraw/zinc/87/19/96/185871996.db2.gz BUAQKMVRJNWHOK-KURKYZTESA-N 1 0 265.485 5.150 10 0 CKAERO CCCC[C@@H](C)[NH2+][C@@H](CC)c1ccc(Cl)c(Cl)c1 ZINC000103971671 185871988 /nfs/dbraw/zinc/87/19/88/185871988.db2.gz PWNGEIRCCWYDRO-ABAIWWIYSA-N 1 0 288.262 5.613 10 0 CKAERO CCCC[C@@H](C)[NH2+][C@H](CC)c1ccc(Cl)c(Cl)c1 ZINC000103971681 185872293 /nfs/dbraw/zinc/87/22/93/185872293.db2.gz PWNGEIRCCWYDRO-IAQYHMDHSA-N 1 0 288.262 5.613 10 0 CKAERO CCCC1CCC([NH2+]C(CC(C)C)CC(C)C)CC1 ZINC000103973045 185872078 /nfs/dbraw/zinc/87/20/78/185872078.db2.gz ZQMSICSTVNTIBM-UHFFFAOYSA-N 1 0 267.501 5.396 10 0 CKAERO CCCC[C@H](C)[NH2+][C@@H]1CCCC[C@@H]1C1CCCCC1 ZINC000103973180 185872443 /nfs/dbraw/zinc/87/24/43/185872443.db2.gz JLJPKQDRMPHTTF-CGTJXYLNSA-N 1 0 265.485 5.294 10 0 CKAERO CCCC[C@H](C)[NH2+][C@H]1CCCC[C@@H]1C1CCCCC1 ZINC000103973188 185872339 /nfs/dbraw/zinc/87/23/39/185872339.db2.gz JLJPKQDRMPHTTF-JQHSSLGASA-N 1 0 265.485 5.294 10 0 CKAERO CC(C)CC(CC(C)C)[NH2+][C@H]1CCCc2sccc21 ZINC000103973316 185871780 /nfs/dbraw/zinc/87/17/80/185871780.db2.gz OYBSPIXMTYYZEM-INIZCTEOSA-N 1 0 279.493 5.176 10 0 CKAERO CC(C)CCC[NH2+][C@@H]1CCCC[C@H]1C1CCCCC1 ZINC000103974653 185872475 /nfs/dbraw/zinc/87/24/75/185872475.db2.gz RJFHPDRHPRDTDL-ZWKOTPCHSA-N 1 0 265.485 5.151 10 0 CKAERO C[C@H]1CCCC[C@@H]1C[NH2+]C1CCC(C(C)(C)C)CC1 ZINC000103974762 185871911 /nfs/dbraw/zinc/87/19/11/185871911.db2.gz QAWFWKSJZVMRBN-NJINODPHSA-N 1 0 265.485 5.007 10 0 CKAERO CCC[C@H](CC)[NH2+][C@@H]1CCSc2ccc(Cl)cc21 ZINC000103974859 185873450 /nfs/dbraw/zinc/87/34/50/185873450.db2.gz BCOSPYSVPBTAKE-GXTWGEPZSA-N 1 0 283.868 5.045 10 0 CKAERO CCC[C@H](CC)[NH2+][C@H]1CCSc2ccc(Cl)cc21 ZINC000103974865 185873384 /nfs/dbraw/zinc/87/33/84/185873384.db2.gz BCOSPYSVPBTAKE-JSGCOSHPSA-N 1 0 283.868 5.045 10 0 CKAERO CCC[C@@H](CC)[NH2+][C@H](c1cccs1)C1CCCC1 ZINC000103976675 185873362 /nfs/dbraw/zinc/87/33/62/185873362.db2.gz UFDWATVCJQDGGC-ZBFHGGJFSA-N 1 0 265.466 5.148 10 0 CKAERO CC(C)[C@@H]([NH2+]CCC1CCCCC1)c1cccs1 ZINC000103980191 185874012 /nfs/dbraw/zinc/87/40/12/185874012.db2.gz UGHBRLZKARHUBO-MRXNPFEDSA-N 1 0 265.466 5.005 10 0 CKAERO CCCC[C@H]([NH2+][C@@H](CC)CCC)c1ccc(F)cc1 ZINC000103982382 185875454 /nfs/dbraw/zinc/87/54/54/185875454.db2.gz DEHQEVMDUPJRNJ-IRXDYDNUSA-N 1 0 265.416 5.225 10 0 CKAERO CCC[C@H](CC)[NH2+][C@@H](C)c1ccc2ccccc2c1 ZINC000103983838 185875346 /nfs/dbraw/zinc/87/53/46/185875346.db2.gz RUOFASZUDMMEGO-KSSFIOAISA-N 1 0 255.405 5.069 10 0 CKAERO CCC[C@H](CC)[NH2+][C@@H](C)c1ccc(CC(C)C)cc1 ZINC000103983863 185875291 /nfs/dbraw/zinc/87/52/91/185875291.db2.gz ZOSQRRCCPRUVLR-YJBOKZPZSA-N 1 0 261.453 5.114 10 0 CKAERO CCC[C@H](CC)[NH2+][C@H](C)c1ccc(CC(C)C)cc1 ZINC000103983871 185874837 /nfs/dbraw/zinc/87/48/37/185874837.db2.gz ZOSQRRCCPRUVLR-QAPCUYQASA-N 1 0 261.453 5.114 10 0 CKAERO CC[C@H](C)C[C@H](CC)[NH2+][C@@H](C)c1ccc(C)cc1C ZINC000103985181 185874928 /nfs/dbraw/zinc/87/49/28/185874928.db2.gz CZAOLVHNOSQODA-JQFCIGGWSA-N 1 0 261.453 5.169 10 0 CKAERO CC[C@@H]([NH2+][C@H](CC)C1CCCCC1)c1ccccc1 ZINC000103987396 185876160 /nfs/dbraw/zinc/87/61/60/185876160.db2.gz FIBVXBLGHFCYBZ-QZTJIDSGSA-N 1 0 259.437 5.086 10 0 CKAERO CC[C@H]([NH2+]C1CCC(C(C)(C)C)CC1)c1cccs1 ZINC000103988949 185875903 /nfs/dbraw/zinc/87/59/03/185875903.db2.gz DGLHPHKFMMXUTR-NRXISQOPSA-N 1 0 279.493 5.394 10 0 CKAERO CC[C@H]([NH2+][C@H]1C[C@H](C)CC(C)(C)C1)c1cccs1 ZINC000103990620 185877297 /nfs/dbraw/zinc/87/72/97/185877297.db2.gz WLOWTZSOYYHNGF-IHRRRGAJSA-N 1 0 265.466 5.004 10 0 CKAERO C[C@H]1CCC[C@@H]1[NH2+]C1CCCCCCCCCCC1 ZINC000103992581 185877619 /nfs/dbraw/zinc/87/76/19/185877619.db2.gz LKDHPUIWIHVNSW-WMZOPIPTSA-N 1 0 265.485 5.438 10 0 CKAERO CC[NH2+][C@H](c1cc(Cl)ccc1Cl)C(C)(C)CC ZINC000103996552 185878480 /nfs/dbraw/zinc/87/84/80/185878480.db2.gz FFTTZWSMWIXIEW-CYBMUJFWSA-N 1 0 274.235 5.080 10 0 CKAERO CCC[NH2+][C@@H](c1ccc(CCC)cc1)C(C)(C)CC ZINC000103996574 185878200 /nfs/dbraw/zinc/87/82/00/185878200.db2.gz SFIOHSPJBICRJL-KRWDZBQOSA-N 1 0 261.453 5.116 10 0 CKAERO CCC[NH2+][C@H](c1ccc(CCC)cc1)C(C)(C)CC ZINC000103996581 185878470 /nfs/dbraw/zinc/87/84/70/185878470.db2.gz SFIOHSPJBICRJL-QGZVFWFLSA-N 1 0 261.453 5.116 10 0 CKAERO CC[NH2+][C@H](c1ccc([C@H](C)CC)cc1)C(C)(C)CC ZINC000103998002 185878003 /nfs/dbraw/zinc/87/80/03/185878003.db2.gz WQHSDVRISIOEFJ-RHSMWYFYSA-N 1 0 261.453 5.287 10 0 CKAERO CCC[NH2+][C@H]1CCCC[C@H]1c1cccc(Cl)c1Cl ZINC000103998677 185878609 /nfs/dbraw/zinc/87/86/09/185878609.db2.gz BESSIXHNOADGFN-FZMZJTMJSA-N 1 0 286.246 5.019 10 0 CKAERO CCCC[C@@H](CC)CC1(C[NH2+]CC)CCCCC1 ZINC000103999409 185878948 /nfs/dbraw/zinc/87/89/48/185878948.db2.gz ZAAGLMOUSPWVEI-MRXNPFEDSA-N 1 0 253.474 5.153 10 0 CKAERO CCCC[C@@H](CC)C[C@](CC)(CCCC)C[NH2+]CC ZINC000104002391 185880393 /nfs/dbraw/zinc/88/03/93/185880393.db2.gz YAUWFXIGCGTQKN-MSOLQXFVSA-N 1 0 269.517 5.789 10 0 CKAERO CCCC[C@](CC)(C[NH2+]CC)Cc1ccc(CC)s1 ZINC000104003591 185880757 /nfs/dbraw/zinc/88/07/57/185880757.db2.gz FJZUEDZUARWJOC-KRWDZBQOSA-N 1 0 281.509 5.049 10 0 CKAERO CCCC[C@@](CC)(C[NH2+]CC)Cc1ccc(CC)s1 ZINC000104003595 185880440 /nfs/dbraw/zinc/88/04/40/185880440.db2.gz FJZUEDZUARWJOC-QGZVFWFLSA-N 1 0 281.509 5.049 10 0 CKAERO CCC[NH2+][C@H](c1ccc(Cl)cc1Cl)[C@@H](C)CCC ZINC000104003750 185880321 /nfs/dbraw/zinc/88/03/21/185880321.db2.gz CXBKBOLGPWFZFT-NHYWBVRUSA-N 1 0 288.262 5.470 10 0 CKAERO CCC[NH2+][C@@H](c1ccc(Cl)cc1Cl)[C@H](C)CCC ZINC000104003753 185880367 /nfs/dbraw/zinc/88/03/67/185880367.db2.gz CXBKBOLGPWFZFT-IAQYHMDHSA-N 1 0 288.262 5.470 10 0 CKAERO CC(C)(C)CC[C@]1(C[NH2+]C(C)(C)C)C[C@H]2CC[C@@H]1C2 ZINC000104004842 185880189 /nfs/dbraw/zinc/88/01/89/185880189.db2.gz WINNWRSSJUYQFD-HDMKZQKVSA-N 1 0 265.485 5.007 10 0 CKAERO CCCC[C@](CC)(C[NH2+]CC)Cc1cccc(Cl)c1 ZINC000104004936 185880643 /nfs/dbraw/zinc/88/06/43/185880643.db2.gz QOBOOGACLFXAGO-KRWDZBQOSA-N 1 0 281.871 5.079 10 0 CKAERO CCCC[C@@H](CC)C[C@H](C[NH2+]C(C)(C)C)CC(C)C ZINC000104008803 185881554 /nfs/dbraw/zinc/88/15/54/185881554.db2.gz VGETVJPFFZNSDR-IAGOWNOFSA-N 1 0 269.517 5.643 10 0 CKAERO CCCC[C@@H](CC)[C@H]([NH2+]CCC)c1sccc1C ZINC000104009374 185881171 /nfs/dbraw/zinc/88/11/71/185881171.db2.gz CGZKZSKSOJIZOQ-CABCVRRESA-N 1 0 267.482 5.314 10 0 CKAERO CCCC[C@H](CC)[C@H]([NH2+]CCC)c1sccc1C ZINC000104009377 185881648 /nfs/dbraw/zinc/88/16/48/185881648.db2.gz CGZKZSKSOJIZOQ-GJZGRUSLSA-N 1 0 267.482 5.314 10 0 CKAERO CCCC[C@@H](CC)[C@@H]([NH2+]CCC)c1sccc1C ZINC000104009381 185881512 /nfs/dbraw/zinc/88/15/12/185881512.db2.gz CGZKZSKSOJIZOQ-HUUCEWRRSA-N 1 0 267.482 5.314 10 0 CKAERO CCC[C@@H](C)CC1(C[NH2+]C)CCC(C(C)(C)C)CC1 ZINC000104010723 185882084 /nfs/dbraw/zinc/88/20/84/185882084.db2.gz UQVNGEVESCAGKV-KLHKWILBSA-N 1 0 267.501 5.255 10 0 CKAERO CCCC[C@H](CC)C[C@@H](C[NH2+]CC(C)C)CC(C)C ZINC000104012226 185882563 /nfs/dbraw/zinc/88/25/63/185882563.db2.gz RUTCUCGFLBBFHL-ROUUACIJSA-N 1 0 269.517 5.501 10 0 CKAERO CCCCC1CCC(CC)(C[NH2+]C(C)(C)C)CC1 ZINC000104014325 185882345 /nfs/dbraw/zinc/88/23/45/185882345.db2.gz PNHSIDURIPJILN-UHFFFAOYSA-N 1 0 253.474 5.151 10 0 CKAERO CCCC[C@@](CC)(C[NH2+]CC(C)C)C[C@H](C)CCC ZINC000104014424 185882957 /nfs/dbraw/zinc/88/29/57/185882957.db2.gz XVSDOKLSMIWTCZ-QZTJIDSGSA-N 1 0 269.517 5.645 10 0 CKAERO CCCC[C@@](CC)(CCC(C)C)C[NH2+]CC(C)C ZINC000104014428 185882154 /nfs/dbraw/zinc/88/21/54/185882154.db2.gz NXVDYURDVKEMQR-KRWDZBQOSA-N 1 0 255.490 5.255 10 0 CKAERO CCC(CC)(C[NH2+]C(C)(C)C)Cc1ccccc1Cl ZINC000104014445 185882550 /nfs/dbraw/zinc/88/25/50/185882550.db2.gz VGGXGLHJUOWMHY-UHFFFAOYSA-N 1 0 281.871 5.077 10 0 CKAERO CCCC[C@@](CC)(C[NH2+]CC(C)C)Cc1cccs1 ZINC000104016144 185883357 /nfs/dbraw/zinc/88/33/57/185883357.db2.gz SAXLZLPZANUFIR-QGZVFWFLSA-N 1 0 281.509 5.123 10 0 CKAERO CCCC[C@H](C[NH2+]C(C)(C)C)Cc1ccc(Cl)cc1 ZINC000104017884 185883928 /nfs/dbraw/zinc/88/39/28/185883928.db2.gz ITIGFTYEPNVAEJ-HNNXBMFYSA-N 1 0 281.871 5.077 10 0 CKAERO CCCC(CCC)(C[NH2+]C(C)C)c1ccc(Cl)cc1 ZINC000104018838 185883678 /nfs/dbraw/zinc/88/36/78/185883678.db2.gz JBKHKGKFLUZWMQ-UHFFFAOYSA-N 1 0 281.871 5.176 10 0 CKAERO CCCC[C@H](CC)CC1(C[NH2+]CCC)CCCC1 ZINC000104020070 185883371 /nfs/dbraw/zinc/88/33/71/185883371.db2.gz PZIJOLPCWWOIOS-INIZCTEOSA-N 1 0 253.474 5.153 10 0 CKAERO CCC[NH2+][C@H](C[C@H](C)CC(C)(C)C)C1=CCCCC1 ZINC000104020491 185883877 /nfs/dbraw/zinc/88/38/77/185883877.db2.gz WZEUDDGLUAYQIP-DOTOQJQBSA-N 1 0 265.485 5.317 10 0 CKAERO CCCC[C@@H](CC)C[NH2+][C@@H](C)c1ccc(CC)s1 ZINC000104021490 185884192 /nfs/dbraw/zinc/88/41/92/185884192.db2.gz NAOOGTCVIDREFA-UONOGXRCSA-N 1 0 267.482 5.178 10 0 CKAERO CCCC[C@H](CC)C[NH2+][C@H](C)c1ccc(CC)s1 ZINC000104021501 185884441 /nfs/dbraw/zinc/88/44/41/185884441.db2.gz NAOOGTCVIDREFA-KGLIPLIRSA-N 1 0 267.482 5.178 10 0 CKAERO CCC[NH2+][C@H](C)c1ccc(-c2ccccc2Cl)cc1 ZINC000104021659 185884701 /nfs/dbraw/zinc/88/47/01/185884701.db2.gz QGNXVESGXXBQCY-CYBMUJFWSA-N 1 0 273.807 5.068 10 0 CKAERO CCC[NH2+][C@@H](C)c1cccc(-c2cccc(Cl)c2)c1 ZINC000104024014 185884569 /nfs/dbraw/zinc/88/45/69/185884569.db2.gz JJPWHCVKVPFQSP-ZDUSSCGKSA-N 1 0 273.807 5.068 10 0 CKAERO CCc1ccc([C@@H](C)[NH2+]CCCCCCC(C)C)s1 ZINC000104027471 185884351 /nfs/dbraw/zinc/88/43/51/185884351.db2.gz UYYIFUNPVCILPV-OAHLLOKOSA-N 1 0 281.509 5.568 10 0 CKAERO CCc1ccc([C@H](C)[NH2+]CCCCCCC(C)C)s1 ZINC000104027475 185884798 /nfs/dbraw/zinc/88/47/98/185884798.db2.gz UYYIFUNPVCILPV-HNNXBMFYSA-N 1 0 281.509 5.568 10 0 CKAERO CCCCCC(CCCCC)[NH2+][C@H]1CCC[C@H](C)C1 ZINC000104029231 185884706 /nfs/dbraw/zinc/88/47/06/185884706.db2.gz MTJJITNDAPHUDT-WMZOPIPTSA-N 1 0 267.501 5.684 10 0 CKAERO CC(C)C[C@@H](C)[NH2+]Cc1sc2ccccc2c1Cl ZINC000104031021 185884114 /nfs/dbraw/zinc/88/41/14/185884114.db2.gz ULVRMXILLMXGJF-LLVKDONJSA-N 1 0 281.852 5.079 10 0 CKAERO C[C@H]([NH2+][C@@H]1CCSc2ccc(Cl)cc21)C1CCCC1 ZINC000104034949 185884308 /nfs/dbraw/zinc/88/43/08/185884308.db2.gz SOYBGMKEQJFVTO-XHDPSFHLSA-N 1 0 295.879 5.045 10 0 CKAERO CC(C)(C)CC(C)(C)[NH2+][C@@H]1C[C@@H]2CC[C@@]1(C)C2(C)C ZINC000104038826 185885187 /nfs/dbraw/zinc/88/51/87/185885187.db2.gz QIFSXEAQKMQILP-PMUMKWKESA-N 1 0 265.485 5.006 10 0 CKAERO CCC[NH2+][C@@H](C)c1ccccc1-c1ccc(Cl)cc1 ZINC000104040799 185885601 /nfs/dbraw/zinc/88/56/01/185885601.db2.gz WFSLKEZHLHTSNC-ZDUSSCGKSA-N 1 0 273.807 5.068 10 0 CKAERO CC[C@@H]([NH2+]C)c1cccc(-c2cccc(Cl)c2Cl)c1 ZINC000104044188 185885249 /nfs/dbraw/zinc/88/52/49/185885249.db2.gz JSQCALIXGAVZKE-OAHLLOKOSA-N 1 0 294.225 5.331 10 0 CKAERO CCc1ccc(C[NH2+][C@H]2CCCC[C@H]2C(C)(C)C)s1 ZINC000104044212 185885532 /nfs/dbraw/zinc/88/55/32/185885532.db2.gz DRTBNAUETBVPCA-CVEARBPZSA-N 1 0 279.493 5.005 10 0 CKAERO CCCCCC[C@]1([NH3+])CCCC[C@@H]1c1ccccc1 ZINC000104151409 185912648 /nfs/dbraw/zinc/91/26/48/185912648.db2.gz MKTHFSCXMRHYDP-MSOLQXFVSA-N 1 0 259.437 5.012 10 0 CKAERO CCCCCC[C@@]1([NH3+])CCCC[C@@H]1c1ccccc1 ZINC000104151412 185912196 /nfs/dbraw/zinc/91/21/96/185912196.db2.gz MKTHFSCXMRHYDP-QZTJIDSGSA-N 1 0 259.437 5.012 10 0 CKAERO CCCCCC[C@]1([NH3+])CCCC[C@H]1c1ccccc1 ZINC000104151416 185912815 /nfs/dbraw/zinc/91/28/15/185912815.db2.gz MKTHFSCXMRHYDP-ROUUACIJSA-N 1 0 259.437 5.012 10 0 CKAERO CCCCCC[C@@]1([NH3+])CCCC[C@H]1c1ccccc1 ZINC000104151418 185912484 /nfs/dbraw/zinc/91/24/84/185912484.db2.gz MKTHFSCXMRHYDP-ZWKOTPCHSA-N 1 0 259.437 5.012 10 0 CKAERO CCCCCC[C@](CC)(CCCC)C[NH2+]C1CC1 ZINC000104152359 185912471 /nfs/dbraw/zinc/91/24/71/185912471.db2.gz PSGIUFFYIQMFLH-KRWDZBQOSA-N 1 0 253.474 5.295 10 0 CKAERO Cc1ccc(Sc2ccc([C@@H](C)[NH3+])cc2Cl)cc1C ZINC000104168483 185915225 /nfs/dbraw/zinc/91/52/25/185915225.db2.gz SXTQYFXAAGZPLR-GFCCVEGCSA-N 1 0 291.847 5.128 10 0 CKAERO Cc1ccc(Sc2ccc([C@H](C)[NH3+])cc2Cl)cc1C ZINC000104168487 185915143 /nfs/dbraw/zinc/91/51/43/185915143.db2.gz SXTQYFXAAGZPLR-LBPRGKRZSA-N 1 0 291.847 5.128 10 0 CKAERO CC[C@H]([NH3+])[C@@H](SC1CCCCC1)c1ccccc1Cl ZINC000104175875 185917132 /nfs/dbraw/zinc/91/71/32/185917132.db2.gz YEYDVLIKIDMDEQ-HOTGVXAUSA-N 1 0 297.895 5.184 10 0 CKAERO CC[C@@H]([NH3+])[C@H](SC1CCCCC1)c1ccc(Cl)cc1 ZINC000104175890 185916866 /nfs/dbraw/zinc/91/68/66/185916866.db2.gz IHEBYMOOYIDBPN-HZPDHXFCSA-N 1 0 297.895 5.184 10 0 CKAERO CCCCCC[C@]1(C[NH2+]C(C)(C)C)C[C@H]2CC[C@@H]1C2 ZINC000104345701 185978429 /nfs/dbraw/zinc/97/84/29/185978429.db2.gz HDRLNJMQMPATSJ-LZLYRXPVSA-N 1 0 265.485 5.151 10 0 CKAERO CC[C@H]1CCCC[C@@H]1C1([NH3+])CCC(C(C)(C)C)CC1 ZINC000104384387 185988220 /nfs/dbraw/zinc/98/82/20/185988220.db2.gz XHZDFPSBJMOMPR-VUGNNNGISA-N 1 0 265.485 5.137 10 0 CKAERO CCC[NH2+][C@H](C1CCCCC1)[C@@H]1CCCC[C@@H]1CC ZINC000104385773 185987852 /nfs/dbraw/zinc/98/78/52/185987852.db2.gz IAFQFHGVXOWROC-CGTJXYLNSA-N 1 0 265.485 5.151 10 0 CKAERO CCC[NH2+][C@@H](C1CCCCC1)[C@H]1CCCC[C@@H]1CC ZINC000104385775 185988588 /nfs/dbraw/zinc/98/85/88/185988588.db2.gz IAFQFHGVXOWROC-SZMVWBNQSA-N 1 0 265.485 5.151 10 0 CKAERO CCC[NH2+][C@H](C1CCCCC1)[C@H]1CCCC[C@@H]1CC ZINC000104385779 185988003 /nfs/dbraw/zinc/98/80/03/185988003.db2.gz IAFQFHGVXOWROC-RYQLBKOJSA-N 1 0 265.485 5.151 10 0 CKAERO CCC(CC)[C@@H](C)[NH2+]C1CCC(C(C)(C)CC)CC1 ZINC000104431699 186000717 /nfs/dbraw/zinc/00/07/17/186000717.db2.gz XLKSYPARLQZAQU-ODIFPOPNSA-N 1 0 267.501 5.396 10 0 CKAERO CCC(CC)[C@H](C)[NH2+]C1CCC(C(C)(C)CC)CC1 ZINC000104431701 186000469 /nfs/dbraw/zinc/00/04/69/186000469.db2.gz XLKSYPARLQZAQU-OOHWJJMZSA-N 1 0 267.501 5.396 10 0 CKAERO CCC(CC)[C@@H](C)[NH2+][C@@H](C)c1ccc(Cl)cc1Cl ZINC000104433119 186000270 /nfs/dbraw/zinc/00/02/70/186000270.db2.gz DNFWLWRXUKTKRS-MNOVXSKESA-N 1 0 288.262 5.469 10 0 CKAERO CCC(CC)[C@H](C)[NH2+][C@@H](C)c1ccc(Cl)cc1Cl ZINC000104433125 186000038 /nfs/dbraw/zinc/00/00/38/186000038.db2.gz DNFWLWRXUKTKRS-QWRGUYRKSA-N 1 0 288.262 5.469 10 0 CKAERO CCC(CC)[C@@H](C)[NH2+][C@H](C)c1ccc(Cl)cc1Cl ZINC000104433129 186000601 /nfs/dbraw/zinc/00/06/01/186000601.db2.gz DNFWLWRXUKTKRS-GHMZBOCLSA-N 1 0 288.262 5.469 10 0 CKAERO CCC(CC)[C@H](C)[NH2+][C@H](C)c1ccc(Cl)cc1Cl ZINC000104433134 186000210 /nfs/dbraw/zinc/00/02/10/186000210.db2.gz DNFWLWRXUKTKRS-WDEREUQCSA-N 1 0 288.262 5.469 10 0 CKAERO CCC[NH2+][C@@H](C[C@@H](C)C(C)(C)C)c1cc(C)oc1C ZINC000104434078 186000177 /nfs/dbraw/zinc/00/01/77/186000177.db2.gz XAIGTMLCXLPPFW-WBMJQRKESA-N 1 0 265.441 5.009 10 0 CKAERO CCC[NH2+][C@H](C[C@@H](C)C(C)(C)C)c1cc(C)oc1C ZINC000104434082 186000400 /nfs/dbraw/zinc/00/04/00/186000400.db2.gz XAIGTMLCXLPPFW-MLGOLLRUSA-N 1 0 265.441 5.009 10 0 CKAERO CCC[NH2+][C@@H](C[C@H](C)C(C)(C)C)c1cc(C)oc1C ZINC000104434088 186000139 /nfs/dbraw/zinc/00/01/39/186000139.db2.gz XAIGTMLCXLPPFW-LRDDRELGSA-N 1 0 265.441 5.009 10 0 CKAERO CCC[NH2+][C@H](C[C@H](C)C(C)(C)C)c1cc(C)oc1C ZINC000104434092 186000179 /nfs/dbraw/zinc/00/01/79/186000179.db2.gz XAIGTMLCXLPPFW-BLLLJJGKSA-N 1 0 265.441 5.009 10 0 CKAERO CCC(CC)[C@@H](C)[NH2+][C@@H]1CCCC[C@@H]1C(C)(C)C ZINC000104434514 186000291 /nfs/dbraw/zinc/00/02/91/186000291.db2.gz NUHPJEKZDQPARI-VNQPRFMTSA-N 1 0 253.474 5.006 10 0 CKAERO CCC(CC)[C@H](C)[NH2+][C@@H]1CCCC[C@@H]1C(C)(C)C ZINC000104434516 186000180 /nfs/dbraw/zinc/00/01/80/186000180.db2.gz NUHPJEKZDQPARI-CWRNSKLLSA-N 1 0 253.474 5.006 10 0 CKAERO CCC(CC)[C@@H](C)[NH2+][C@H]1CCCC[C@@H]1C(C)(C)C ZINC000104434519 186000293 /nfs/dbraw/zinc/00/02/93/186000293.db2.gz NUHPJEKZDQPARI-KBMXLJTQSA-N 1 0 253.474 5.006 10 0 CKAERO CCC(CC)[C@H](C)[NH2+][C@H]1CCCC[C@@H]1C(C)(C)C ZINC000104434522 186001383 /nfs/dbraw/zinc/00/13/83/186001383.db2.gz NUHPJEKZDQPARI-BPUTZDHNSA-N 1 0 253.474 5.006 10 0 CKAERO CCCCCC(CCCCC)[NH2+]CC1(C)CCCC1 ZINC000104436418 186001263 /nfs/dbraw/zinc/00/12/63/186001263.db2.gz MOFKQGYEMLVSDZ-UHFFFAOYSA-N 1 0 267.501 5.686 10 0 CKAERO CC(C)c1ccc([C@@H](C)[NH2+]CC2(C)CCCC2)cc1 ZINC000104437704 186002534 /nfs/dbraw/zinc/00/25/34/186002534.db2.gz UIXCPRKLLUWULK-OAHLLOKOSA-N 1 0 259.437 5.041 10 0 CKAERO CC(C)c1ccc([C@H](C)[NH2+]CC2(C)CCCC2)cc1 ZINC000104437707 186001990 /nfs/dbraw/zinc/00/19/90/186001990.db2.gz UIXCPRKLLUWULK-HNNXBMFYSA-N 1 0 259.437 5.041 10 0 CKAERO CCCC[C@H]([NH2+][C@@H](C)C(CC)CC)c1ccccc1 ZINC000104439534 186002599 /nfs/dbraw/zinc/00/25/99/186002599.db2.gz HTQDSCOTIOAQQG-YJBOKZPZSA-N 1 0 261.453 5.332 10 0 CKAERO CCCC[C@@H]([NH2+][C@@H](C)C(CC)CC)c1ccccc1 ZINC000104439537 186002006 /nfs/dbraw/zinc/00/20/06/186002006.db2.gz HTQDSCOTIOAQQG-MAUKXSAKSA-N 1 0 261.453 5.332 10 0 CKAERO CCCC[C@H]([NH2+][C@H](C)C(CC)CC)c1ccccc1 ZINC000104439539 186002188 /nfs/dbraw/zinc/00/21/88/186002188.db2.gz HTQDSCOTIOAQQG-QAPCUYQASA-N 1 0 261.453 5.332 10 0 CKAERO CCCC[C@@H]([NH2+][C@H](C)C(CC)CC)c1ccccc1 ZINC000104439543 186002161 /nfs/dbraw/zinc/00/21/61/186002161.db2.gz HTQDSCOTIOAQQG-CRAIPNDOSA-N 1 0 261.453 5.332 10 0 CKAERO CCC(CC)[C@@H](C)[NH2+]C1CC(c2ccccc2Cl)C1 ZINC000104443162 186004439 /nfs/dbraw/zinc/00/44/39/186004439.db2.gz BTISXZJOWHFODM-LRVUVFPRSA-N 1 0 279.855 5.000 10 0 CKAERO CCC(CC)[C@H](C)[NH2+]C1CC(c2ccccc2Cl)C1 ZINC000104443164 186004522 /nfs/dbraw/zinc/00/45/22/186004522.db2.gz BTISXZJOWHFODM-GRTSSRMGSA-N 1 0 279.855 5.000 10 0 CKAERO CCC(CC)[C@@H](C)[NH2+][C@@H](c1cccs1)C1CCCC1 ZINC000104444420 186004393 /nfs/dbraw/zinc/00/43/93/186004393.db2.gz RFRTURYWFBKTLW-CXAGYDPISA-N 1 0 279.493 5.394 10 0 CKAERO CCC(CC)[C@H](C)[NH2+][C@@H](c1cccs1)C1CCCC1 ZINC000104444423 186004443 /nfs/dbraw/zinc/00/44/43/186004443.db2.gz RFRTURYWFBKTLW-SUMWQHHRSA-N 1 0 279.493 5.394 10 0 CKAERO CCC(CC)[C@@H](C)[NH2+][C@H](c1cccs1)C1CCCC1 ZINC000104444426 186004136 /nfs/dbraw/zinc/00/41/36/186004136.db2.gz RFRTURYWFBKTLW-DYVFJYSZSA-N 1 0 279.493 5.394 10 0 CKAERO CCC(CC)[C@H](C)[NH2+][C@H](c1cccs1)C1CCCC1 ZINC000104444429 186003839 /nfs/dbraw/zinc/00/38/39/186003839.db2.gz RFRTURYWFBKTLW-GUYCJALGSA-N 1 0 279.493 5.394 10 0 CKAERO C[NH2+][C@@H](C[C@H](C)C(C)(C)C)c1cc(Cl)ccc1Cl ZINC000104445308 186005362 /nfs/dbraw/zinc/00/53/62/186005362.db2.gz KLIIMXMDMXJHFC-HZMBPMFUSA-N 1 0 288.262 5.326 10 0 CKAERO C[NH2+][C@@H](C[C@@H](C)C(C)(C)C)c1cc(Cl)ccc1Cl ZINC000104445310 186004929 /nfs/dbraw/zinc/00/49/29/186004929.db2.gz KLIIMXMDMXJHFC-YGRLFVJLSA-N 1 0 288.262 5.326 10 0 CKAERO C[NH2+][C@H](C[C@H](C)C(C)(C)C)c1cc(Cl)ccc1Cl ZINC000104445313 186004982 /nfs/dbraw/zinc/00/49/82/186004982.db2.gz KLIIMXMDMXJHFC-IINYFYTJSA-N 1 0 288.262 5.326 10 0 CKAERO C[NH2+][C@H](C[C@@H](C)C(C)(C)C)c1cc(Cl)ccc1Cl ZINC000104445315 186005257 /nfs/dbraw/zinc/00/52/57/186005257.db2.gz KLIIMXMDMXJHFC-QMTHXVAHSA-N 1 0 288.262 5.326 10 0 CKAERO CCC(CC)[C@@H](C)[NH2+][C@@H](CC)c1cccc(Cl)c1 ZINC000104446982 186005157 /nfs/dbraw/zinc/00/51/57/186005157.db2.gz YNUTUYLCEDGHBE-WBMJQRKESA-N 1 0 267.844 5.205 10 0 CKAERO CCC(CC)[C@H](C)[NH2+][C@@H](CC)c1cccc(Cl)c1 ZINC000104446986 186004860 /nfs/dbraw/zinc/00/48/60/186004860.db2.gz YNUTUYLCEDGHBE-LRDDRELGSA-N 1 0 267.844 5.205 10 0 CKAERO CCC(CC)[C@@H](C)[NH2+][C@H](CC)c1cccc(Cl)c1 ZINC000104446990 186005118 /nfs/dbraw/zinc/00/51/18/186005118.db2.gz YNUTUYLCEDGHBE-MLGOLLRUSA-N 1 0 267.844 5.205 10 0 CKAERO CCC(CC)[C@H](C)[NH2+][C@H](CC)c1cccc(Cl)c1 ZINC000104446991 186005131 /nfs/dbraw/zinc/00/51/31/186005131.db2.gz YNUTUYLCEDGHBE-BLLLJJGKSA-N 1 0 267.844 5.205 10 0 CKAERO Cc1ccsc1C[NH2+][C@@H](C)c1ccc2ccccc2c1 ZINC000105814709 330328386 /nfs/dbraw/zinc/32/83/86/330328386.db2.gz FZRJENKEHYHDGU-AWEZNQCLSA-N 1 0 281.424 5.061 10 0 CKAERO Cc1ccsc1C[NH2+][C@H](C)c1ccc2ccccc2c1 ZINC000105814712 330328430 /nfs/dbraw/zinc/32/84/30/330328430.db2.gz FZRJENKEHYHDGU-CQSZACIVSA-N 1 0 281.424 5.061 10 0 CKAERO CCC(C)(C)C1CCC2(C[C@@H]2C[NH2+]C(C)(C)C)CC1 ZINC000110267428 186289845 /nfs/dbraw/zinc/28/98/45/186289845.db2.gz RLKMENKGLHPXMC-SWKXRBFHSA-N 1 0 265.485 5.007 10 0 CKAERO CCC(C)(C)C1CCC2(C[C@H]2C[NH2+]C(C)(C)C)CC1 ZINC000110267431 186289260 /nfs/dbraw/zinc/28/92/60/186289260.db2.gz RLKMENKGLHPXMC-CSLYMUCUSA-N 1 0 265.485 5.007 10 0 CKAERO CCCCCCC1([NH3+])CCC(C(C)(C)CC)CC1 ZINC000110462682 186297609 /nfs/dbraw/zinc/29/76/09/186297609.db2.gz LDQPBINREHSMLZ-UHFFFAOYSA-N 1 0 253.474 5.281 10 0 CKAERO CCCCC1CCC(C[NH2+]CC)(CC(C)C)CC1 ZINC000110521255 186301135 /nfs/dbraw/zinc/30/11/35/186301135.db2.gz GBLPYOZSSTWTCL-UHFFFAOYSA-N 1 0 253.474 5.009 10 0 CKAERO CCC[NH2+][C@H](CCC)CCc1csc2ccccc12 ZINC000111615063 186431561 /nfs/dbraw/zinc/43/15/61/186431561.db2.gz WIXGZCHRLCOULT-OAHLLOKOSA-N 1 0 275.461 5.002 10 0 CKAERO CC(C)[NH2+]Cc1ccc(-c2ccc(Cl)cc2Cl)cc1 ZINC000111818326 186459371 /nfs/dbraw/zinc/45/93/71/186459371.db2.gz KXZKAQILQZHCMH-UHFFFAOYSA-N 1 0 294.225 5.158 10 0 CKAERO CCC[NH2+][C@@H]1CC[C@H](CCC)C[C@H]1CCC(C)C ZINC000112405910 186494710 /nfs/dbraw/zinc/49/47/10/186494710.db2.gz GCRHWCBTLDKNCF-GVDBMIGSSA-N 1 0 253.474 5.007 10 0 CKAERO Cc1ccc([C@@H](C)NC2c3ccccc3-c3ccccc32)o1 ZINC000120692415 330391561 /nfs/dbraw/zinc/39/15/61/330391561.db2.gz ICLDMBKTDMWMSQ-CQSZACIVSA-N 1 0 289.378 5.009 10 0 CKAERO Cc1ccc([C@H](C)NC2c3ccccc3-c3ccccc32)o1 ZINC000120692579 330391670 /nfs/dbraw/zinc/39/16/70/330391670.db2.gz ICLDMBKTDMWMSQ-AWEZNQCLSA-N 1 0 289.378 5.009 10 0 CKAERO C[C@H]([NH2+][C@@H](C)c1cc2c(s1)CCCC2)c1cccs1 ZINC000129547386 518183488 /nfs/dbraw/zinc/18/34/88/518183488.db2.gz SLNKBVRLKXTURP-RYUDHWBXSA-N 1 0 291.485 5.100 10 0 CKAERO C[C@@H]([NH2+][C@@H](C)c1cccs1)c1cc2c(s1)CCCC2 ZINC000129547594 333776424 /nfs/dbraw/zinc/77/64/24/333776424.db2.gz SLNKBVRLKXTURP-NWDGAFQWSA-N 1 0 291.485 5.100 10 0 CKAERO C[C@@H]([NH2+][C@@H](C)c1cc2c(s1)CCCC2)c1cccs1 ZINC000129547825 333776338 /nfs/dbraw/zinc/77/63/38/333776338.db2.gz SLNKBVRLKXTURP-NEPJUHHUSA-N 1 0 291.485 5.100 10 0 CKAERO C[C@@H]([NH2+][C@H](C)c1cc2c(s1)CCCC2)c1cccs1 ZINC000129548014 333776441 /nfs/dbraw/zinc/77/64/41/333776441.db2.gz SLNKBVRLKXTURP-VXGBXAGGSA-N 1 0 291.485 5.100 10 0 CKAERO C[C@H]([NH2+][C@H]1C[C@H](C)Sc2sccc21)c1cccs1 ZINC000130198110 525636153 /nfs/dbraw/zinc/63/61/53/525636153.db2.gz SYTXIKIXKFKNAA-NHCYSSNCSA-N 1 0 295.498 5.086 10 0 CKAERO C[C@H]([NH2+][C@@H]1C[C@H](C)Sc2sccc21)c1cccs1 ZINC000130198299 525588880 /nfs/dbraw/zinc/58/88/80/525588880.db2.gz SYTXIKIXKFKNAA-JBLDHEPKSA-N 1 0 295.498 5.086 10 0 CKAERO C[C@@H]([NH2+][C@H]1C[C@H](C)Sc2sccc21)c1cccs1 ZINC000130198525 525695702 /nfs/dbraw/zinc/69/57/02/525695702.db2.gz SYTXIKIXKFKNAA-UMNHJUIQSA-N 1 0 295.498 5.086 10 0 CKAERO C[C@@H]([NH2+][C@@H]1C[C@H](C)Sc2sccc21)c1cccs1 ZINC000130198749 525653615 /nfs/dbraw/zinc/65/36/15/525653615.db2.gz SYTXIKIXKFKNAA-HOSYDEDBSA-N 1 0 295.498 5.086 10 0 CKAERO Cc1cccc([C@@H](C)[NH2+][C@@H](C)c2cc(C)cc(C)c2)c1 ZINC000132670668 333997741 /nfs/dbraw/zinc/99/77/41/333997741.db2.gz IVOUQCLICLSTCV-SJORKVTESA-N 1 0 267.416 5.024 10 0 CKAERO Cc1cccc([C@@H](C)[NH2+][C@H](C)c2cc(C)cc(C)c2)c1 ZINC000132670861 333997703 /nfs/dbraw/zinc/99/77/03/333997703.db2.gz IVOUQCLICLSTCV-IAGOWNOFSA-N 1 0 267.416 5.024 10 0 CKAERO Cc1cccc([C@H](C)[NH2+][C@@H](C)c2cc(C)cc(C)c2)c1 ZINC000132671036 333997643 /nfs/dbraw/zinc/99/76/43/333997643.db2.gz IVOUQCLICLSTCV-IRXDYDNUSA-N 1 0 267.416 5.024 10 0 CKAERO C[C@H]([NH2+][C@H]1CC[C@@H](C)c2ccccc21)c1cccs1 ZINC000136974266 334166454 /nfs/dbraw/zinc/16/64/54/334166454.db2.gz AAVOZOLHMWDMTN-WWGRRREGSA-N 1 0 271.429 5.037 10 0 CKAERO C[C@H]([NH2+][C@@H]1CC[C@@H](C)c2ccccc21)c1cccs1 ZINC000136974320 334166438 /nfs/dbraw/zinc/16/64/38/334166438.db2.gz AAVOZOLHMWDMTN-DVOMOZLQSA-N 1 0 271.429 5.037 10 0 CKAERO C[C@@H]([NH2+][C@H]1CC[C@@H](C)c2ccccc21)c1cccs1 ZINC000136974381 334166443 /nfs/dbraw/zinc/16/64/43/334166443.db2.gz AAVOZOLHMWDMTN-IOASZLSFSA-N 1 0 271.429 5.037 10 0 CKAERO C[C@@H]([NH2+][C@@H]1CC[C@@H](C)c2ccccc21)c1cccs1 ZINC000136974445 334166448 /nfs/dbraw/zinc/16/64/48/334166448.db2.gz AAVOZOLHMWDMTN-XJKCOSOUSA-N 1 0 271.429 5.037 10 0 CKAERO CC[C@H]([NH2+][C@@H]1CCc2cc(Cl)ccc21)c1cccs1 ZINC000156103877 330720111 /nfs/dbraw/zinc/72/01/11/330720111.db2.gz WTNPUPFSGLEANJ-LSDHHAIUSA-N 1 0 291.847 5.130 10 0 CKAERO CC[C@H]([NH2+][C@H]1CCc2cc(Cl)ccc21)c1cccs1 ZINC000156104113 330720081 /nfs/dbraw/zinc/72/00/81/330720081.db2.gz WTNPUPFSGLEANJ-GJZGRUSLSA-N 1 0 291.847 5.130 10 0 CKAERO Cc1cccc([C@@H](C)[NH2+][C@@H](C)c2ccc(C)c(C)c2)c1 ZINC000157180214 330769308 /nfs/dbraw/zinc/76/93/08/330769308.db2.gz XETGESKOKLLVFP-SJORKVTESA-N 1 0 267.416 5.024 10 0 CKAERO Cc1cccc([C@@H](C)[NH2+][C@H](C)c2ccc(C)c(C)c2)c1 ZINC000157180356 330769440 /nfs/dbraw/zinc/76/94/40/330769440.db2.gz XETGESKOKLLVFP-IAGOWNOFSA-N 1 0 267.416 5.024 10 0 CKAERO Cc1cccc([C@@H](C)[NH2+][C@H](C)c2ccc(F)c(Cl)c2)c1 ZINC000157184605 328460524 /nfs/dbraw/zinc/46/05/24/328460524.db2.gz DHGOITCURWIGOO-CHWSQXEVSA-N 1 0 291.797 5.199 10 0 CKAERO Cc1cccc([C@@H](C)[NH2+][C@H](C)c2ccc(F)cc2Cl)c1 ZINC000157198333 330770415 /nfs/dbraw/zinc/77/04/15/330770415.db2.gz HFTKDCJWXUQHHH-CHWSQXEVSA-N 1 0 291.797 5.199 10 0 CKAERO Cc1cccc([C@H](C)[NH2+][C@H](C)c2ccc(C)c(C)c2)c1 ZINC000157235061 330771843 /nfs/dbraw/zinc/77/18/43/330771843.db2.gz XETGESKOKLLVFP-DLBZAZTESA-N 1 0 267.416 5.024 10 0 CKAERO Cc1cccc([C@H](C)[NH2+][C@@H](C)c2ccc(F)c(Cl)c2)c1 ZINC000157238920 264255808 /nfs/dbraw/zinc/25/58/08/264255808.db2.gz DHGOITCURWIGOO-STQMWFEESA-N 1 0 291.797 5.199 10 0 CKAERO Cc1cccc([C@H](C)[NH2+][C@H](C)c2ccc(F)c(Cl)c2)c1 ZINC000157239080 264255314 /nfs/dbraw/zinc/25/53/14/264255314.db2.gz DHGOITCURWIGOO-QWHCGFSZSA-N 1 0 291.797 5.199 10 0 CKAERO Cc1cccc([C@H](C)[NH2+]Cc2csc3ccccc23)c1 ZINC000157270849 264279775 /nfs/dbraw/zinc/27/97/75/264279775.db2.gz LOTDDADDNGGAQK-AWEZNQCLSA-N 1 0 281.424 5.061 10 0 CKAERO CC[C@H]([NH2+][C@@H](C)c1ccc(Cl)s1)c1ccccc1F ZINC000163464027 331042488 /nfs/dbraw/zinc/04/24/88/331042488.db2.gz WPLJUBPNIBYPFU-GWCFXTLKSA-N 1 0 297.826 5.343 10 0 CKAERO CC[C@@H]([NH2+][C@@H](C)c1ccc(Cl)s1)c1ccccc1F ZINC000163464120 331042560 /nfs/dbraw/zinc/04/25/60/331042560.db2.gz WPLJUBPNIBYPFU-GXFFZTMASA-N 1 0 297.826 5.343 10 0 CKAERO CC[C@H]([NH2+][C@H](C)c1ccc(Cl)s1)c1ccccc1F ZINC000163464203 331042565 /nfs/dbraw/zinc/04/25/65/331042565.db2.gz WPLJUBPNIBYPFU-MFKMUULPSA-N 1 0 297.826 5.343 10 0 CKAERO CC[C@@H]([NH2+][C@H](C)c1ccc(Cl)s1)c1ccccc1F ZINC000163464304 331042543 /nfs/dbraw/zinc/04/25/43/331042543.db2.gz WPLJUBPNIBYPFU-ZWNOBZJWSA-N 1 0 297.826 5.343 10 0 CKAERO CC[C@H]([NH2+][C@@H](C)c1ccc(Cl)s1)c1cccc(F)c1 ZINC000166476690 331307339 /nfs/dbraw/zinc/30/73/39/331307339.db2.gz QCGAFIBVPASYKG-GWCFXTLKSA-N 1 0 297.826 5.343 10 0 CKAERO CC[C@@H]([NH2+][C@@H](C)c1ccc(Cl)s1)c1cccc(F)c1 ZINC000166476810 331307328 /nfs/dbraw/zinc/30/73/28/331307328.db2.gz QCGAFIBVPASYKG-GXFFZTMASA-N 1 0 297.826 5.343 10 0 CKAERO CC[C@H]([NH2+][C@H](C)c1ccc(Cl)s1)c1cccc(F)c1 ZINC000166476919 331307305 /nfs/dbraw/zinc/30/73/05/331307305.db2.gz QCGAFIBVPASYKG-MFKMUULPSA-N 1 0 297.826 5.343 10 0 CKAERO CC[C@@H]([NH2+][C@H](C)c1ccc(Cl)s1)c1cccc(F)c1 ZINC000166477038 331307282 /nfs/dbraw/zinc/30/72/82/331307282.db2.gz QCGAFIBVPASYKG-ZWNOBZJWSA-N 1 0 297.826 5.343 10 0 CKAERO CC[C@H]([NH2+][C@@H](CC)c1cccc(F)c1)c1ccccc1 ZINC000166569490 331307464 /nfs/dbraw/zinc/30/74/64/331307464.db2.gz KUROOTNTJSTATQ-ROUUACIJSA-N 1 0 271.379 5.018 10 0 CKAERO CC[C@@H]([NH2+][C@@H](CC)c1cccc(F)c1)c1ccccc1 ZINC000166569618 331307363 /nfs/dbraw/zinc/30/73/63/331307363.db2.gz KUROOTNTJSTATQ-MSOLQXFVSA-N 1 0 271.379 5.018 10 0 CKAERO CC[C@@H]([NH2+][C@@H](CC)c1ccccc1)c1cccc(F)c1 ZINC000166569728 331307376 /nfs/dbraw/zinc/30/73/76/331307376.db2.gz KUROOTNTJSTATQ-ZWKOTPCHSA-N 1 0 271.379 5.018 10 0 CKAERO CC[C@@H]([NH2+][C@H](CC)c1cccc(F)c1)c1ccccc1 ZINC000166569837 331307450 /nfs/dbraw/zinc/30/74/50/331307450.db2.gz KUROOTNTJSTATQ-QZTJIDSGSA-N 1 0 271.379 5.018 10 0 CKAERO Cc1nc(C(C)C)sc1[C@@H](C)[NH2+][C@@H](C)c1cccs1 ZINC000178174114 333068870 /nfs/dbraw/zinc/06/88/70/333068870.db2.gz NEJODPAOWNRHKQ-WDEREUQCSA-N 1 0 294.489 5.048 10 0 CKAERO Cc1nc(C(C)C)sc1[C@H](C)[NH2+][C@@H](C)c1cccs1 ZINC000178174128 333068936 /nfs/dbraw/zinc/06/89/36/333068936.db2.gz NEJODPAOWNRHKQ-QWRGUYRKSA-N 1 0 294.489 5.048 10 0 CKAERO Cc1nc(C(C)C)sc1[C@@H](C)[NH2+][C@H](C)c1cccs1 ZINC000178174140 333068894 /nfs/dbraw/zinc/06/88/94/333068894.db2.gz NEJODPAOWNRHKQ-GHMZBOCLSA-N 1 0 294.489 5.048 10 0 CKAERO Cc1nc(C(C)C)sc1[C@H](C)[NH2+][C@H](C)c1cccs1 ZINC000178174154 327085672 /nfs/dbraw/zinc/08/56/72/327085672.db2.gz NEJODPAOWNRHKQ-MNOVXSKESA-N 1 0 294.489 5.048 10 0 CKAERO CCC[C@@H]([NH2+][C@@H](C)c1cccs1)c1ccsc1 ZINC000191183851 529018501 /nfs/dbraw/zinc/01/85/01/529018501.db2.gz OWQJJCIAKBOCNY-WCQYABFASA-N 1 0 265.447 5.002 10 0 CKAERO CCC/C=C(\NC(=[NH2+])c1ccc(C)cc1)c1ccc(C)cc1 ZINC000216059748 189700430 /nfs/dbraw/zinc/70/04/30/189700430.db2.gz CXMTVZQQMACZDX-SWNXQHNESA-N 1 0 292.426 5.060 10 0 CKAERO Cc1ccccc1[C@@H](C)[NH2+][C@@H](C)c1csc(Cl)c1 ZINC000230406939 333317547 /nfs/dbraw/zinc/31/75/47/333317547.db2.gz IKLREBCABXQNGN-NWDGAFQWSA-N 1 0 279.836 5.122 10 0 CKAERO Cc1ccccc1[C@H](C)[NH2+][C@@H](C)c1csc(Cl)c1 ZINC000230406942 333317491 /nfs/dbraw/zinc/31/74/91/333317491.db2.gz IKLREBCABXQNGN-RYUDHWBXSA-N 1 0 279.836 5.122 10 0 CKAERO Cc1ccccc1[C@@H](C)[NH2+][C@H](C)c1csc(Cl)c1 ZINC000230406944 333317550 /nfs/dbraw/zinc/31/75/50/333317550.db2.gz IKLREBCABXQNGN-VXGBXAGGSA-N 1 0 279.836 5.122 10 0 CKAERO Cc1ccccc1[C@H](C)[NH2+][C@H](C)c1csc(Cl)c1 ZINC000230406947 333317540 /nfs/dbraw/zinc/31/75/40/333317540.db2.gz IKLREBCABXQNGN-NEPJUHHUSA-N 1 0 279.836 5.122 10 0 CKAERO CC[C@@H]([NH2+][C@@H](C)c1csc(Cl)c1)c1ccccc1 ZINC000230408953 333317809 /nfs/dbraw/zinc/31/78/09/333317809.db2.gz QXGXVICFUVMMBI-SMDDNHRTSA-N 1 0 279.836 5.203 10 0 CKAERO CC[C@H]([NH2+][C@@H](C)c1csc(Cl)c1)c1ccccc1 ZINC000230408957 333317870 /nfs/dbraw/zinc/31/78/70/333317870.db2.gz QXGXVICFUVMMBI-FZMZJTMJSA-N 1 0 279.836 5.203 10 0 CKAERO CC[C@@H]([NH2+][C@H](C)c1csc(Cl)c1)c1ccccc1 ZINC000230408961 333317872 /nfs/dbraw/zinc/31/78/72/333317872.db2.gz QXGXVICFUVMMBI-BXUZGUMPSA-N 1 0 279.836 5.203 10 0 CKAERO CC[C@H]([NH2+][C@H](C)c1csc(Cl)c1)c1ccccc1 ZINC000230408963 333317817 /nfs/dbraw/zinc/31/78/17/333317817.db2.gz QXGXVICFUVMMBI-RISCZKNCSA-N 1 0 279.836 5.203 10 0 CKAERO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2csc(Cl)c2)cc1F ZINC000230410431 333318305 /nfs/dbraw/zinc/31/83/05/333318305.db2.gz BJTGGKYUIMETKO-MNOVXSKESA-N 1 0 297.826 5.261 10 0 CKAERO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2csc(Cl)c2)cc1F ZINC000230410435 333318217 /nfs/dbraw/zinc/31/82/17/333318217.db2.gz BJTGGKYUIMETKO-QWRGUYRKSA-N 1 0 297.826 5.261 10 0 CKAERO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2csc(Cl)c2)cc1F ZINC000230410438 333318289 /nfs/dbraw/zinc/31/82/89/333318289.db2.gz BJTGGKYUIMETKO-GHMZBOCLSA-N 1 0 297.826 5.261 10 0 CKAERO Cc1ccc([C@H](C)[NH2+][C@H](C)c2csc(Cl)c2)cc1F ZINC000230410441 333318327 /nfs/dbraw/zinc/31/83/27/333318327.db2.gz BJTGGKYUIMETKO-WDEREUQCSA-N 1 0 297.826 5.261 10 0 CKAERO Cc1sccc1C[NH2+][C@H](C)c1ccc(C(C)C)cc1 ZINC000312060859 333076094 /nfs/dbraw/zinc/07/60/94/333076094.db2.gz IBPUDJGLMITWHC-CYBMUJFWSA-N 1 0 273.445 5.031 10 0 CKAERO Cc1sccc1C[NH2+][C@@H](C)c1ccc(C(C)C)cc1 ZINC000312060860 333075934 /nfs/dbraw/zinc/07/59/34/333075934.db2.gz IBPUDJGLMITWHC-ZDUSSCGKSA-N 1 0 273.445 5.031 10 0 CKAERO Cc1cc(C[NH2+][C@@H](C)c2ccc(C(C)C)cc2)cs1 ZINC000328562983 333535089 /nfs/dbraw/zinc/53/50/89/333535089.db2.gz IREZOZWGSZWRBS-AWEZNQCLSA-N 1 0 273.445 5.031 10 0 CKAERO Cc1cc(C[NH2+][C@H](C)c2ccc(C(C)C)cc2)cs1 ZINC000328562984 333535145 /nfs/dbraw/zinc/53/51/45/333535145.db2.gz IREZOZWGSZWRBS-CQSZACIVSA-N 1 0 273.445 5.031 10 0 CKAERO Cc1cc(C[NH2+][C@@H](C)c2ccc3ccccc3c2)cs1 ZINC000381293205 336058414 /nfs/dbraw/zinc/05/84/14/336058414.db2.gz OGXRODUSHFSBAU-AWEZNQCLSA-N 1 0 281.424 5.061 10 0 CKAERO Cc1cc(C[NH2+][C@H](C)c2ccc3ccccc3c2)cs1 ZINC000381293206 336058271 /nfs/dbraw/zinc/05/82/71/336058271.db2.gz OGXRODUSHFSBAU-CQSZACIVSA-N 1 0 281.424 5.061 10 0 CKAERO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2cccc(Cl)c2)cs1 ZINC000381462725 336064872 /nfs/dbraw/zinc/06/48/72/336064872.db2.gz JIHCSQUBZWOYBP-NWDGAFQWSA-N 1 0 279.836 5.122 10 0 CKAERO Cc1cc([C@H](C)[NH2+][C@@H](C)c2cccc(Cl)c2)cs1 ZINC000381462727 336064997 /nfs/dbraw/zinc/06/49/97/336064997.db2.gz JIHCSQUBZWOYBP-RYUDHWBXSA-N 1 0 279.836 5.122 10 0 CKAERO CCc1ccc([C@H](C)[NH2+][C@@H](C)c2csc(C)c2)cc1 ZINC000381697229 336070997 /nfs/dbraw/zinc/07/09/97/336070997.db2.gz GJQYSPLALLIQFT-KBPBESRZSA-N 1 0 273.445 5.031 10 0 CKAERO CCc1ccc([C@@H](C)[NH2+][C@@H](C)c2csc(C)c2)cc1 ZINC000381697230 336071166 /nfs/dbraw/zinc/07/11/66/336071166.db2.gz GJQYSPLALLIQFT-KGLIPLIRSA-N 1 0 273.445 5.031 10 0 CKAERO CCc1ccc([C@H](C)[NH2+][C@H](C)c2csc(C)c2)cc1 ZINC000381697231 336071214 /nfs/dbraw/zinc/07/12/14/336071214.db2.gz GJQYSPLALLIQFT-UONOGXRCSA-N 1 0 273.445 5.031 10 0 CKAERO Cc1cc([C@H](C)[NH2+][C@H](C)c2ccc(C(C)C)cc2)cs1 ZINC000381703798 336071208 /nfs/dbraw/zinc/07/12/08/336071208.db2.gz HJXKNENGRYEJSB-CABCVRRESA-N 1 0 287.472 5.592 10 0 CKAERO Cc1cc([C@H](C)[NH2+][C@@H](C)c2ccc(C(C)C)cc2)cs1 ZINC000381703805 336071107 /nfs/dbraw/zinc/07/11/07/336071107.db2.gz HJXKNENGRYEJSB-GJZGRUSLSA-N 1 0 287.472 5.592 10 0 CKAERO Cc1cc([C@@H](C)[NH2+][C@H](C)c2ccc(C(C)C)cc2)cs1 ZINC000381703812 336071273 /nfs/dbraw/zinc/07/12/73/336071273.db2.gz HJXKNENGRYEJSB-HUUCEWRRSA-N 1 0 287.472 5.592 10 0 CKAERO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2ccc(C(C)C)cc2)cs1 ZINC000381703816 336071347 /nfs/dbraw/zinc/07/13/47/336071347.db2.gz HJXKNENGRYEJSB-LSDHHAIUSA-N 1 0 287.472 5.592 10 0 CKAERO Cc1cc([C@@H](C)[NH2+][C@H](C)c2ccc(Cl)s2)cs1 ZINC000381704774 327738295 /nfs/dbraw/zinc/73/82/95/327738295.db2.gz HPWRCYJLZDJPPA-NXEZZACHSA-N 1 0 285.865 5.183 10 0 CKAERO Cc1cc([C@H](C)[NH2+][C@@H](C)c2ccc(Cl)s2)cs1 ZINC000381704778 336071413 /nfs/dbraw/zinc/07/14/13/336071413.db2.gz HPWRCYJLZDJPPA-UWVGGRQHSA-N 1 0 285.865 5.183 10 0 CKAERO Cc1cc([C@H](C)[NH2+][C@H](C)c2ccc(Cl)s2)cs1 ZINC000381705146 336071364 /nfs/dbraw/zinc/07/13/64/336071364.db2.gz HPWRCYJLZDJPPA-VHSXEESVSA-N 1 0 285.865 5.183 10 0 CKAERO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2ccc(Cl)s2)cs1 ZINC000381705147 327738209 /nfs/dbraw/zinc/73/82/09/327738209.db2.gz HPWRCYJLZDJPPA-ZJUUUORDSA-N 1 0 285.865 5.183 10 0 CKAERO Cc1cc([C@@H](C)[NH2+][C@@H](C)c2ccc(C)cc2C)cs1 ZINC000381816353 336073710 /nfs/dbraw/zinc/07/37/10/336073710.db2.gz VYPURCBTSCFXRK-CABCVRRESA-N 1 0 273.445 5.085 10 0 CKAERO Cc1cc([C@H](C)[NH2+][C@@H](C)c2ccc(C)cc2C)cs1 ZINC000381816358 336073543 /nfs/dbraw/zinc/07/35/43/336073543.db2.gz VYPURCBTSCFXRK-GJZGRUSLSA-N 1 0 273.445 5.085 10 0 CKAERO Cc1cc([C@@H](C)[NH2+][C@H](C)c2ccc(C)cc2C)cs1 ZINC000381816364 336073513 /nfs/dbraw/zinc/07/35/13/336073513.db2.gz VYPURCBTSCFXRK-HUUCEWRRSA-N 1 0 273.445 5.085 10 0 CKAERO Cc1cc([C@H](C)[NH2+][C@H](C)c2ccc(C)cc2C)cs1 ZINC000381816369 336073657 /nfs/dbraw/zinc/07/36/57/336073657.db2.gz VYPURCBTSCFXRK-LSDHHAIUSA-N 1 0 273.445 5.085 10 0 CKAERO CC[C@H]([NH2+][C@@H](C)c1ccc(C(C)C)cc1)c1ccsc1 ZINC000382081097 336081411 /nfs/dbraw/zinc/08/14/11/336081411.db2.gz FIIKEINZNSMURD-KSSFIOAISA-N 1 0 287.472 5.673 10 0 CKAERO CC[C@@H]([NH2+][C@H](C)c1ccc(C(C)C)cc1)c1ccsc1 ZINC000382081098 336081439 /nfs/dbraw/zinc/08/14/39/336081439.db2.gz FIIKEINZNSMURD-RDTXWAMCSA-N 1 0 287.472 5.673 10 0 CKAERO CC[C@H]([NH2+][C@H](C)c1ccc(C)cc1C)c1ccsc1 ZINC000382132856 336082718 /nfs/dbraw/zinc/08/27/18/336082718.db2.gz PBPDCGIUECWQDV-PBHICJAKSA-N 1 0 273.445 5.167 10 0 CKAERO CC[C@@H]([NH2+][C@H](C)c1ccc(C)cc1C)c1ccsc1 ZINC000382133107 336082622 /nfs/dbraw/zinc/08/26/22/336082622.db2.gz PBPDCGIUECWQDV-RHSMWYFYSA-N 1 0 273.445 5.167 10 0 CKAERO CC[C@@H]([NH2+][C@@H](C)c1ccc(C)cc1C)c1ccsc1 ZINC000382133108 336082460 /nfs/dbraw/zinc/08/24/60/336082460.db2.gz PBPDCGIUECWQDV-WMLDXEAASA-N 1 0 273.445 5.167 10 0 CKAERO CC[C@H]([NH2+][C@@H](C)c1ccc(C)cc1C)c1ccsc1 ZINC000382133109 336082726 /nfs/dbraw/zinc/08/27/26/336082726.db2.gz PBPDCGIUECWQDV-YOEHRIQHSA-N 1 0 273.445 5.167 10 0 CKAERO CC[C@H]([NH2+][C@@H](C)c1cccc(Cl)c1)c1ccsc1 ZINC000382140167 336083018 /nfs/dbraw/zinc/08/30/18/336083018.db2.gz QLAKWWRMOKXAHR-NHYWBVRUSA-N 1 0 279.836 5.203 10 0 CKAERO CC[C@@H]([NH2+][C@@H](C)c1cccc(Cl)c1)c1ccsc1 ZINC000382140173 336082765 /nfs/dbraw/zinc/08/27/65/336082765.db2.gz QLAKWWRMOKXAHR-XHDPSFHLSA-N 1 0 279.836 5.203 10 0 CKAERO CC[C@@H]([NH2+][C@@H](C)c1ccc(Cl)s1)c1ccsc1 ZINC000382171423 327845127 /nfs/dbraw/zinc/84/51/27/327845127.db2.gz WGAFORITYGADHD-GXSJLCMTSA-N 1 0 285.865 5.265 10 0 CKAERO CCc1ccc([C@@H](C)[NH2+][C@H](CC)c2ccsc2)cc1 ZINC000382171467 336083795 /nfs/dbraw/zinc/08/37/95/336083795.db2.gz WGUAWTRXQNSQCA-CXAGYDPISA-N 1 0 273.445 5.112 10 0 CKAERO CCc1ccc([C@@H](C)[NH2+][C@@H](CC)c2ccsc2)cc1 ZINC000382171469 336083737 /nfs/dbraw/zinc/08/37/37/336083737.db2.gz WGUAWTRXQNSQCA-DYVFJYSZSA-N 1 0 273.445 5.112 10 0 CKAERO CCc1ccc([C@H](C)[NH2+][C@@H](CC)c2ccsc2)cc1 ZINC000382171471 336083809 /nfs/dbraw/zinc/08/38/09/336083809.db2.gz WGUAWTRXQNSQCA-GUYCJALGSA-N 1 0 273.445 5.112 10 0 CKAERO CCc1ccc([C@H](C)[NH2+][C@H](CC)c2ccsc2)cc1 ZINC000382171473 336083915 /nfs/dbraw/zinc/08/39/15/336083915.db2.gz WGUAWTRXQNSQCA-SUMWQHHRSA-N 1 0 273.445 5.112 10 0 CKAERO CCCCC[C@H]([NH3+])c1cc(Cl)cc(Cl)c1Cl ZINC000396689667 567016065 /nfs/dbraw/zinc/01/60/65/567016065.db2.gz AXCGPGVTUWIXCD-NSHDSACASA-N 1 0 280.626 5.227 10 0 CKAERO CCC(C)(C)C1CCC2(CC1)[NH2+][C@H](C)Cc1ccsc12 ZINC000584883880 566934761 /nfs/dbraw/zinc/93/47/61/566934761.db2.gz UVEGYLUMNSXZKF-MJJDPTRDSA-N 1 0 291.504 5.104 10 0 CKAERO CCC(C)(C)C1CCC2(CC1)[NH2+][C@@H](C)Cc1ccsc12 ZINC000584883881 566936739 /nfs/dbraw/zinc/93/67/39/566936739.db2.gz UVEGYLUMNSXZKF-UQHVZDHRSA-N 1 0 291.504 5.104 10 0 CKAERO