smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[C@@H](N[C@@H](C)c1ccc(F)cc1F)c1ccc(Cl)cc1 ZINC000020000650 170965719 /nfs/dbraw/zinc/96/57/19/170965719.db2.gz GDADFBKJGBIWTL-MNOVXSKESA-N 0 1 295.760 5.030 20 0 CKADMN Cc1ccccc1[C@H](C)N[C@H](C)c1nc2ccccc2s1 ZINC000020126272 171010483 /nfs/dbraw/zinc/01/04/83/171010483.db2.gz DAKSLMCYHGEKKQ-UONOGXRCSA-N 0 1 296.439 5.017 20 0 CKADMN Cc1ccccc1[C@H](C)N[C@@H](C)c1nc2ccccc2s1 ZINC000020126273 171010704 /nfs/dbraw/zinc/01/07/04/171010704.db2.gz DAKSLMCYHGEKKQ-KBPBESRZSA-N 0 1 296.439 5.017 20 0 CKADMN Cc1ccccc1[C@@H](C)N[C@H](C)c1nc2ccccc2s1 ZINC000020126274 171010443 /nfs/dbraw/zinc/01/04/43/171010443.db2.gz DAKSLMCYHGEKKQ-ZIAGYGMSSA-N 0 1 296.439 5.017 20 0 CKADMN Cc1ccccc1[C@@H](C)N[C@@H](C)c1nc2ccccc2s1 ZINC000020126275 171010698 /nfs/dbraw/zinc/01/06/98/171010698.db2.gz DAKSLMCYHGEKKQ-KGLIPLIRSA-N 0 1 296.439 5.017 20 0 CKADMN Cc1ccccc1[C@@H](C)N[C@@H](C)c1ccccc1Cl ZINC000020552942 171248083 /nfs/dbraw/zinc/24/80/83/171248083.db2.gz RNHLRXSMHRSPTF-KGLIPLIRSA-N 0 1 273.807 5.060 20 0 CKADMN Cc1ccccc1[C@H](C)N[C@@H](C)c1ccccc1Cl ZINC000020552943 171248333 /nfs/dbraw/zinc/24/83/33/171248333.db2.gz RNHLRXSMHRSPTF-KBPBESRZSA-N 0 1 273.807 5.060 20 0 CKADMN Cc1ccccc1[C@@H](C)N[C@H](C)c1ccccc1Cl ZINC000020552944 171248112 /nfs/dbraw/zinc/24/81/12/171248112.db2.gz RNHLRXSMHRSPTF-ZIAGYGMSSA-N 0 1 273.807 5.060 20 0 CKADMN Cc1ccccc1[C@H](C)N[C@H](C)c1ccccc1Cl ZINC000020552945 171248421 /nfs/dbraw/zinc/24/84/21/171248421.db2.gz RNHLRXSMHRSPTF-UONOGXRCSA-N 0 1 273.807 5.060 20 0 CKADMN C[C@@H](N[C@@H](C)c1ccc(F)cc1F)c1cccc(Cl)c1 ZINC000020559749 171251554 /nfs/dbraw/zinc/25/15/54/171251554.db2.gz FCWZCRJWDJNFAI-MNOVXSKESA-N 0 1 295.760 5.030 20 0 CKADMN C[C@H](N[C@@H](C)c1ccc(F)cc1F)c1cccc(Cl)c1 ZINC000020559751 171251537 /nfs/dbraw/zinc/25/15/37/171251537.db2.gz FCWZCRJWDJNFAI-QWRGUYRKSA-N 0 1 295.760 5.030 20 0 CKADMN C[C@@H](N[C@H](C)c1ccc(F)cc1F)c1cccc(Cl)c1 ZINC000020559753 171251643 /nfs/dbraw/zinc/25/16/43/171251643.db2.gz FCWZCRJWDJNFAI-GHMZBOCLSA-N 0 1 295.760 5.030 20 0 CKADMN C[C@@H](N[C@@H](C)c1cccc(Cl)c1)c1ccc(F)cc1F ZINC000020559755 171251495 /nfs/dbraw/zinc/25/14/95/171251495.db2.gz FCWZCRJWDJNFAI-WDEREUQCSA-N 0 1 295.760 5.030 20 0 CKADMN C[C@@H](N[C@@H](C)c1ccccc1Cl)c1ccc(F)c(F)c1 ZINC000021020860 262373745 /nfs/dbraw/zinc/37/37/45/262373745.db2.gz APCZNGCRZIFUMQ-MNOVXSKESA-N 0 1 295.760 5.030 20 0 CKADMN C[C@H](N[C@@H](C)c1ccccc1Cl)c1ccc(F)c(F)c1 ZINC000021020863 262373727 /nfs/dbraw/zinc/37/37/27/262373727.db2.gz APCZNGCRZIFUMQ-QWRGUYRKSA-N 0 1 295.760 5.030 20 0 CKADMN C[C@@H](N[C@H](C)c1ccccc1Cl)c1ccc(F)c(F)c1 ZINC000021020867 262373616 /nfs/dbraw/zinc/37/36/16/262373616.db2.gz APCZNGCRZIFUMQ-GHMZBOCLSA-N 0 1 295.760 5.030 20 0 CKADMN C[C@@H](N[C@@H](C)c1ccc(F)c(F)c1)c1ccccc1Cl ZINC000021020870 262374094 /nfs/dbraw/zinc/37/40/94/262374094.db2.gz APCZNGCRZIFUMQ-WDEREUQCSA-N 0 1 295.760 5.030 20 0 CKADMN Cc1ccc([C@@H](C)N[C@@H](C)c2ccccc2Cl)cc1 ZINC000021059258 171296473 /nfs/dbraw/zinc/29/64/73/171296473.db2.gz LWBKUXAAQXJJEH-KGLIPLIRSA-N 0 1 273.807 5.060 20 0 CKADMN Cc1ccc([C@H](C)N[C@@H](C)c2ccccc2Cl)cc1 ZINC000021059261 171296775 /nfs/dbraw/zinc/29/67/75/171296775.db2.gz LWBKUXAAQXJJEH-KBPBESRZSA-N 0 1 273.807 5.060 20 0 CKADMN Cc1ccc([C@@H](C)N[C@H](C)c2ccccc2Cl)cc1 ZINC000021059264 171296754 /nfs/dbraw/zinc/29/67/54/171296754.db2.gz LWBKUXAAQXJJEH-ZIAGYGMSSA-N 0 1 273.807 5.060 20 0 CKADMN Cc1ccc([C@H](C)N[C@H](C)c2ccccc2Cl)cc1 ZINC000021059268 171296865 /nfs/dbraw/zinc/29/68/65/171296865.db2.gz LWBKUXAAQXJJEH-UONOGXRCSA-N 0 1 273.807 5.060 20 0 CKADMN CC[C@@H](NCc1ccccc1Cl)c1ccc(Cl)cc1 ZINC000021515274 171311887 /nfs/dbraw/zinc/31/18/87/171311887.db2.gz WCCKLMWFXYNFHW-MRXNPFEDSA-N 0 1 294.225 5.234 20 0 CKADMN CC[C@H](NCc1ccccc1Cl)c1ccc(Cl)cc1 ZINC000021515276 171312065 /nfs/dbraw/zinc/31/20/65/171312065.db2.gz WCCKLMWFXYNFHW-INIZCTEOSA-N 0 1 294.225 5.234 20 0 CKADMN CC[C@@H](NCc1ccccc1Cl)c1cccc(Cl)c1 ZINC000021818679 171333800 /nfs/dbraw/zinc/33/38/00/171333800.db2.gz YZWKWXVOBZIRJE-MRXNPFEDSA-N 0 1 294.225 5.234 20 0 CKADMN CC[C@H](NCc1ccccc1Cl)c1cccc(Cl)c1 ZINC000021818681 171333670 /nfs/dbraw/zinc/33/36/70/171333670.db2.gz YZWKWXVOBZIRJE-INIZCTEOSA-N 0 1 294.225 5.234 20 0 CKADMN C[C@H](NCc1cc2ccccc2o1)c1cc2ccccc2o1 ZINC000026313405 333413732 /nfs/dbraw/zinc/41/37/32/333413732.db2.gz ZBCCHFYTBLRHPM-ZDUSSCGKSA-N 0 1 291.350 5.030 20 0 CKADMN Cc1nc([C@@H](C)N[C@@H](C)c2cccc3ccccc32)cs1 ZINC000036915343 527032491 /nfs/dbraw/zinc/03/24/91/527032491.db2.gz IYHIFTFVVLRKEX-QWHCGFSZSA-N 0 1 296.439 5.017 20 0 CKADMN Cc1nc([C@H](C)N[C@@H](C)c2cccc3ccccc32)cs1 ZINC000036915344 527065977 /nfs/dbraw/zinc/06/59/77/527065977.db2.gz IYHIFTFVVLRKEX-STQMWFEESA-N 0 1 296.439 5.017 20 0 CKADMN Cc1nc([C@@H](C)N[C@H](C)c2cccc3ccccc32)cs1 ZINC000036915345 527033830 /nfs/dbraw/zinc/03/38/30/527033830.db2.gz IYHIFTFVVLRKEX-CHWSQXEVSA-N 0 1 296.439 5.017 20 0 CKADMN Cc1nc([C@H](C)N[C@H](C)c2cccc3ccccc32)cs1 ZINC000036915346 527067778 /nfs/dbraw/zinc/06/77/78/527067778.db2.gz IYHIFTFVVLRKEX-OLZOCXBDSA-N 0 1 296.439 5.017 20 0 CKADMN CC[C@H](N[C@@H](C)c1ccc(C)o1)c1cccc(Cl)c1 ZINC000036921485 330313809 /nfs/dbraw/zinc/31/38/09/330313809.db2.gz ZQNHFXNPZDGCNF-WFASDCNBSA-N 0 1 277.795 5.043 20 0 CKADMN CC[C@@H](N[C@@H](C)c1ccc(C)o1)c1cccc(Cl)c1 ZINC000036921486 330313906 /nfs/dbraw/zinc/31/39/06/330313906.db2.gz ZQNHFXNPZDGCNF-SWLSCSKDSA-N 0 1 277.795 5.043 20 0 CKADMN CC[C@H](N[C@H](C)c1ccc(C)o1)c1cccc(Cl)c1 ZINC000036921487 330313789 /nfs/dbraw/zinc/31/37/89/330313789.db2.gz ZQNHFXNPZDGCNF-DOMZBBRYSA-N 0 1 277.795 5.043 20 0 CKADMN CC[C@@H](N[C@H](C)c1ccc(C)o1)c1cccc(Cl)c1 ZINC000036921488 330313852 /nfs/dbraw/zinc/31/38/52/330313852.db2.gz ZQNHFXNPZDGCNF-IUODEOHRSA-N 0 1 277.795 5.043 20 0 CKADMN Cc1cc([C@@H](C)N[C@@H](C)c2cc(F)ccc2F)c(C)s1 ZINC000036921781 330313868 /nfs/dbraw/zinc/31/38/68/330313868.db2.gz ISVBRUZLNHTXNJ-MNOVXSKESA-N 0 1 295.398 5.055 20 0 CKADMN Cc1cc([C@H](C)N[C@@H](C)c2cc(F)ccc2F)c(C)s1 ZINC000036921782 330313784 /nfs/dbraw/zinc/31/37/84/330313784.db2.gz ISVBRUZLNHTXNJ-QWRGUYRKSA-N 0 1 295.398 5.055 20 0 CKADMN Cc1cc([C@@H](C)N[C@H](C)c2cc(F)ccc2F)c(C)s1 ZINC000036921783 330313818 /nfs/dbraw/zinc/31/38/18/330313818.db2.gz ISVBRUZLNHTXNJ-GHMZBOCLSA-N 0 1 295.398 5.055 20 0 CKADMN Cc1cc([C@H](C)N[C@H](C)c2cc(F)ccc2F)c(C)s1 ZINC000036921784 330313800 /nfs/dbraw/zinc/31/38/00/330313800.db2.gz ISVBRUZLNHTXNJ-WDEREUQCSA-N 0 1 295.398 5.055 20 0 CKADMN Cc1cc([C@@H](C)N[C@@H](C)c2ccc(F)cc2F)c(C)s1 ZINC000036952689 330322484 /nfs/dbraw/zinc/32/24/84/330322484.db2.gz XSAQZUQOFUQLFV-WDEREUQCSA-N 0 1 295.398 5.055 20 0 CKADMN Cc1cc([C@H](C)N[C@@H](C)c2ccc(F)cc2F)c(C)s1 ZINC000036952690 330322474 /nfs/dbraw/zinc/32/24/74/330322474.db2.gz XSAQZUQOFUQLFV-QWRGUYRKSA-N 0 1 295.398 5.055 20 0 CKADMN Cc1cc([C@@H](C)N[C@H](C)c2ccc(F)cc2F)c(C)s1 ZINC000036952691 330322391 /nfs/dbraw/zinc/32/23/91/330322391.db2.gz XSAQZUQOFUQLFV-GHMZBOCLSA-N 0 1 295.398 5.055 20 0 CKADMN Cc1cc([C@H](C)N[C@H](C)c2ccc(F)cc2F)c(C)s1 ZINC000036952692 330322354 /nfs/dbraw/zinc/32/23/54/330322354.db2.gz XSAQZUQOFUQLFV-MNOVXSKESA-N 0 1 295.398 5.055 20 0 CKADMN Cc1ccc([C@@H](C)N[C@@H](C)c2ccccc2C(F)(F)F)o1 ZINC000036960021 326885686 /nfs/dbraw/zinc/88/56/86/326885686.db2.gz XMYBKBRAUPNNOC-NWDGAFQWSA-N 0 1 297.320 5.019 20 0 CKADMN Cc1ccc([C@@H](C)N[C@@H](C)c2cccc(C(F)(F)F)c2)o1 ZINC000036960327 326894518 /nfs/dbraw/zinc/89/45/18/326894518.db2.gz RLOBZJIUFSDIGM-NWDGAFQWSA-N 0 1 297.320 5.019 20 0 CKADMN Cc1ccc([C@H](C)N[C@H](C)c2cccc(C(F)(F)F)c2)o1 ZINC000036960333 326894932 /nfs/dbraw/zinc/89/49/32/326894932.db2.gz RLOBZJIUFSDIGM-NEPJUHHUSA-N 0 1 297.320 5.019 20 0 CKADMN CC[C@@H](N[C@@H](C)c1ccc(C)o1)c1ccc(Cl)cc1 ZINC000036960350 326896694 /nfs/dbraw/zinc/89/66/94/326896694.db2.gz JCVVHRFLRBOURK-SWLSCSKDSA-N 0 1 277.795 5.043 20 0 CKADMN Cc1cc([C@@H](C)N[C@@H](C)c2cc3ccccc3o2)c(C)o1 ZINC000037070937 333472175 /nfs/dbraw/zinc/47/21/75/333472175.db2.gz INYZERLTGPQVFZ-OLZOCXBDSA-N 0 1 283.371 5.054 20 0 CKADMN C[C@H](NC(c1cccs1)c1cccs1)c1ccccc1 ZINC000037185853 333509956 /nfs/dbraw/zinc/50/99/56/333509956.db2.gz PZVNNMGWOCVKSJ-ZDUSSCGKSA-N 0 1 299.464 5.250 20 0 CKADMN C[C@H](N[C@@H](CC(F)(F)F)c1ccccc1)c1ccccc1 ZINC000037185943 333510211 /nfs/dbraw/zinc/51/02/11/333510211.db2.gz MAKICKBUTUMWMI-BBRMVZONSA-N 0 1 293.332 5.031 20 0 CKADMN C[C@@H](N[C@@H](CC(F)(F)F)c1ccccc1)c1ccccc1 ZINC000037185944 333510171 /nfs/dbraw/zinc/51/01/71/333510171.db2.gz MAKICKBUTUMWMI-CJNGLKHVSA-N 0 1 293.332 5.031 20 0 CKADMN C[C@@H](N[C@H](CC(F)(F)F)c1ccccc1)c1ccccc1 ZINC000037185946 333510208 /nfs/dbraw/zinc/51/02/08/333510208.db2.gz MAKICKBUTUMWMI-CZUORRHYSA-N 0 1 293.332 5.031 20 0 CKADMN C[C@H](N[C@@H](C)c1ccc(F)cc1Cl)c1ccc(F)cc1 ZINC000037217379 333515963 /nfs/dbraw/zinc/51/59/63/333515963.db2.gz LWSIXLBPKVWZLI-QWRGUYRKSA-N 0 1 295.760 5.030 20 0 CKADMN Cc1cccc([C@@H](C)N[C@@H](C)c2ccccc2Cl)c1 ZINC000037219121 173036634 /nfs/dbraw/zinc/03/66/34/173036634.db2.gz VNANSCPSNRCGCP-KGLIPLIRSA-N 0 1 273.807 5.060 20 0 CKADMN Cc1cccc([C@H](C)N[C@@H](C)c2ccccc2Cl)c1 ZINC000037219122 173036916 /nfs/dbraw/zinc/03/69/16/173036916.db2.gz VNANSCPSNRCGCP-KBPBESRZSA-N 0 1 273.807 5.060 20 0 CKADMN Cc1cccc([C@@H](C)N[C@H](C)c2ccccc2Cl)c1 ZINC000037219123 173036698 /nfs/dbraw/zinc/03/66/98/173036698.db2.gz VNANSCPSNRCGCP-ZIAGYGMSSA-N 0 1 273.807 5.060 20 0 CKADMN Cc1cccc([C@H](C)N[C@H](C)c2ccccc2Cl)c1 ZINC000037219124 173036925 /nfs/dbraw/zinc/03/69/25/173036925.db2.gz VNANSCPSNRCGCP-UONOGXRCSA-N 0 1 273.807 5.060 20 0 CKADMN Cc1ccc([C@H](C)N[C@@H](c2ccc(Cl)cc2)C2CC2)o1 ZINC000037280671 333530497 /nfs/dbraw/zinc/53/04/97/333530497.db2.gz QEYBGBZQHVZXMY-YVEFUNNKSA-N 0 1 289.806 5.043 20 0 CKADMN Cc1ccc([C@@H](C)N[C@H](c2ccc(Cl)cc2)C2CC2)o1 ZINC000037280673 333530513 /nfs/dbraw/zinc/53/05/13/333530513.db2.gz QEYBGBZQHVZXMY-PXAZEXFGSA-N 0 1 289.806 5.043 20 0 CKADMN Cc1ccc([C@H](C)N[C@H](c2ccc(Cl)cc2)C2CC2)o1 ZINC000037280675 333530443 /nfs/dbraw/zinc/53/04/43/333530443.db2.gz QEYBGBZQHVZXMY-SJCJKPOMSA-N 0 1 289.806 5.043 20 0 CKADMN Cc1ccc([C@@H](C)N[C@@H](C)c2ccc(C(F)(F)F)cc2)o1 ZINC000037413461 333532840 /nfs/dbraw/zinc/53/28/40/333532840.db2.gz YIKNMYSRCLJXQT-NWDGAFQWSA-N 0 1 297.320 5.019 20 0 CKADMN CC(C)[C@H](NCc1ccc(Cl)o1)c1ccc(Cl)cc1 ZINC000037489538 326853782 /nfs/dbraw/zinc/85/37/82/326853782.db2.gz MCKXYKYPASJABU-HNNXBMFYSA-N 0 1 298.213 5.073 20 0 CKADMN CC(C)[C@H](N[C@@H](C)c1c(F)cccc1F)c1ccccc1 ZINC000037508196 333534243 /nfs/dbraw/zinc/53/42/43/333534243.db2.gz TUSAOBLLHKCGRR-UGSOOPFHSA-N 0 1 289.369 5.013 20 0 CKADMN CC(C)[C@H](N[C@H](C)c1c(F)cccc1F)c1ccccc1 ZINC000037508198 333534728 /nfs/dbraw/zinc/53/47/28/333534728.db2.gz TUSAOBLLHKCGRR-ACJLOTCBSA-N 0 1 289.369 5.013 20 0 CKADMN CC(C)[C@@H](N[C@H](C)c1c(F)cccc1F)c1ccccc1 ZINC000037508199 333534519 /nfs/dbraw/zinc/53/45/19/333534519.db2.gz TUSAOBLLHKCGRR-FZKQIMNGSA-N 0 1 289.369 5.013 20 0 CKADMN C[C@@H](N[C@@H](C)c1ccc(F)c(Cl)c1)c1ccccc1F ZINC000037764677 333538197 /nfs/dbraw/zinc/53/81/97/333538197.db2.gz DPIAIQHPEQBVOE-WDEREUQCSA-N 0 1 295.760 5.030 20 0 CKADMN C[C@@H](N[C@H](C)c1ccccc1F)c1ccc(F)c(Cl)c1 ZINC000037764678 333538194 /nfs/dbraw/zinc/53/81/94/333538194.db2.gz DPIAIQHPEQBVOE-GHMZBOCLSA-N 0 1 295.760 5.030 20 0 CKADMN CCc1ccc([C@@H](C)N[C@@H](C)c2ccc(F)cc2F)s1 ZINC000041203633 328030030 /nfs/dbraw/zinc/03/00/30/328030030.db2.gz UMHBBAVQNHHNPJ-WDEREUQCSA-N 0 1 295.398 5.001 20 0 CKADMN CCc1ccc([C@H](C)N[C@@H](C)c2ccc(F)cc2F)s1 ZINC000041203636 328030217 /nfs/dbraw/zinc/03/02/17/328030217.db2.gz UMHBBAVQNHHNPJ-QWRGUYRKSA-N 0 1 295.398 5.001 20 0 CKADMN CCc1ccc([C@@H](C)N[C@H](C)c2ccc(F)cc2F)s1 ZINC000041203639 328030060 /nfs/dbraw/zinc/03/00/60/328030060.db2.gz UMHBBAVQNHHNPJ-GHMZBOCLSA-N 0 1 295.398 5.001 20 0 CKADMN CCc1ccc([C@H](C)N[C@H](C)c2ccc(F)cc2F)s1 ZINC000041203642 328030004 /nfs/dbraw/zinc/03/00/04/328030004.db2.gz UMHBBAVQNHHNPJ-MNOVXSKESA-N 0 1 295.398 5.001 20 0 CKADMN CCc1ccc([C@@H](C)N[C@H](C)c2c(F)cccc2F)s1 ZINC000041631791 328712843 /nfs/dbraw/zinc/71/28/43/328712843.db2.gz IQJACLFYCNVNNY-GHMZBOCLSA-N 0 1 295.398 5.001 20 0 CKADMN Cc1cc([C@@H](C)NCc2ccc(Cl)c(Cl)c2)c(C)o1 ZINC000044729278 330331305 /nfs/dbraw/zinc/33/13/05/330331305.db2.gz JYTZAHRIZLXUFM-SNVBAGLBSA-N 0 1 298.213 5.054 20 0 CKADMN Cc1cc([C@H](C)NCc2ccc(Cl)c(Cl)c2)c(C)o1 ZINC000044729279 330331218 /nfs/dbraw/zinc/33/12/18/330331218.db2.gz JYTZAHRIZLXUFM-JTQLQIEISA-N 0 1 298.213 5.054 20 0 CKADMN Cc1cc([C@@H](C)N[C@@H](C)c2ccc(F)c(Cl)c2)c(C)o1 ZINC000044729504 330331176 /nfs/dbraw/zinc/33/11/76/330331176.db2.gz KJNDOQPPETXMAC-WDEREUQCSA-N 0 1 295.785 5.101 20 0 CKADMN Cc1cc([C@H](C)N[C@@H](C)c2ccc(F)c(Cl)c2)c(C)o1 ZINC000044729505 330331320 /nfs/dbraw/zinc/33/13/20/330331320.db2.gz KJNDOQPPETXMAC-QWRGUYRKSA-N 0 1 295.785 5.101 20 0 CKADMN Cc1cc([C@@H](C)N[C@H](C)c2ccc(F)c(Cl)c2)c(C)o1 ZINC000044729506 330331167 /nfs/dbraw/zinc/33/11/67/330331167.db2.gz KJNDOQPPETXMAC-GHMZBOCLSA-N 0 1 295.785 5.101 20 0 CKADMN Cc1cc([C@H](C)N[C@H](C)c2ccc(F)c(Cl)c2)c(C)o1 ZINC000044729507 330331285 /nfs/dbraw/zinc/33/12/85/330331285.db2.gz KJNDOQPPETXMAC-MNOVXSKESA-N 0 1 295.785 5.101 20 0 CKADMN Cc1cc([C@@H](C)NCc2cc(Cl)cc(Cl)c2)c(C)o1 ZINC000044729993 330331436 /nfs/dbraw/zinc/33/14/36/330331436.db2.gz MOVVLDRUANWRNY-SNVBAGLBSA-N 0 1 298.213 5.054 20 0 CKADMN Cc1cc([C@H](C)NCc2cc(Cl)cc(Cl)c2)c(C)o1 ZINC000044729994 330331337 /nfs/dbraw/zinc/33/13/37/330331337.db2.gz MOVVLDRUANWRNY-JTQLQIEISA-N 0 1 298.213 5.054 20 0 CKADMN Cc1ccc([C@@H](C)N[C@@H](C)c2ccc(F)cc2Cl)s1 ZINC000049160957 328351119 /nfs/dbraw/zinc/35/11/19/328351119.db2.gz ZJARQSUUXPSEMQ-WDEREUQCSA-N 0 1 297.826 5.261 20 0 CKADMN Cc1ccc([C@H](C)N[C@@H](C)c2ccc(F)cc2Cl)s1 ZINC000049160961 328351169 /nfs/dbraw/zinc/35/11/69/328351169.db2.gz ZJARQSUUXPSEMQ-QWRGUYRKSA-N 0 1 297.826 5.261 20 0 CKADMN Cc1ccc([C@@H](C)N[C@H](C)c2ccc(F)cc2Cl)s1 ZINC000049160966 328351245 /nfs/dbraw/zinc/35/12/45/328351245.db2.gz ZJARQSUUXPSEMQ-GHMZBOCLSA-N 0 1 297.826 5.261 20 0 CKADMN Cc1ccc([C@H](C)N[C@H](C)c2ccc(F)cc2Cl)s1 ZINC000049160970 328351203 /nfs/dbraw/zinc/35/12/03/328351203.db2.gz ZJARQSUUXPSEMQ-MNOVXSKESA-N 0 1 297.826 5.261 20 0 CKADMN CC[C@H](NCc1cccc(Cl)c1Cl)c1ccccc1 ZINC000050198382 328391529 /nfs/dbraw/zinc/39/15/29/328391529.db2.gz NHVDMRAMTDDXSN-HNNXBMFYSA-N 0 1 294.225 5.234 20 0 CKADMN CC[C@@H](NCc1cccc(Cl)c1Cl)c1ccccc1 ZINC000050198384 328391480 /nfs/dbraw/zinc/39/14/80/328391480.db2.gz NHVDMRAMTDDXSN-OAHLLOKOSA-N 0 1 294.225 5.234 20 0 CKADMN C[C@H](NC(c1ccccc1)c1ccccc1)c1ccsc1 ZINC000050338451 328397531 /nfs/dbraw/zinc/39/75/31/328397531.db2.gz SYQCMQHHMFQKDP-HNNXBMFYSA-N 0 1 293.435 5.188 20 0 CKADMN C[C@@H](NC(c1ccccc1)c1ccccc1)c1ccsc1 ZINC000050338454 328397445 /nfs/dbraw/zinc/39/74/45/328397445.db2.gz SYQCMQHHMFQKDP-OAHLLOKOSA-N 0 1 293.435 5.188 20 0 CKADMN 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Cc1c2ccccc2oc1[C@@H](C)N[C@H](C)c1ccsc1 ZINC000061361447 330436091 /nfs/dbraw/zinc/43/60/91/330436091.db2.gz KHOQYEYGDCNGEN-CHWSQXEVSA-N 0 1 285.412 5.215 20 0 CKADMN Cc1c2ccccc2oc1[C@H](C)N[C@H](C)c1ccsc1 ZINC000061361448 330436008 /nfs/dbraw/zinc/43/60/08/330436008.db2.gz KHOQYEYGDCNGEN-OLZOCXBDSA-N 0 1 285.412 5.215 20 0 CKADMN C[C@H](N[C@@H](CC(F)(F)F)c1ccccc1)c1ccsc1 ZINC000061361689 330436047 /nfs/dbraw/zinc/43/60/47/330436047.db2.gz HPVBACKVTUUFNO-FZMZJTMJSA-N 0 1 299.361 5.092 20 0 CKADMN C[C@@H](N[C@H](CC(F)(F)F)c1ccccc1)c1ccsc1 ZINC000061361692 330436000 /nfs/dbraw/zinc/43/60/00/330436000.db2.gz HPVBACKVTUUFNO-BXUZGUMPSA-N 0 1 299.361 5.092 20 0 CKADMN CC[C@H](N[C@@H](C)c1ccc(C(C)C)cc1)c1nccs1 ZINC000080257817 334168677 /nfs/dbraw/zinc/16/86/77/334168677.db2.gz NJWUZACUDNKTNJ-BBRMVZONSA-N 0 1 288.460 5.068 20 0 CKADMN CC[C@@H](N[C@@H](C)c1ccc(C(C)C)cc1)c1nccs1 ZINC000080257820 334168661 /nfs/dbraw/zinc/16/86/61/334168661.db2.gz NJWUZACUDNKTNJ-XJKSGUPXSA-N 0 1 288.460 5.068 20 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5.098 20 0 CKADMN CC[C@H](N[C@@H](C)c1cccc2ccccc21)c1nccs1 ZINC000080264289 334168946 /nfs/dbraw/zinc/16/89/46/334168946.db2.gz VUGFVGPXPFUHKD-GUYCJALGSA-N 0 1 296.439 5.098 20 0 CKADMN CC[C@@H](N[C@@H](C)c1cccc2ccccc21)c1nccs1 ZINC000080264293 334168919 /nfs/dbraw/zinc/16/89/19/334168919.db2.gz VUGFVGPXPFUHKD-SUMWQHHRSA-N 0 1 296.439 5.098 20 0 CKADMN CC[C@H](N[C@H](C)c1cccc2ccccc21)c1nccs1 ZINC000080264297 334168933 /nfs/dbraw/zinc/16/89/33/334168933.db2.gz VUGFVGPXPFUHKD-DYVFJYSZSA-N 0 1 296.439 5.098 20 0 CKADMN CC[C@@H](N[C@H](C)c1cccc2ccccc21)c1nccs1 ZINC000080264301 334168825 /nfs/dbraw/zinc/16/88/25/334168825.db2.gz VUGFVGPXPFUHKD-CXAGYDPISA-N 0 1 296.439 5.098 20 0 CKADMN Cc1csc([C@@H](C)N[C@@H](C)c2ccc3ccccc3c2)n1 ZINC000080274376 334169553 /nfs/dbraw/zinc/16/95/53/334169553.db2.gz UHDOXGRDKFVMEV-UONOGXRCSA-N 0 1 296.439 5.017 20 0 CKADMN Cc1csc([C@H](C)N[C@@H](C)c2ccc3ccccc3c2)n1 ZINC000080274382 334169450 /nfs/dbraw/zinc/16/94/50/334169450.db2.gz UHDOXGRDKFVMEV-KBPBESRZSA-N 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/nfs/dbraw/zinc/25/96/05/265259605.db2.gz UCEGITMCWLYXDB-GHMZBOCLSA-N 0 1 295.760 5.030 20 0 CKADMN Cc1cc([C@@H](C)NCc2cc(Cl)ccc2F)c(C)s1 ZINC000125156901 328595769 /nfs/dbraw/zinc/59/57/69/328595769.db2.gz OWJPYDYUAGRBGQ-SNVBAGLBSA-N 0 1 297.826 5.008 20 0 CKADMN Cc1ccc([C@@H](C)N[C@@H]2CCCc3sc(Cl)cc32)o1 ZINC000127653202 260369682 /nfs/dbraw/zinc/36/96/82/260369682.db2.gz JATPNAUFPAOFQW-ZYHUDNBSSA-N 0 1 295.835 5.031 20 0 CKADMN Cc1ccc([C@H](C)N[C@@H]2CCCc3sc(Cl)cc32)o1 ZINC000127653417 260369815 /nfs/dbraw/zinc/36/98/15/260369815.db2.gz JATPNAUFPAOFQW-CMPLNLGQSA-N 0 1 295.835 5.031 20 0 CKADMN Cc1ccc([C@@H](C)N[C@H]2CCCc3sc(Cl)cc32)o1 ZINC000127653646 260369799 /nfs/dbraw/zinc/36/97/99/260369799.db2.gz JATPNAUFPAOFQW-PWSUYJOCSA-N 0 1 295.835 5.031 20 0 CKADMN Cc1ccc([C@H](C)N[C@H]2CCCc3sc(Cl)cc32)o1 ZINC000127653867 260369832 /nfs/dbraw/zinc/36/98/32/260369832.db2.gz JATPNAUFPAOFQW-JQWIXIFHSA-N 0 1 295.835 5.031 20 0 CKADMN Cc1cnc([C@@H](C)N[C@@H](C)c2ccc3ccccc3c2)s1 ZINC000134899031 334107269 /nfs/dbraw/zinc/10/72/69/334107269.db2.gz ATQFWSYFHPRZNH-UONOGXRCSA-N 0 1 296.439 5.017 20 0 CKADMN Cc1cnc([C@H](C)N[C@@H](C)c2ccc3ccccc3c2)s1 ZINC000134899045 334107371 /nfs/dbraw/zinc/10/73/71/334107371.db2.gz ATQFWSYFHPRZNH-KBPBESRZSA-N 0 1 296.439 5.017 20 0 CKADMN Cc1cnc([C@@H](C)N[C@H](C)c2ccc3ccccc3c2)s1 ZINC000134899066 334107255 /nfs/dbraw/zinc/10/72/55/334107255.db2.gz ATQFWSYFHPRZNH-ZIAGYGMSSA-N 0 1 296.439 5.017 20 0 CKADMN Cc1cnc([C@H](C)N[C@H](C)c2ccc3ccccc3c2)s1 ZINC000134899081 334107320 /nfs/dbraw/zinc/10/73/20/334107320.db2.gz ATQFWSYFHPRZNH-KGLIPLIRSA-N 0 1 296.439 5.017 20 0 CKADMN Cc1cnc([C@@H](C)N[C@@H](C)c2cccc3ccccc32)s1 ZINC000134901174 334107637 /nfs/dbraw/zinc/10/76/37/334107637.db2.gz BJBQZSUTCPUPBD-UONOGXRCSA-N 0 1 296.439 5.017 20 0 CKADMN Cc1cnc([C@H](C)N[C@@H](C)c2cccc3ccccc32)s1 ZINC000134901195 334107617 /nfs/dbraw/zinc/10/76/17/334107617.db2.gz BJBQZSUTCPUPBD-KBPBESRZSA-N 0 1 296.439 5.017 20 0 CKADMN Cc1cnc([C@@H](C)N[C@H](C)c2cccc3ccccc32)s1 ZINC000134901217 334107494 /nfs/dbraw/zinc/10/74/94/334107494.db2.gz BJBQZSUTCPUPBD-ZIAGYGMSSA-N 0 1 296.439 5.017 20 0 CKADMN Cc1cnc([C@H](C)N[C@H](C)c2cccc3ccccc32)s1 ZINC000134901239 334107465 /nfs/dbraw/zinc/10/74/65/334107465.db2.gz BJBQZSUTCPUPBD-KGLIPLIRSA-N 0 1 296.439 5.017 20 0 CKADMN Cc1cc([C@@H](C)NCc2ccc(Cl)cc2F)c(C)s1 ZINC000157436390 330775458 /nfs/dbraw/zinc/77/54/58/330775458.db2.gz CAZJECYSUWSVNF-SNVBAGLBSA-N 0 1 297.826 5.008 20 0 CKADMN Cc1cc([C@H](C)NCc2ccc(Cl)cc2F)c(C)s1 ZINC000157436552 330775511 /nfs/dbraw/zinc/77/55/11/330775511.db2.gz CAZJECYSUWSVNF-JTQLQIEISA-N 0 1 297.826 5.008 20 0 CKADMN CC[C@H](N[C@H](C)c1ccc(C)o1)c1ccc(Cl)s1 ZINC000158180727 334794698 /nfs/dbraw/zinc/79/46/98/334794698.db2.gz KPVUPODVDAJRJI-MNOVXSKESA-N 0 1 283.824 5.105 20 0 CKADMN Cc1ccc(CN[C@@H](C)c2cccc(Cl)c2Cl)cc1 ZINC000165149544 331305858 /nfs/dbraw/zinc/30/58/58/331305858.db2.gz MYSXUCHVAMIRNA-LBPRGKRZSA-N 0 1 294.225 5.153 20 0 CKADMN Cc1ccc(CN[C@H](C)c2cccc(Cl)c2Cl)cc1 ZINC000165149673 331305914 /nfs/dbraw/zinc/30/59/14/331305914.db2.gz MYSXUCHVAMIRNA-GFCCVEGCSA-N 0 1 294.225 5.153 20 0 CKADMN Cc1cc([C@@H](C)NCc2cccc(F)c2Cl)c(C)s1 ZINC000166344592 331306934 /nfs/dbraw/zinc/30/69/34/331306934.db2.gz ONYZZKOWNMNSRX-SNVBAGLBSA-N 0 1 297.826 5.008 20 0 CKADMN Cc1cc([C@H](C)NCc2cccc(F)c2Cl)c(C)s1 ZINC000166344703 331307058 /nfs/dbraw/zinc/30/70/58/331307058.db2.gz ONYZZKOWNMNSRX-JTQLQIEISA-N 0 1 297.826 5.008 20 0 CKADMN CC(C)Sc1ccc([C@@H](C)N[C@@H](C)c2ccoc2)cc1 ZINC000178621228 335441805 /nfs/dbraw/zinc/44/18/05/335441805.db2.gz QJWDOKHWAODYHQ-KGLIPLIRSA-N 0 1 289.444 5.192 20 0 CKADMN CC(C)Sc1ccc([C@H](C)N[C@@H](C)c2ccoc2)cc1 ZINC000178621239 335441852 /nfs/dbraw/zinc/44/18/52/335441852.db2.gz QJWDOKHWAODYHQ-KBPBESRZSA-N 0 1 289.444 5.192 20 0 CKADMN C[C@H](NCc1ccoc1)c1cc2c(ccc3ccccc23)o1 ZINC000181554134 335770227 /nfs/dbraw/zinc/77/02/27/335770227.db2.gz BCNYGXABLUNBCK-ZDUSSCGKSA-N 0 1 291.350 5.030 20 0 CKADMN C[C@@H](NCc1ccoc1)c1cc2c(ccc3ccccc23)o1 ZINC000181554151 335770156 /nfs/dbraw/zinc/77/01/56/335770156.db2.gz BCNYGXABLUNBCK-CYBMUJFWSA-N 0 1 291.350 5.030 20 0 CKADMN CC[C@@H](NCc1ccc(C(F)F)cc1)c1ccccc1F ZINC000185357796 327838651 /nfs/dbraw/zinc/83/86/51/327838651.db2.gz CZDFNQFYTMQXMJ-MRXNPFEDSA-N 0 1 293.332 5.004 20 0 CKADMN CCc1c2ccccc2oc1[C@@H](C)N[C@@H](C)c1ccc(C)o1 ZINC000195613729 331178468 /nfs/dbraw/zinc/17/84/68/331178468.db2.gz IBZQKHVNYNDJPX-UONOGXRCSA-N 0 1 297.398 5.308 20 0 CKADMN CCc1c2ccccc2oc1[C@H](C)N[C@@H](C)c1ccc(C)o1 ZINC000195613730 331178466 /nfs/dbraw/zinc/17/84/66/331178466.db2.gz IBZQKHVNYNDJPX-KBPBESRZSA-N 0 1 297.398 5.308 20 0 CKADMN CCc1c2ccccc2oc1[C@@H](C)N[C@H](C)c1ccc(C)o1 ZINC000195613731 331178422 /nfs/dbraw/zinc/17/84/22/331178422.db2.gz IBZQKHVNYNDJPX-ZIAGYGMSSA-N 0 1 297.398 5.308 20 0 CKADMN CCc1c2ccccc2oc1[C@H](C)N[C@H](C)c1ccc(C)o1 ZINC000195613732 331178351 /nfs/dbraw/zinc/17/83/51/331178351.db2.gz IBZQKHVNYNDJPX-KGLIPLIRSA-N 0 1 297.398 5.308 20 0 CKADMN Cc1c2ccccc2oc1[C@@H](C)N[C@@H](C)c1cccc(F)c1 ZINC000195615938 331178534 /nfs/dbraw/zinc/17/85/34/331178534.db2.gz BZJGUTBACSKZOC-UONOGXRCSA-N 0 1 297.373 5.292 20 0 CKADMN Cc1c2ccccc2oc1[C@H](C)N[C@@H](C)c1cccc(F)c1 ZINC000195615941 331178502 /nfs/dbraw/zinc/17/85/02/331178502.db2.gz BZJGUTBACSKZOC-KBPBESRZSA-N 0 1 297.373 5.292 20 0 CKADMN Cc1c2ccccc2oc1[C@@H](C)N[C@H](C)c1cccc(F)c1 ZINC000195615944 331178516 /nfs/dbraw/zinc/17/85/16/331178516.db2.gz BZJGUTBACSKZOC-ZIAGYGMSSA-N 0 1 297.373 5.292 20 0 CKADMN Cc1c2ccccc2oc1[C@H](C)N[C@H](C)c1cccc(F)c1 ZINC000195615946 331178562 /nfs/dbraw/zinc/17/85/62/331178562.db2.gz BZJGUTBACSKZOC-KGLIPLIRSA-N 0 1 297.373 5.292 20 0 CKADMN Cc1c2ccccc2oc1[C@@H](C)N[C@@H](C)c1ccccc1F ZINC000195656503 331179746 /nfs/dbraw/zinc/17/97/46/331179746.db2.gz WRIJJGSLBCATMS-UONOGXRCSA-N 0 1 297.373 5.292 20 0 CKADMN Cc1c2ccccc2oc1[C@H](C)N[C@@H](C)c1ccccc1F ZINC000195656512 331179698 /nfs/dbraw/zinc/17/96/98/331179698.db2.gz WRIJJGSLBCATMS-KBPBESRZSA-N 0 1 297.373 5.292 20 0 CKADMN Cc1c2ccccc2oc1[C@@H](C)N[C@H](C)c1ccccc1F ZINC000195656513 331179683 /nfs/dbraw/zinc/17/96/83/331179683.db2.gz WRIJJGSLBCATMS-ZIAGYGMSSA-N 0 1 297.373 5.292 20 0 CKADMN Cc1c2ccccc2oc1[C@H](C)N[C@H](C)c1ccccc1F ZINC000195656514 331179767 /nfs/dbraw/zinc/17/97/67/331179767.db2.gz WRIJJGSLBCATMS-KGLIPLIRSA-N 0 1 297.373 5.292 20 0 CKADMN Cc1cc([C@@H](C)N[C@@H](C)c2cccc(F)c2F)c(C)s1 ZINC000222716422 333199257 /nfs/dbraw/zinc/19/92/57/333199257.db2.gz JDNUYMWSKKSYTM-WDEREUQCSA-N 0 1 295.398 5.055 20 0 CKADMN Cc1cc([C@H](C)N[C@@H](C)c2cccc(F)c2F)c(C)s1 ZINC000222716478 333199443 /nfs/dbraw/zinc/19/94/43/333199443.db2.gz JDNUYMWSKKSYTM-QWRGUYRKSA-N 0 1 295.398 5.055 20 0 CKADMN Cc1cc([C@@H](C)N[C@H](C)c2cccc(F)c2F)c(C)s1 ZINC000222716532 333199353 /nfs/dbraw/zinc/19/93/53/333199353.db2.gz JDNUYMWSKKSYTM-GHMZBOCLSA-N 0 1 295.398 5.055 20 0 CKADMN Cc1cc([C@H](C)N[C@H](C)c2cccc(F)c2F)c(C)s1 ZINC000222716599 333199422 /nfs/dbraw/zinc/19/94/22/333199422.db2.gz JDNUYMWSKKSYTM-MNOVXSKESA-N 0 1 295.398 5.055 20 0 CKADMN CC[C@@H](NCc1cc(C)ccc1F)c1ccc(Cl)cc1 ZINC000227283068 333279665 /nfs/dbraw/zinc/27/96/65/333279665.db2.gz SQFMBAJYXZVKJA-QGZVFWFLSA-N 0 1 291.797 5.028 20 0 CKADMN CC[C@H](NCc1cc(C)ccc1F)c1ccc(Cl)cc1 ZINC000227283073 333279634 /nfs/dbraw/zinc/27/96/34/333279634.db2.gz SQFMBAJYXZVKJA-KRWDZBQOSA-N 0 1 291.797 5.028 20 0 CKADMN CC[C@@H](NCc1cc(C)ccc1F)c1cccc(Cl)c1 ZINC000227283721 333279545 /nfs/dbraw/zinc/27/95/45/333279545.db2.gz PFEAPYXXHUQSGO-QGZVFWFLSA-N 0 1 291.797 5.028 20 0 CKADMN CC[C@H](NCc1cc(C)ccc1F)c1cccc(Cl)c1 ZINC000227283727 333279526 /nfs/dbraw/zinc/27/95/26/333279526.db2.gz PFEAPYXXHUQSGO-KRWDZBQOSA-N 0 1 291.797 5.028 20 0 CKADMN Cc1cccc(CN[C@@H](C)c2cccc(Cl)c2Cl)c1 ZINC000227530113 333285001 /nfs/dbraw/zinc/28/50/01/333285001.db2.gz DAIFCTBGLMEORM-LBPRGKRZSA-N 0 1 294.225 5.153 20 0 CKADMN Cc1cccc(CN[C@H](C)c2cccc(Cl)c2Cl)c1 ZINC000227530116 333285010 /nfs/dbraw/zinc/28/50/10/333285010.db2.gz DAIFCTBGLMEORM-GFCCVEGCSA-N 0 1 294.225 5.153 20 0 CKADMN Cc1ccccc1CN[C@@H](C)c1cccc(Cl)c1Cl ZINC000227530361 333284959 /nfs/dbraw/zinc/28/49/59/333284959.db2.gz CIPAKIDEMAPPPE-LBPRGKRZSA-N 0 1 294.225 5.153 20 0 CKADMN Cc1ccccc1CN[C@H](C)c1cccc(Cl)c1Cl ZINC000227530364 333285126 /nfs/dbraw/zinc/28/51/26/333285126.db2.gz CIPAKIDEMAPPPE-GFCCVEGCSA-N 0 1 294.225 5.153 20 0 CKADMN C[C@@H](N[C@@H](C)c1cccc(F)c1F)c1ccc(Cl)cc1 ZINC000231635019 333326545 /nfs/dbraw/zinc/32/65/45/333326545.db2.gz XKIQZWKZRBHDLY-MNOVXSKESA-N 0 1 295.760 5.030 20 0 CKADMN C[C@H](N[C@@H](C)c1cccc(F)c1F)c1ccc(Cl)cc1 ZINC000231635022 333326491 /nfs/dbraw/zinc/32/64/91/333326491.db2.gz XKIQZWKZRBHDLY-QWRGUYRKSA-N 0 1 295.760 5.030 20 0 CKADMN C[C@@H](N[C@H](C)c1cccc(F)c1F)c1ccc(Cl)cc1 ZINC000231635025 333326568 /nfs/dbraw/zinc/32/65/68/333326568.db2.gz XKIQZWKZRBHDLY-GHMZBOCLSA-N 0 1 295.760 5.030 20 0 CKADMN C[C@@H](N[C@@H](C)c1ccc(Cl)cc1)c1cccc(F)c1F ZINC000231635027 333326531 /nfs/dbraw/zinc/32/65/31/333326531.db2.gz XKIQZWKZRBHDLY-WDEREUQCSA-N 0 1 295.760 5.030 20 0 CKADMN C[C@@H](N[C@@H](C)c1cccc(F)c1F)c1cccc(Cl)c1 ZINC000231635069 333326551 /nfs/dbraw/zinc/32/65/51/333326551.db2.gz WNIPKNUHRVWTRV-MNOVXSKESA-N 0 1 295.760 5.030 20 0 CKADMN C[C@H](N[C@@H](C)c1cccc(F)c1F)c1cccc(Cl)c1 ZINC000231635073 333326560 /nfs/dbraw/zinc/32/65/60/333326560.db2.gz WNIPKNUHRVWTRV-QWRGUYRKSA-N 0 1 295.760 5.030 20 0 CKADMN C[C@@H](N[C@H](C)c1cccc(F)c1F)c1cccc(Cl)c1 ZINC000231635075 333326547 /nfs/dbraw/zinc/32/65/47/333326547.db2.gz WNIPKNUHRVWTRV-GHMZBOCLSA-N 0 1 295.760 5.030 20 0 CKADMN C[C@@H](N[C@@H](C)c1cccc(Cl)c1)c1cccc(F)c1F ZINC000231635079 333326543 /nfs/dbraw/zinc/32/65/43/333326543.db2.gz WNIPKNUHRVWTRV-WDEREUQCSA-N 0 1 295.760 5.030 20 0 CKADMN CC(C)(NCc1ccc(Cl)cc1Cl)c1ccccc1 ZINC000311690055 260257438 /nfs/dbraw/zinc/25/74/38/260257438.db2.gz FIEPTTDXAQWTAN-UHFFFAOYSA-N 0 1 294.225 5.018 20 0 CKADMN CC[C@H](N[C@@H](C)c1c(F)cccc1Cl)c1cccs1 ZINC000311889247 333073951 /nfs/dbraw/zinc/07/39/51/333073951.db2.gz ONHWXPUOQYDLEK-GWCFXTLKSA-N 0 1 297.826 5.343 20 0 CKADMN CC[C@@H](N[C@@H](C)c1c(F)cccc1Cl)c1cccs1 ZINC000311889249 333073961 /nfs/dbraw/zinc/07/39/61/333073961.db2.gz ONHWXPUOQYDLEK-GXFFZTMASA-N 0 1 297.826 5.343 20 0 CKADMN CC[C@H](N[C@H](C)c1c(F)cccc1Cl)c1cccs1 ZINC000311889251 333074044 /nfs/dbraw/zinc/07/40/44/333074044.db2.gz ONHWXPUOQYDLEK-MFKMUULPSA-N 0 1 297.826 5.343 20 0 CKADMN CC[C@@H](N[C@H](C)c1c(F)cccc1Cl)c1cccs1 ZINC000311889253 333073947 /nfs/dbraw/zinc/07/39/47/333073947.db2.gz ONHWXPUOQYDLEK-ZWNOBZJWSA-N 0 1 297.826 5.343 20 0 CKADMN CC[C@H](NCc1occc1C)c1ccc(Cl)c(Cl)c1 ZINC000311893326 333074238 /nfs/dbraw/zinc/07/42/38/333074238.db2.gz BAIGQEQWWAVOCN-AWEZNQCLSA-N 0 1 298.213 5.136 20 0 CKADMN CC[C@@H](NCc1occc1C)c1ccc(Cl)c(Cl)c1 ZINC000311893327 333074189 /nfs/dbraw/zinc/07/41/89/333074189.db2.gz BAIGQEQWWAVOCN-CQSZACIVSA-N 0 1 298.213 5.136 20 0 CKADMN CC(C)[C@H](NCc1ccsc1Cl)c1ccc(F)cc1 ZINC000312562415 260149518 /nfs/dbraw/zinc/14/95/18/260149518.db2.gz QPWNWQRJKCQCGA-AWEZNQCLSA-N 0 1 297.826 5.028 20 0 CKADMN CC(C)[C@@H](NCc1ccsc1Cl)c1ccc(F)cc1 ZINC000312562418 260149334 /nfs/dbraw/zinc/14/93/34/260149334.db2.gz QPWNWQRJKCQCGA-CQSZACIVSA-N 0 1 297.826 5.028 20 0 CKADMN CCC[C@H](NCc1ccsc1Cl)c1ccccc1 ZINC000312571056 260153550 /nfs/dbraw/zinc/15/35/50/260153550.db2.gz IQMPYMSXFDFIJJ-AWEZNQCLSA-N 0 1 279.836 5.033 20 0 CKADMN CCC[C@@H](NCc1ccsc1Cl)c1ccccc1 ZINC000312571059 260153381 /nfs/dbraw/zinc/15/33/81/260153381.db2.gz IQMPYMSXFDFIJJ-CQSZACIVSA-N 0 1 279.836 5.033 20 0 CKADMN Cc1ccc(CN[C@@H](C)c2ccc(-c3ccccc3)cc2)o1 ZINC000314944058 330468042 /nfs/dbraw/zinc/46/80/42/330468042.db2.gz UNMXNHYPKLLFPL-INIZCTEOSA-N 0 1 291.394 5.106 20 0 CKADMN Cc1c2ccccc2oc1[C@H](C)N[C@H]1CCCc2occc21 ZINC000315712299 333383351 /nfs/dbraw/zinc/38/33/51/333383351.db2.gz XJEKPLKTMDSLOV-BBRMVZONSA-N 0 1 295.382 5.062 20 0 CKADMN Cc1c2ccccc2oc1[C@@H](C)N[C@H]1CCCc2occc21 ZINC000315712304 333383217 /nfs/dbraw/zinc/38/32/17/333383217.db2.gz XJEKPLKTMDSLOV-CJNGLKHVSA-N 0 1 295.382 5.062 20 0 CKADMN Cc1c2ccccc2oc1[C@@H](C)N[C@@H]1CCCc2occc21 ZINC000315712308 333383099 /nfs/dbraw/zinc/38/30/99/333383099.db2.gz XJEKPLKTMDSLOV-CZUORRHYSA-N 0 1 295.382 5.062 20 0 CKADMN Cc1c2ccccc2oc1[C@H](C)N[C@@H]1CCCc2occc21 ZINC000315712312 333383186 /nfs/dbraw/zinc/38/31/86/333383186.db2.gz XJEKPLKTMDSLOV-XJKSGUPXSA-N 0 1 295.382 5.062 20 0 CKADMN C[C@@H](NCc1coc2ccccc12)c1cc2ccccc2o1 ZINC000378906495 327765217 /nfs/dbraw/zinc/76/52/17/327765217.db2.gz FPDPRNBDZVNPSE-CYBMUJFWSA-N 0 1 291.350 5.030 20 0 CKADMN Cc1cc([C@@H](C)N[C@H](C)c2cc3ccccc3o2)cs1 ZINC000381510244 336067219 /nfs/dbraw/zinc/06/72/19/336067219.db2.gz UWKXKSXCHVQEGI-CHWSQXEVSA-N 0 1 285.412 5.215 20 0 CKADMN Cc1cc([C@@H](C)N[C@@H](C)c2cc3ccccc3o2)cs1 ZINC000381510246 336067243 /nfs/dbraw/zinc/06/72/43/336067243.db2.gz UWKXKSXCHVQEGI-OLZOCXBDSA-N 0 1 285.412 5.215 20 0 CKADMN Cc1cc([C@H](C)N[C@H](C)c2cc3ccccc3o2)cs1 ZINC000381510247 336067165 /nfs/dbraw/zinc/06/71/65/336067165.db2.gz UWKXKSXCHVQEGI-QWHCGFSZSA-N 0 1 285.412 5.215 20 0 CKADMN Cc1cc([C@H](C)N[C@@H](C)c2cc3ccccc3o2)cs1 ZINC000381510248 336067088 /nfs/dbraw/zinc/06/70/88/336067088.db2.gz UWKXKSXCHVQEGI-STQMWFEESA-N 0 1 285.412 5.215 20 0 CKADMN Cc1cc([C@@H](C)N[C@@H](C)c2ccccc2Cl)cs1 ZINC000381519286 327552397 /nfs/dbraw/zinc/55/23/97/327552397.db2.gz WYPJTYOBCGUXOE-NEPJUHHUSA-N 0 1 279.836 5.122 20 0 CKADMN Cc1cc([C@H](C)N[C@H](C)c2ccccc2Cl)cs1 ZINC000381519291 336067255 /nfs/dbraw/zinc/06/72/55/336067255.db2.gz WYPJTYOBCGUXOE-NWDGAFQWSA-N 0 1 279.836 5.122 20 0 CKADMN Cc1cc([C@H](C)N[C@@H](C)c2ccccc2Cl)cs1 ZINC000381519296 336067173 /nfs/dbraw/zinc/06/71/73/336067173.db2.gz WYPJTYOBCGUXOE-RYUDHWBXSA-N 0 1 279.836 5.122 20 0 CKADMN Cc1cc([C@@H](C)N[C@H](C)c2ccccc2Cl)cs1 ZINC000381519300 336067135 /nfs/dbraw/zinc/06/71/35/336067135.db2.gz WYPJTYOBCGUXOE-VXGBXAGGSA-N 0 1 279.836 5.122 20 0 CKADMN CC[C@H](N[C@H](C)c1ccccc1Cl)c1ccsc1 ZINC000382190882 336084136 /nfs/dbraw/zinc/08/41/36/336084136.db2.gz YYCSMZLOFKMACS-ABAIWWIYSA-N 0 1 279.836 5.203 20 0 CKADMN CC[C@@H](N[C@H](C)c1ccccc1Cl)c1ccsc1 ZINC000382190885 327851962 /nfs/dbraw/zinc/85/19/62/327851962.db2.gz YYCSMZLOFKMACS-IAQYHMDHSA-N 0 1 279.836 5.203 20 0 CKADMN CC[C@H](N[C@@H](C)c1ccccc1Cl)c1ccsc1 ZINC000382190893 336084059 /nfs/dbraw/zinc/08/40/59/336084059.db2.gz YYCSMZLOFKMACS-NHYWBVRUSA-N 0 1 279.836 5.203 20 0 CKADMN CC[C@@H](N[C@@H](C)c1ccccc1Cl)c1ccsc1 ZINC000382190898 336084066 /nfs/dbraw/zinc/08/40/66/336084066.db2.gz YYCSMZLOFKMACS-XHDPSFHLSA-N 0 1 279.836 5.203 20 0 CKADMN Cc1cc([C@H](C)N[C@@H](C)c2oc3ccccc3c2C)c(C)o1 ZINC000386768595 336178569 /nfs/dbraw/zinc/17/85/69/336178569.db2.gz HEPVJUFLSYCEJA-KBPBESRZSA-N 0 1 297.398 5.363 20 0 CKADMN Cc1cc([C@@H](C)N[C@@H](C)c2oc3ccccc3c2C)c(C)o1 ZINC000386768607 336178604 /nfs/dbraw/zinc/17/86/04/336178604.db2.gz HEPVJUFLSYCEJA-KGLIPLIRSA-N 0 1 297.398 5.363 20 0 CKADMN Cc1cc([C@H](C)N[C@H](C)c2oc3ccccc3c2C)c(C)o1 ZINC000386768610 336178401 /nfs/dbraw/zinc/17/84/01/336178401.db2.gz HEPVJUFLSYCEJA-UONOGXRCSA-N 0 1 297.398 5.363 20 0 CKADMN Cc1cc([C@@H](C)N[C@H](C)c2oc3ccccc3c2C)c(C)o1 ZINC000386768612 336178531 /nfs/dbraw/zinc/17/85/31/336178531.db2.gz HEPVJUFLSYCEJA-ZIAGYGMSSA-N 0 1 297.398 5.363 20 0 CKADMN Cc1ccc([C@@H](C)N[C@H](C)c2c(F)cccc2Cl)s1 ZINC000388347999 327872379 /nfs/dbraw/zinc/87/23/79/327872379.db2.gz LDRKACSQJRBDEX-GHMZBOCLSA-N 0 1 297.826 5.261 20 0 CKADMN Cc1ccc([C@@H](C)N[C@@H](C)c2c(F)cccc2Cl)s1 ZINC000388348005 327872406 /nfs/dbraw/zinc/87/24/06/327872406.db2.gz LDRKACSQJRBDEX-MNOVXSKESA-N 0 1 297.826 5.261 20 0 CKADMN Cc1ccc([C@H](C)N[C@@H](C)c2c(F)cccc2Cl)s1 ZINC000388348007 327872507 /nfs/dbraw/zinc/87/25/07/327872507.db2.gz LDRKACSQJRBDEX-QWRGUYRKSA-N 0 1 297.826 5.261 20 0 CKADMN Cc1ccc([C@H](C)N[C@H](C)c2c(F)cccc2Cl)s1 ZINC000388348008 327872500 /nfs/dbraw/zinc/87/25/00/327872500.db2.gz LDRKACSQJRBDEX-WDEREUQCSA-N 0 1 297.826 5.261 20 0 CKADMN Cc1ccoc1CN[C@@H](C)c1ccc(-c2ccccc2)cc1 ZINC000390745890 262250150 /nfs/dbraw/zinc/25/01/50/262250150.db2.gz UKKYGYGQAUYRHN-INIZCTEOSA-N 0 1 291.394 5.106 20 0 CKADMN Cc1ccoc1CN[C@H](C)c1ccc(-c2ccccc2)cc1 ZINC000390745891 262250228 /nfs/dbraw/zinc/25/02/28/262250228.db2.gz UKKYGYGQAUYRHN-MRXNPFEDSA-N 0 1 291.394 5.106 20 0 CKADMN Cc1ccoc1CN[C@@H](C)c1cccc(-c2ccccc2)c1 ZINC000426287497 260331564 /nfs/dbraw/zinc/33/15/64/260331564.db2.gz AAPZYJVTWRJGLC-INIZCTEOSA-N 0 1 291.394 5.106 20 0 CKADMN Cc1ccoc1CN[C@H](C)c1cccc(-c2ccccc2)c1 ZINC000426287498 260331833 /nfs/dbraw/zinc/33/18/33/260331833.db2.gz AAPZYJVTWRJGLC-MRXNPFEDSA-N 0 1 291.394 5.106 20 0 CKADMN CSc1ccccc1[C@H](C)NCc1cc2ccccc2o1 ZINC000440627540 330752858 /nfs/dbraw/zinc/75/28/58/330752858.db2.gz TUNBWECCNLNMJE-ZDUSSCGKSA-N 0 1 297.423 5.006 20 0 CKADMN CSc1ccccc1CN[C@H](C)c1cc2ccccc2o1 ZINC000442890626 330790832 /nfs/dbraw/zinc/79/08/32/330790832.db2.gz KKUFXCMGVYPCIR-CYBMUJFWSA-N 0 1 297.423 5.006 20 0 CKADMN CCC[C@H](NCc1ccccc1Cl)c1ccsc1 ZINC000443090090 528229528 /nfs/dbraw/zinc/22/95/28/528229528.db2.gz VPYKGHXIKIOPBA-HNNXBMFYSA-N 0 1 279.836 5.033 20 0 CKADMN CCC[C@@H](NCc1ccccc1Cl)c1ccsc1 ZINC000443090091 529013550 /nfs/dbraw/zinc/01/35/50/529013550.db2.gz VPYKGHXIKIOPBA-OAHLLOKOSA-N 0 1 279.836 5.033 20 0 CKADMN CCC[C@@H](N[C@@H]1CSc2ccccc21)c1ccsc1 ZINC000443094587 330794580 /nfs/dbraw/zinc/79/45/80/330794580.db2.gz CZOMXZPBCLDMBQ-HUUCEWRRSA-N 0 1 289.469 5.026 20 0 CKADMN CCC[C@H](N[C@@H]1CSc2ccccc21)c1ccsc1 ZINC000443094589 330794572 /nfs/dbraw/zinc/79/45/72/330794572.db2.gz CZOMXZPBCLDMBQ-LSDHHAIUSA-N 0 1 289.469 5.026 20 0 CKADMN CCC[C@@H](N[C@@H](C)c1ccc(F)cc1F)c1ccsc1 ZINC000443097418 330794681 /nfs/dbraw/zinc/79/46/81/330794681.db2.gz YAWRUWIZDBWSNW-MEDUHNTESA-N 0 1 295.398 5.218 20 0 CKADMN CCC[C@H](N[C@@H](C)c1ccc(F)cc1F)c1ccsc1 ZINC000443097421 330794664 /nfs/dbraw/zinc/79/46/64/330794664.db2.gz YAWRUWIZDBWSNW-ZBEGNZNMSA-N 0 1 295.398 5.218 20 0 CKADMN Cc1ccc([C@H](C)NCc2ccc(-c3cccs3)cc2)o1 ZINC000444684228 261063339 /nfs/dbraw/zinc/06/33/39/261063339.db2.gz IVTVBFZYXQDYIX-AWEZNQCLSA-N 0 1 297.423 5.167 20 0 CKADMN Cc1ccc([C@@H](C)NCc2ccc(-c3cccs3)cc2)o1 ZINC000444684229 261063434 /nfs/dbraw/zinc/06/34/34/261063434.db2.gz IVTVBFZYXQDYIX-CQSZACIVSA-N 0 1 297.423 5.167 20 0 CKADMN CC[C@H](N[C@@H](C)c1cccs1)c1cccc(Cl)c1F ZINC000461089415 331311329 /nfs/dbraw/zinc/31/13/29/331311329.db2.gz QNFZPFMWZINDCY-GWCFXTLKSA-N 0 1 297.826 5.343 20 0 CKADMN CC[C@@H](N[C@@H](C)c1cccs1)c1cccc(Cl)c1F ZINC000461089416 331311231 /nfs/dbraw/zinc/31/12/31/331311231.db2.gz QNFZPFMWZINDCY-GXFFZTMASA-N 0 1 297.826 5.343 20 0 CKADMN CC[C@H](N[C@H](C)c1cccs1)c1cccc(Cl)c1F ZINC000461089417 331311212 /nfs/dbraw/zinc/31/12/12/331311212.db2.gz QNFZPFMWZINDCY-MFKMUULPSA-N 0 1 297.826 5.343 20 0 CKADMN CC[C@@H](N[C@H](C)c1cccs1)c1cccc(Cl)c1F ZINC000461089418 331311236 /nfs/dbraw/zinc/31/12/36/331311236.db2.gz QNFZPFMWZINDCY-ZWNOBZJWSA-N 0 1 297.826 5.343 20 0 CKADMN Cc1ccoc1CN[C@H](C)c1ccc(Cl)c2ccccc21 ZINC000462523829 331323094 /nfs/dbraw/zinc/32/30/94/331323094.db2.gz IRQSQVSCLONODH-CYBMUJFWSA-N 0 1 299.801 5.245 20 0 CKADMN Cc1ccoc1CN[C@@H](C)c1ccc(Cl)c2ccccc21 ZINC000462523830 331323053 /nfs/dbraw/zinc/32/30/53/331323053.db2.gz IRQSQVSCLONODH-ZDUSSCGKSA-N 0 1 299.801 5.245 20 0 CKADMN Cc1ccoc1CN[C@@H](CC(C)C)c1ccc(Cl)cc1 ZINC000462720363 331325667 /nfs/dbraw/zinc/32/56/67/331325667.db2.gz XDQFKMYRWKMBML-INIZCTEOSA-N 0 1 291.822 5.118 20 0 CKADMN Cc1ccoc1CN[C@H](CC(C)C)c1ccc(Cl)cc1 ZINC000462720365 331325594 /nfs/dbraw/zinc/32/55/94/331325594.db2.gz XDQFKMYRWKMBML-MRXNPFEDSA-N 0 1 291.822 5.118 20 0 CKADMN CC(C)(C)C[C@H](NCc1ccco1)c1ccc(Cl)cc1 ZINC000462722970 331325637 /nfs/dbraw/zinc/32/56/37/331325637.db2.gz CVJJEACERUFKBS-INIZCTEOSA-N 0 1 291.822 5.200 20 0 CKADMN CC(C)(C)C[C@@H](NCc1ccco1)c1ccc(Cl)cc1 ZINC000462722971 331325561 /nfs/dbraw/zinc/32/55/61/331325561.db2.gz CVJJEACERUFKBS-MRXNPFEDSA-N 0 1 291.822 5.200 20 0 CKADMN Cc1ccc(CN[C@@H](CC(C)C)c2ccc(Cl)cc2)o1 ZINC000462727343 331325761 /nfs/dbraw/zinc/32/57/61/331325761.db2.gz NJFPGEKSQAEQOK-KRWDZBQOSA-N 0 1 291.822 5.118 20 0 CKADMN Cc1ccc(CN[C@H](CC(C)C)c2ccc(Cl)cc2)o1 ZINC000462727344 331325737 /nfs/dbraw/zinc/32/57/37/331325737.db2.gz NJFPGEKSQAEQOK-QGZVFWFLSA-N 0 1 291.822 5.118 20 0 CKADMN Cc1ccoc1CN[C@@H](c1oc2ccccc2c1C)C(C)C ZINC000462748486 331327305 /nfs/dbraw/zinc/32/73/05/331327305.db2.gz IITSNXJQTLYIFY-GOSISDBHSA-N 0 1 297.398 5.130 20 0 CKADMN Cc1ccoc1CN[C@H](c1oc2ccccc2c1C)C(C)C ZINC000462748487 331327265 /nfs/dbraw/zinc/32/72/65/331327265.db2.gz IITSNXJQTLYIFY-SFHVURJKSA-N 0 1 297.398 5.130 20 0 CKADMN C[C@@H](N[C@H](C)c1ccc(Cl)c2ccccc21)c1ccco1 ZINC000462846483 331332565 /nfs/dbraw/zinc/33/25/65/331332565.db2.gz VOMIJIPDHIHHTA-CHWSQXEVSA-N 0 1 299.801 5.498 20 0 CKADMN C[C@@H](N[C@@H](C)c1ccco1)c1ccc(Cl)c2ccccc21 ZINC000462846484 331332557 /nfs/dbraw/zinc/33/25/57/331332557.db2.gz VOMIJIPDHIHHTA-OLZOCXBDSA-N 0 1 299.801 5.498 20 0 CKADMN C[C@@H](N[C@@H](C)c1ccc(Cl)c2ccccc21)c1ccco1 ZINC000462846485 331332521 /nfs/dbraw/zinc/33/25/21/331332521.db2.gz VOMIJIPDHIHHTA-QWHCGFSZSA-N 0 1 299.801 5.498 20 0 CKADMN C[C@H](N[C@@H](C)c1ccc(Cl)c2ccccc21)c1ccco1 ZINC000462846486 331332491 /nfs/dbraw/zinc/33/24/91/331332491.db2.gz VOMIJIPDHIHHTA-STQMWFEESA-N 0 1 299.801 5.498 20 0 CKADMN C[C@@H](N[C@H](C)c1cc2cccc(F)c2o1)c1ccsc1 ZINC000474108103 331571318 /nfs/dbraw/zinc/57/13/18/331571318.db2.gz VFUQVBYLEBANEJ-GHMZBOCLSA-N 0 1 289.375 5.045 20 0 CKADMN C[C@@H](N[C@@H](C)c1cc2cccc(F)c2o1)c1ccsc1 ZINC000474108104 331571283 /nfs/dbraw/zinc/57/12/83/331571283.db2.gz VFUQVBYLEBANEJ-MNOVXSKESA-N 0 1 289.375 5.045 20 0 CKADMN C[C@@H](N[C@@H](C)c1ccsc1)c1cc2cccc(F)c2o1 ZINC000474108108 331571276 /nfs/dbraw/zinc/57/12/76/331571276.db2.gz VFUQVBYLEBANEJ-WDEREUQCSA-N 0 1 289.375 5.045 20 0 CKADMN CCc1ccc([C@H](C)N[C@H](C)c2oc3ccccc3c2C)o1 ZINC000477852769 331691825 /nfs/dbraw/zinc/69/18/25/331691825.db2.gz MBUSSIUIBKDZRO-UONOGXRCSA-N 0 1 297.398 5.308 20 0 CKADMN CCc1ccc([C@@H](C)N[C@H](C)c2oc3ccccc3c2C)o1 ZINC000477852771 331691774 /nfs/dbraw/zinc/69/17/74/331691774.db2.gz MBUSSIUIBKDZRO-ZIAGYGMSSA-N 0 1 297.398 5.308 20 0 CKADMN CCc1ccc([C@H](C)N[C@@H](C)c2oc3ccccc3c2C)o1 ZINC000477858719 331692222 /nfs/dbraw/zinc/69/22/22/331692222.db2.gz MBUSSIUIBKDZRO-KBPBESRZSA-N 0 1 297.398 5.308 20 0 CKADMN CC(C)C[C@@H](NCc1ccsc1Cl)c1cccs1 ZINC000480662015 331780863 /nfs/dbraw/zinc/78/08/63/331780863.db2.gz LIKZHXLSTGDGCD-GFCCVEGCSA-N 0 1 299.892 5.340 20 0 CKADMN C[C@@H](NC(C)(C)c1cccs1)c1cccc(Cl)c1F ZINC000481009525 331794468 /nfs/dbraw/zinc/79/44/68/331794468.db2.gz BLTYWGICEDWYIP-SNVBAGLBSA-N 0 1 297.826 5.127 20 0 CKADMN CC[C@H](N[C@@H](C)c1cccc(Cl)c1F)c1cccs1 ZINC000481031868 331795426 /nfs/dbraw/zinc/79/54/26/331795426.db2.gz BFTVLNKRWVEGAB-GWCFXTLKSA-N 0 1 297.826 5.343 20 0 CKADMN Cc1ccc(CN[C@H](c2oc3ccccc3c2C)C(C)C)o1 ZINC000482137456 331825284 /nfs/dbraw/zinc/82/52/84/331825284.db2.gz DNIWDJHRGJEINT-SFHVURJKSA-N 0 1 297.398 5.130 20 0 CKADMN Cc1c2ccccc2oc1[C@H](N[C@@H](C)c1ccco1)C(C)C ZINC000482875848 331849970 /nfs/dbraw/zinc/84/99/70/331849970.db2.gz SUYASPYZYDVIMC-KBXCAEBGSA-N 0 1 297.398 5.382 20 0 CKADMN Cc1c2ccccc2oc1[C@@H](N[C@H](C)c1ccco1)C(C)C ZINC000482875850 331849950 /nfs/dbraw/zinc/84/99/50/331849950.db2.gz SUYASPYZYDVIMC-KDOFPFPSSA-N 0 1 297.398 5.382 20 0 CKADMN Cc1c2ccccc2oc1[C@@H](N[C@@H](C)c1ccco1)C(C)C ZINC000482875852 331850025 /nfs/dbraw/zinc/85/00/25/331850025.db2.gz SUYASPYZYDVIMC-KSSFIOAISA-N 0 1 297.398 5.382 20 0 CKADMN Cc1c2ccccc2oc1[C@H](N[C@H](C)c1ccco1)C(C)C ZINC000482875854 331850005 /nfs/dbraw/zinc/85/00/05/331850005.db2.gz SUYASPYZYDVIMC-RDTXWAMCSA-N 0 1 297.398 5.382 20 0 CKADMN CCc1ccc([C@@H](C)N[C@@H](CC)c2ccc(Cl)s2)o1 ZINC000483137680 331860081 /nfs/dbraw/zinc/86/00/81/331860081.db2.gz VCJBQBWDWKCPEQ-PWSUYJOCSA-N 0 1 297.851 5.359 20 0 CKADMN CCc1ccc([C@@H](C)N[C@H](CC)c2ccc(Cl)s2)o1 ZINC000483137681 331860188 /nfs/dbraw/zinc/86/01/88/331860188.db2.gz VCJBQBWDWKCPEQ-ZYHUDNBSSA-N 0 1 297.851 5.359 20 0 CKADMN CC(C)[C@@H](N[C@H](C)c1ccsc1)c1ccc(F)cc1F ZINC000484498411 331900402 /nfs/dbraw/zinc/90/04/02/331900402.db2.gz KFKYUDVTNDUOGR-BDJLRTHQSA-N 0 1 295.398 5.074 20 0 CKADMN CC(C)[C@@H](N[C@@H](C)c1ccsc1)c1ccc(F)cc1F ZINC000484498416 331900463 /nfs/dbraw/zinc/90/04/63/331900463.db2.gz KFKYUDVTNDUOGR-MEDUHNTESA-N 0 1 295.398 5.074 20 0 CKADMN CC(C)[C@H](N[C@@H](C)c1ccsc1)c1ccc(F)cc1F ZINC000484498417 331900488 /nfs/dbraw/zinc/90/04/88/331900488.db2.gz KFKYUDVTNDUOGR-ZBEGNZNMSA-N 0 1 295.398 5.074 20 0 CKADMN C[C@@H](N[C@H](c1ccccc1F)C1CCCC1)c1ccco1 ZINC000484622474 331902968 /nfs/dbraw/zinc/90/29/68/331902968.db2.gz SGTRNWLMXUXMNG-ACJLOTCBSA-N 0 1 287.378 5.001 20 0 CKADMN C[C@@H](N[C@@H](c1ccccc1F)C1CCCC1)c1ccco1 ZINC000484622475 331903131 /nfs/dbraw/zinc/90/31/31/331903131.db2.gz SGTRNWLMXUXMNG-FZKQIMNGSA-N 0 1 287.378 5.001 20 0 CKADMN Cc1ccccc1[C@H](CC(C)C)NCc1ccc(Cl)o1 ZINC000489067944 332040379 /nfs/dbraw/zinc/04/03/79/332040379.db2.gz MYIWMPYZLUOBQT-INIZCTEOSA-N 0 1 291.822 5.118 20 0 CKADMN Cc1ccccc1[C@@H](CC(C)C)NCc1ccc(Cl)o1 ZINC000489067945 332040256 /nfs/dbraw/zinc/04/02/56/332040256.db2.gz MYIWMPYZLUOBQT-MRXNPFEDSA-N 0 1 291.822 5.118 20 0 CKADMN CSc1ccccc1[C@@H](C)NCc1cc2ccccc2o1 ZINC000500448014 332609555 /nfs/dbraw/zinc/60/95/55/332609555.db2.gz TUNBWECCNLNMJE-CYBMUJFWSA-N 0 1 297.423 5.006 20 0 CKADMN CCC[C@H](NCc1ccco1)c1ccc(Cl)c(Cl)c1 ZINC000500898422 332621546 /nfs/dbraw/zinc/62/15/46/332621546.db2.gz UERLYZSVUNZQPR-HNNXBMFYSA-N 0 1 298.213 5.217 20 0 CKADMN Cc1cc([C@H](C)N[C@@H](C)c2oc3ccccc3c2C)oc1C ZINC000502371504 332655433 /nfs/dbraw/zinc/65/54/33/332655433.db2.gz HXFGBDKHCWWGGI-KBPBESRZSA-N 0 1 297.398 5.363 20 0 CKADMN CSc1ccc([C@@H](C)N[C@H](C)c2cc(C)c(C)o2)cc1 ZINC000502407353 262208713 /nfs/dbraw/zinc/20/87/13/262208713.db2.gz YBJYZMVDYCTZMG-CHWSQXEVSA-N 0 1 289.444 5.030 20 0 CKADMN CSc1ccc([C@@H](C)N[C@@H](C)c2cc(C)c(C)o2)cc1 ZINC000502407355 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ZINC000503868904 332697364 /nfs/dbraw/zinc/69/73/64/332697364.db2.gz CZMUMBKPLLEHDZ-CHWSQXEVSA-N 0 1 289.444 5.030 20 0 CKADMN CSc1ccccc1[C@@H](C)N[C@@H](C)c1cc(C)c(C)o1 ZINC000503878936 332697597 /nfs/dbraw/zinc/69/75/97/332697597.db2.gz ZVLSHYZGFCDNOF-OLZOCXBDSA-N 0 1 289.444 5.030 20 0 CKADMN CC(C)CC[C@H](NCc1ccco1)c1ccc(Cl)cc1 ZINC000513092425 333003945 /nfs/dbraw/zinc/00/39/45/333003945.db2.gz MPDLMIJYRZWWMP-KRWDZBQOSA-N 0 1 291.822 5.200 20 0 CKADMN CC(C)CC[C@@H](NCc1ccco1)c1ccc(Cl)cc1 ZINC000513092426 333003986 /nfs/dbraw/zinc/00/39/86/333003986.db2.gz MPDLMIJYRZWWMP-QGZVFWFLSA-N 0 1 291.822 5.200 20 0 CKADMN Cc1ccc([C@H](C)NCc2ccc(-c3ccccc3)o2)cc1 ZINC000513104329 333004461 /nfs/dbraw/zinc/00/44/61/333004461.db2.gz GXFPQLKDUILDKH-INIZCTEOSA-N 0 1 291.394 5.106 20 0 CKADMN Cc1ccc([C@@H](C)NCc2ccc(-c3ccccc3)o2)cc1 ZINC000513104330 333004448 /nfs/dbraw/zinc/00/44/48/333004448.db2.gz GXFPQLKDUILDKH-MRXNPFEDSA-N 0 1 291.394 5.106 20 0 CKADMN Cc1ccnc([C@@H](C)N[C@@H](C)c2ccc(CC(C)C)cc2)c1 ZINC000514086495 262162951 /nfs/dbraw/zinc/16/29/51/262162951.db2.gz BBLYBDYGXHGXTB-DLBZAZTESA-N 0 1 296.458 5.000 20 0 CKADMN Cc1ccnc([C@@H](C)N[C@H](C)c2ccc(CC(C)C)cc2)c1 ZINC000514086498 262162834 /nfs/dbraw/zinc/16/28/34/262162834.db2.gz BBLYBDYGXHGXTB-IAGOWNOFSA-N 0 1 296.458 5.000 20 0 CKADMN Cc1ccnc([C@H](C)N[C@@H](C)c2ccc(CC(C)C)cc2)c1 ZINC000514086500 262162916 /nfs/dbraw/zinc/16/29/16/262162916.db2.gz BBLYBDYGXHGXTB-IRXDYDNUSA-N 0 1 296.458 5.000 20 0 CKADMN Cc1ccnc([C@H](C)N[C@H](C)c2ccc(CC(C)C)cc2)c1 ZINC000514086501 262162638 /nfs/dbraw/zinc/16/26/38/262162638.db2.gz BBLYBDYGXHGXTB-SJORKVTESA-N 0 1 296.458 5.000 20 0 CKADMN CC[C@@H](NCc1cc(C)ccc1F)c1ccc(Cl)s1 ZINC000523935936 333349482 /nfs/dbraw/zinc/34/94/82/333349482.db2.gz PWNLWYPBDRFAMT-CYBMUJFWSA-N 0 1 297.826 5.090 20 0 CKADMN CC[C@H](NCc1cc(C)ccc1F)c1ccc(Cl)s1 ZINC000523935937 333349600 /nfs/dbraw/zinc/34/96/00/333349600.db2.gz PWNLWYPBDRFAMT-ZDUSSCGKSA-N 0 1 297.826 5.090 20 0 CKADMN Cc1c2ccccc2oc1[C@H](C)NCc1cc(C)ccc1F ZINC000523937970 333349782 /nfs/dbraw/zinc/34/97/82/333349782.db2.gz PBKKHYKLJAEBRT-AWEZNQCLSA-N 0 1 297.373 5.040 20 0 CKADMN Cc1c2ccccc2oc1[C@@H](C)NCc1cc(C)ccc1F ZINC000523937971 333349792 /nfs/dbraw/zinc/34/97/92/333349792.db2.gz PBKKHYKLJAEBRT-CQSZACIVSA-N 0 1 297.373 5.040 20 0 CKADMN CC(C)(NCc1ccc(-c2ccccc2)o1)c1cccs1 ZINC000523940172 333349814 /nfs/dbraw/zinc/34/98/14/333349814.db2.gz YSVOPMTUQYZABS-UHFFFAOYSA-N 0 1 297.423 5.033 20 0 CKADMN CCC[C@H](NCc1ccc([C@@H]2C[C@H]2C)o1)c1ccsc1 ZINC000525954941 329682753 /nfs/dbraw/zinc/68/27/53/329682753.db2.gz PQEJGVUNVNNFEF-WQVCFCJDSA-N 0 1 289.444 5.096 20 0 CKADMN Cc1c2ccccc2oc1[C@H](N[C@@H](C)c1ccoc1)C(C)C ZINC000531715140 328028289 /nfs/dbraw/zinc/02/82/89/328028289.db2.gz PABYLQNMURITPA-KBXCAEBGSA-N 0 1 297.398 5.382 20 0 CKADMN Cc1c2ccccc2oc1[C@@H](N[C@H](C)c1ccoc1)C(C)C ZINC000531715141 328028321 /nfs/dbraw/zinc/02/83/21/328028321.db2.gz PABYLQNMURITPA-KDOFPFPSSA-N 0 1 297.398 5.382 20 0 CKADMN Cc1c2ccccc2oc1[C@@H](N[C@@H](C)c1ccoc1)C(C)C ZINC000531715142 328028246 /nfs/dbraw/zinc/02/82/46/328028246.db2.gz PABYLQNMURITPA-KSSFIOAISA-N 0 1 297.398 5.382 20 0 CKADMN Cc1c2ccccc2oc1[C@H](N[C@H](C)c1ccoc1)C(C)C ZINC000531715143 328028334 /nfs/dbraw/zinc/02/83/34/328028334.db2.gz PABYLQNMURITPA-RDTXWAMCSA-N 0 1 297.398 5.382 20 0 CKADMN C[C@H](N[C@@H](CC(C)(C)C)c1ccc(F)cc1)c1ccco1 ZINC000531938001 328319871 /nfs/dbraw/zinc/31/98/71/328319871.db2.gz ZEECZENRJJRDOF-BBRMVZONSA-N 0 1 289.394 5.247 20 0 CKADMN C[C@@H](N[C@@H](CC(C)(C)C)c1ccc(F)cc1)c1ccco1 ZINC000531938002 328319663 /nfs/dbraw/zinc/31/96/63/328319663.db2.gz ZEECZENRJJRDOF-CJNGLKHVSA-N 0 1 289.394 5.247 20 0 CKADMN C[C@@H](N[C@H](CC(C)(C)C)c1ccc(F)cc1)c1ccco1 ZINC000531938003 328319725 /nfs/dbraw/zinc/31/97/25/328319725.db2.gz ZEECZENRJJRDOF-CZUORRHYSA-N 0 1 289.394 5.247 20 0 CKADMN C[C@H](N[C@H](CC(C)(C)C)c1ccc(F)cc1)c1ccco1 ZINC000531938004 328319817 /nfs/dbraw/zinc/31/98/17/328319817.db2.gz ZEECZENRJJRDOF-XJKSGUPXSA-N 0 1 289.394 5.247 20 0 CKADMN CCSc1ccc([C@H](C)N[C@@H](C)c2ccc(C)o2)cc1 ZINC000531960817 328343898 /nfs/dbraw/zinc/34/38/98/328343898.db2.gz VVZGEKVZWWTBHA-KBPBESRZSA-N 0 1 289.444 5.112 20 0 CKADMN CCSc1ccc([C@@H](C)N[C@@H](C)c2ccc(C)o2)cc1 ZINC000531960818 328343894 /nfs/dbraw/zinc/34/38/94/328343894.db2.gz VVZGEKVZWWTBHA-KGLIPLIRSA-N 0 1 289.444 5.112 20 0 CKADMN CCSc1ccc([C@H](C)N[C@H](C)c2ccc(C)o2)cc1 ZINC000531960819 328343949 /nfs/dbraw/zinc/34/39/49/328343949.db2.gz VVZGEKVZWWTBHA-UONOGXRCSA-N 0 1 289.444 5.112 20 0 CKADMN CCSc1ccc([C@@H](C)N[C@H](C)c2ccc(C)o2)cc1 ZINC000531960820 328343824 /nfs/dbraw/zinc/34/38/24/328343824.db2.gz VVZGEKVZWWTBHA-ZIAGYGMSSA-N 0 1 289.444 5.112 20 0 CKADMN C[C@@H](N[C@@H](c1ccccc1F)C1CCCC1)c1ccoc1 ZINC000532247062 328711160 /nfs/dbraw/zinc/71/11/60/328711160.db2.gz KDNWYIKSVVHGST-FZKQIMNGSA-N 0 1 287.378 5.001 20 0 CKADMN C[C@H](N[C@@H](c1ccccc1F)C1CCCC1)c1ccoc1 ZINC000532247063 328711261 /nfs/dbraw/zinc/71/12/61/328711261.db2.gz KDNWYIKSVVHGST-SCLBCKFNSA-N 0 1 287.378 5.001 20 0 CKADMN CC[C@H](N[C@@H](C)c1ccccc1F)c1ccc(Cl)s1 ZINC000532499905 328784341 /nfs/dbraw/zinc/78/43/41/328784341.db2.gz FOXRXGFSNSMJQR-GWCFXTLKSA-N 0 1 297.826 5.343 20 0 CKADMN CC[C@@H](N[C@@H](C)c1ccccc1F)c1ccc(Cl)s1 ZINC000532499919 328784266 /nfs/dbraw/zinc/78/42/66/328784266.db2.gz FOXRXGFSNSMJQR-GXFFZTMASA-N 0 1 297.826 5.343 20 0 CKADMN Cc1ccsc1[C@@H](C)N[C@H](C)c1c(F)cccc1Cl ZINC000536878133 330314143 /nfs/dbraw/zinc/31/41/43/330314143.db2.gz PXWLTHRKUCIONI-GHMZBOCLSA-N 0 1 297.826 5.261 20 0 CKADMN Cc1ccsc1[C@H](C)N[C@H](C)c1c(F)cccc1Cl ZINC000536878144 330314123 /nfs/dbraw/zinc/31/41/23/330314123.db2.gz PXWLTHRKUCIONI-MNOVXSKESA-N 0 1 297.826 5.261 20 0 CKADMN Cc1ccsc1[C@H](C)N[C@@H](C)c1c(F)cccc1Cl ZINC000536878146 330314178 /nfs/dbraw/zinc/31/41/78/330314178.db2.gz PXWLTHRKUCIONI-QWRGUYRKSA-N 0 1 297.826 5.261 20 0 CKADMN Cc1ccsc1[C@@H](C)N[C@@H](C)c1c(F)cccc1Cl ZINC000536878148 330314174 /nfs/dbraw/zinc/31/41/74/330314174.db2.gz PXWLTHRKUCIONI-WDEREUQCSA-N 0 1 297.826 5.261 20 0 CKADMN CCC(CC)[C@H](N[C@H](C)c1cscn1)c1cccs1 ZINC000537966741 330375585 /nfs/dbraw/zinc/37/55/85/330375585.db2.gz CJUVTGHTSLNVEV-ABAIWWIYSA-N 0 1 294.489 5.033 20 0 CKADMN CCC(CC)[C@@H](N[C@H](C)c1cscn1)c1cccs1 ZINC000537966742 330375496 /nfs/dbraw/zinc/37/54/96/330375496.db2.gz CJUVTGHTSLNVEV-IAQYHMDHSA-N 0 1 294.489 5.033 20 0 CKADMN CCC(CC)[C@H](N[C@@H](C)c1cscn1)c1cccs1 ZINC000537966743 330375538 /nfs/dbraw/zinc/37/55/38/330375538.db2.gz CJUVTGHTSLNVEV-NHYWBVRUSA-N 0 1 294.489 5.033 20 0 CKADMN CCC(CC)[C@@H](N[C@@H](C)c1cscn1)c1cccs1 ZINC000537966744 330375590 /nfs/dbraw/zinc/37/55/90/330375590.db2.gz CJUVTGHTSLNVEV-XHDPSFHLSA-N 0 1 294.489 5.033 20 0 CKADMN CC(C)[C@H](NCc1ccco1)c1ccc(Cl)c(Cl)c1 ZINC000538060123 333572671 /nfs/dbraw/zinc/57/26/71/333572671.db2.gz KXKJJHKGAARTLI-HNNXBMFYSA-N 0 1 298.213 5.073 20 0 CKADMN CCc1ccc([C@@H](C)N[C@H](C)c2cccc(F)c2F)s1 ZINC000539047186 333651035 /nfs/dbraw/zinc/65/10/35/333651035.db2.gz TYRGAMZNKONCPI-GHMZBOCLSA-N 0 1 295.398 5.001 20 0 CKADMN CCc1ccc([C@H](C)N[C@@H](C)c2cccc(F)c2F)s1 ZINC000539047188 326928788 /nfs/dbraw/zinc/92/87/88/326928788.db2.gz TYRGAMZNKONCPI-QWRGUYRKSA-N 0 1 295.398 5.001 20 0 CKADMN CC[C@H](N[C@H](C)c1ccc(C)s1)c1cc(F)ccc1F ZINC000539080573 333655890 /nfs/dbraw/zinc/65/58/90/333655890.db2.gz VJLJSNOFGJTKKS-ABAIWWIYSA-N 0 1 295.398 5.137 20 0 CKADMN CC[C@@H](N[C@@H](C)c1ccc(C)s1)c1cc(F)ccc1F ZINC000539080583 517776941 /nfs/dbraw/zinc/77/69/41/517776941.db2.gz VJLJSNOFGJTKKS-XHDPSFHLSA-N 0 1 295.398 5.137 20 0 CKADMN CC(C)[C@H](NCc1ccoc1)c1ccc(Cl)c(Cl)c1 ZINC000539160936 333659965 /nfs/dbraw/zinc/65/99/65/333659965.db2.gz IULDETWXFJXJHL-HNNXBMFYSA-N 0 1 298.213 5.073 20 0 CKADMN CC(C)[C@@H](N[C@H](C)c1ccoc1)c1ccc(Cl)cc1F ZINC000543799724 333899530 /nfs/dbraw/zinc/89/95/30/333899530.db2.gz UOXLFIOEFDECKD-BDJLRTHQSA-N 0 1 295.785 5.120 20 0 CKADMN Cc1cc(CN[C@@H](C)c2ccoc2)ccc1-c1ccccc1 ZINC000547979547 334133222 /nfs/dbraw/zinc/13/32/22/334133222.db2.gz RQKXBYSTCSHBDU-INIZCTEOSA-N 0 1 291.394 5.106 20 0 CKADMN Cc1cc(CN[C@H](C)c2ccoc2)ccc1-c1ccccc1 ZINC000547979548 334133291 /nfs/dbraw/zinc/13/32/91/334133291.db2.gz RQKXBYSTCSHBDU-MRXNPFEDSA-N 0 1 291.394 5.106 20 0 CKADMN C[C@H](NC1(c2ccccc2F)CC1)c1cccc(C2CC2)c1 ZINC000550751099 334228351 /nfs/dbraw/zinc/22/83/51/334228351.db2.gz HEYRCJNHWYKFFI-AWEZNQCLSA-N 0 1 295.401 5.043 20 0 CKADMN C[C@@H](NC1(c2ccccc2F)CC1)c1cccc(C2CC2)c1 ZINC000550751103 334228364 /nfs/dbraw/zinc/22/83/64/334228364.db2.gz HEYRCJNHWYKFFI-CQSZACIVSA-N 0 1 295.401 5.043 20 0 CKADMN Cc1cc(N2CCCCCC2)ccc1N[C@@H](C)c1ccco1 ZINC000552320972 334316674 /nfs/dbraw/zinc/31/66/74/334316674.db2.gz IKRYJBAXMUILEJ-INIZCTEOSA-N 0 1 298.430 5.142 20 0 CKADMN Cc1cc(N2CCCCCC2)ccc1N[C@H](C)c1ccco1 ZINC000552320973 334316735 /nfs/dbraw/zinc/31/67/35/334316735.db2.gz IKRYJBAXMUILEJ-MRXNPFEDSA-N 0 1 298.430 5.142 20 0 CKADMN C[C@@H](N[C@H]1CSc2ccccc21)c1cccc(C2CC2)c1 ZINC000556094374 334495243 /nfs/dbraw/zinc/49/52/43/334495243.db2.gz SQUZHXXCFKTXKD-ACJLOTCBSA-N 0 1 295.451 5.062 20 0 CKADMN C[C@@H](N[C@@H]1CSc2ccccc21)c1cccc(C2CC2)c1 ZINC000556094375 334495221 /nfs/dbraw/zinc/49/52/21/334495221.db2.gz SQUZHXXCFKTXKD-FZKQIMNGSA-N 0 1 295.451 5.062 20 0 CKADMN C[C@H](N[C@@H]1CSc2ccccc21)c1cccc(C2CC2)c1 ZINC000556094376 334495262 /nfs/dbraw/zinc/49/52/62/334495262.db2.gz SQUZHXXCFKTXKD-SCLBCKFNSA-N 0 1 295.451 5.062 20 0 CKADMN C[C@H](N[C@H]1CSc2ccccc21)c1cccc(C2CC2)c1 ZINC000556094377 334495271 /nfs/dbraw/zinc/49/52/71/334495271.db2.gz SQUZHXXCFKTXKD-UGSOOPFHSA-N 0 1 295.451 5.062 20 0 CKADMN Cc1ccoc1CN[C@@H](C)c1ccc(-c2cccs2)cc1 ZINC000561409201 327393069 /nfs/dbraw/zinc/39/30/69/327393069.db2.gz XXNMRDKCEZHZRZ-AWEZNQCLSA-N 0 1 297.423 5.167 20 0 CKADMN Cc1ccoc1CN[C@H](C)c1ccc(-c2cccs2)cc1 ZINC000561409205 327393084 /nfs/dbraw/zinc/39/30/84/327393084.db2.gz XXNMRDKCEZHZRZ-CQSZACIVSA-N 0 1 297.423 5.167 20 0 CKADMN C[C@H](N[C@@H](C)c1ccccc1F)c1cccc(C2CC2)c1 ZINC000570990451 327971514 /nfs/dbraw/zinc/97/15/14/327971514.db2.gz JRYLMYKMFNZOEY-KBPBESRZSA-N 0 1 283.390 5.115 20 0 CKADMN C[C@@H](N[C@@H](C)c1ccccc1F)c1cccc(C2CC2)c1 ZINC000570990452 327971518 /nfs/dbraw/zinc/97/15/18/327971518.db2.gz JRYLMYKMFNZOEY-KGLIPLIRSA-N 0 1 283.390 5.115 20 0 CKADMN C[C@@H](N[C@@H](C)c1cccc(C2CC2)c1)c1ccccc1F ZINC000570990453 327971508 /nfs/dbraw/zinc/97/15/08/327971508.db2.gz JRYLMYKMFNZOEY-UONOGXRCSA-N 0 1 283.390 5.115 20 0 CKADMN Cc1ccc2oc(CN[C@H](C)c3ccc(Cl)cc3)cc2c1 ZINC000577802360 335402106 /nfs/dbraw/zinc/40/21/06/335402106.db2.gz UUFTYYSUVSPZBO-CYBMUJFWSA-N 0 1 299.801 5.245 20 0 CKADMN