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(C(C)C)P(OCc1ccccc1)OCc1ccccc1 ZINC000216644079 564153694 /nfs/dbraw/zinc/15/36/94/564153694.db2.gz ZUUQBOHQXAUFBS-UHFFFAOYSA-N 0 0 344.435 6.413 40 70 EKIBRN FC(F)(F)c1cccc(Cn2ccc(-c3cc4ccccc4o3)n2)c1 ZINC000216690278 241204618 /nfs/dbraw/zinc/20/46/18/241204618.db2.gz NDXYMZDFSHGRIM-UHFFFAOYSA-N 0 0 342.320 5.363 40 70 EKIBRN CCc1ccc(-n2ccc([C@@H]3OCCN3c3ccc(CC)cc3)c2)cc1 ZINC000216730353 241206988 /nfs/dbraw/zinc/20/69/88/241206988.db2.gz AGKFLZHMQDIYMR-QHCPKHFHSA-N 0 0 346.474 5.138 40 70 EKIBRN CCc1ccc(-n2ccc([C@H]3OCCN3c3ccc(CC)cc3)c2)cc1 ZINC000216730399 241206390 /nfs/dbraw/zinc/20/63/90/241206390.db2.gz AGKFLZHMQDIYMR-HSZRJFAPSA-N 0 0 346.474 5.138 40 70 EKIBRN CCc1ccc(N2CCO[C@@H]2c2ccn(-c3ccccc3CC)c2)cc1 ZINC000216730679 536184911 /nfs/dbraw/zinc/18/49/11/536184911.db2.gz DJBVOVWOTNOCSL-HSZRJFAPSA-N 0 0 346.474 5.138 40 70 EKIBRN CCc1ccc(N2CCO[C@H]2c2ccn(-c3ccccc3CC)c2)cc1 ZINC000216730727 536184918 /nfs/dbraw/zinc/18/49/18/536184918.db2.gz DJBVOVWOTNOCSL-QHCPKHFHSA-N 0 0 346.474 5.138 40 70 EKIBRN CC(C)c1ccc2oc(CCc3nc4cc(C(C)C)ccc4o3)nc2c1 ZINC000216740349 241208965 /nfs/dbraw/zinc/20/89/65/241208965.db2.gz RXRPIAGNANOECT-UHFFFAOYSA-N 0 0 348.446 6.001 40 70 EKIBRN CCc1ccc2oc(CCCc3nc4cc(CC)ccc4o3)nc2c1 ZINC000216741013 535833026 /nfs/dbraw/zinc/83/30/26/535833026.db2.gz ANMJNNGYHJLNGF-UHFFFAOYSA-N 0 0 334.419 5.269 40 70 EKIBRN Cc1cc2nc(CCCc3nc4cc(C)cc(C)c4o3)oc2c(C)c1 ZINC000216741070 241208779 /nfs/dbraw/zinc/20/87/79/241208779.db2.gz JDEIJGBPWXLHMD-UHFFFAOYSA-N 0 0 334.419 5.378 40 70 EKIBRN Cc1cc2nc(CCCc3nc4cc(C)c(C)cc4o3)oc2cc1C ZINC000216741141 241208209 /nfs/dbraw/zinc/20/82/09/241208209.db2.gz DDEZFSRJDKWONI-UHFFFAOYSA-N 0 0 334.419 5.378 40 70 EKIBRN CCOC(=O)c1cc(-c2ccc3ccccc3c2)nc2ccccc21 ZINC000216941567 241224795 /nfs/dbraw/zinc/22/47/95/241224795.db2.gz ITNAYHCYYINILD-UHFFFAOYSA-N 0 0 327.383 5.232 40 70 EKIBRN CCOC(=O)c1cc(-c2ccc(C)c3ccccc32)nc2ccccc21 ZINC000216941752 241225898 /nfs/dbraw/zinc/22/58/98/241225898.db2.gz RWJFLTHFZNKYCB-UHFFFAOYSA-N 0 0 341.410 5.540 40 70 EKIBRN COC(=O)c1cc(-c2ccc(C)c3ccccc32)nc2ccccc21 ZINC000216941781 241225388 /nfs/dbraw/zinc/22/53/88/241225388.db2.gz CXJQQPCKNKFKET-UHFFFAOYSA-N 0 0 327.383 5.150 40 70 EKIBRN COc1ccccc1NC(=O)Nc1ccc(Oc2ccccc2)cc1 ZINC000217267997 241244451 /nfs/dbraw/zinc/24/44/51/241244451.db2.gz OQMHIKNPKOESLX-UHFFFAOYSA-N 0 0 334.375 5.132 40 70 EKIBRN COc1ccccc1NC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000217268012 241244740 /nfs/dbraw/zinc/24/47/40/241244740.db2.gz PRMOGZGYYYRYGH-UHFFFAOYSA-N 0 0 344.720 5.011 40 70 EKIBRN CC[C@@H](NC(=O)Nc1ccc(Cl)cc1)c1ccc2c(c1)CCCC2 ZINC000217272366 241244599 /nfs/dbraw/zinc/24/45/99/241244599.db2.gz UBMKQMPLOHVXCW-LJQANCHMSA-N 0 0 342.870 5.492 40 70 EKIBRN CC[C@H](NC(=O)Nc1ccc(Cl)cc1)c1ccc2c(c1)CCCC2 ZINC000217272368 241243640 /nfs/dbraw/zinc/24/36/40/241243640.db2.gz UBMKQMPLOHVXCW-IBGZPJMESA-N 0 0 342.870 5.492 40 70 EKIBRN C[C@@H](NC(=O)Nc1ccc(Cl)cc1)c1ccc2c(c1)CCCC2 ZINC000217272371 241244324 /nfs/dbraw/zinc/24/43/24/241244324.db2.gz LWHCZMPOYJIPLD-CYBMUJFWSA-N 0 0 328.843 5.102 40 70 EKIBRN C[C@H](NC(=O)Nc1ccc(Cl)cc1)c1ccc2c(c1)CCCC2 ZINC000217272373 241245068 /nfs/dbraw/zinc/24/50/68/241245068.db2.gz LWHCZMPOYJIPLD-ZDUSSCGKSA-N 0 0 328.843 5.102 40 70 EKIBRN CC[C@@H](NC(=O)Nc1cccc(Cl)c1)c1ccc2c(c1)CCCC2 ZINC000217275419 535796633 /nfs/dbraw/zinc/79/66/33/535796633.db2.gz POQYPKXQKYIHOY-LJQANCHMSA-N 0 0 342.870 5.492 40 70 EKIBRN CC[C@H](NC(=O)Nc1cccc(Cl)c1)c1ccc2c(c1)CCCC2 ZINC000217275421 241244395 /nfs/dbraw/zinc/24/43/95/241244395.db2.gz POQYPKXQKYIHOY-IBGZPJMESA-N 0 0 342.870 5.492 40 70 EKIBRN C[C@@H](NC(=O)Nc1cccc(Cl)c1)c1ccc2c(c1)CCCC2 ZINC000217275423 241243547 /nfs/dbraw/zinc/24/35/47/241243547.db2.gz NOAUQGOLEYMDRV-CYBMUJFWSA-N 0 0 328.843 5.102 40 70 EKIBRN C[C@H](NC(=O)Nc1cccc(Cl)c1)c1ccc2c(c1)CCCC2 ZINC000217275425 241244398 /nfs/dbraw/zinc/24/43/98/241244398.db2.gz NOAUQGOLEYMDRV-ZDUSSCGKSA-N 0 0 328.843 5.102 40 70 EKIBRN Cc1cccc2c(Nc3ccccc3)cc(/C=C/c3ccccc3)nc12 ZINC000217446667 241250928 /nfs/dbraw/zinc/25/09/28/241250928.db2.gz HYNFTWUQIKWUSQ-FOCLMDBBSA-N 0 0 336.438 6.457 40 70 EKIBRN CCC[C@@H](C)Oc1ccc2c(c1)c(C(=O)OCC)c(C)n2CCC ZINC000217763002 241273017 /nfs/dbraw/zinc/27/30/17/241273017.db2.gz GLUPEJOUHIJNAZ-CQSZACIVSA-N 0 0 331.456 5.104 40 70 EKIBRN CCC[C@H](C)Oc1ccc2c(c1)c(C(=O)OCC)c(C)n2CCC ZINC000217763083 241273028 /nfs/dbraw/zinc/27/30/28/241273028.db2.gz GLUPEJOUHIJNAZ-AWEZNQCLSA-N 0 0 331.456 5.104 40 70 EKIBRN CCCCn1c(C)c(C(=O)OCC)c2cc(O[C@@H](C)CCC)ccc21 ZINC000217763196 241273463 /nfs/dbraw/zinc/27/34/63/241273463.db2.gz DDUDWXITDQHDDJ-HNNXBMFYSA-N 0 0 345.483 5.494 40 70 EKIBRN CCCCn1c(C)c(C(=O)OCC)c2cc(O[C@H](C)CCC)ccc21 ZINC000217763275 241272776 /nfs/dbraw/zinc/27/27/76/241272776.db2.gz DDUDWXITDQHDDJ-OAHLLOKOSA-N 0 0 345.483 5.494 40 70 EKIBRN CCC[C@@H](C)Oc1ccc2c(c1)c(C(=O)OCC)c(C)n2CC(C)C ZINC000217763586 241273553 /nfs/dbraw/zinc/27/35/53/241273553.db2.gz PHLNBWWYNHYIHY-OAHLLOKOSA-N 0 0 345.483 5.350 40 70 EKIBRN CCC[C@H](C)Oc1ccc2c(c1)c(C(=O)OCC)c(C)n2CC(C)C ZINC000217763665 241272717 /nfs/dbraw/zinc/27/27/17/241272717.db2.gz PHLNBWWYNHYIHY-HNNXBMFYSA-N 0 0 345.483 5.350 40 70 EKIBRN CCCCOc1ccc2c(c1)c(C(=O)OCC)c(C)n2CCCC ZINC000217766308 535327709 /nfs/dbraw/zinc/32/77/09/535327709.db2.gz MSFQWPMLNHUEFD-UHFFFAOYSA-N 0 0 331.456 5.105 40 70 EKIBRN CCCCn1c(C)c(C(=O)OCC)c2cc(OC3CCCC3)ccc21 ZINC000217768395 241275163 /nfs/dbraw/zinc/27/51/63/241275163.db2.gz OADMDNLIRKCZTD-UHFFFAOYSA-N 0 0 343.467 5.248 40 70 EKIBRN CCOC(=O)c1c(C)n(CC(C)C)c2ccc(OC3CCCC3)cc21 ZINC000217768592 241274864 /nfs/dbraw/zinc/27/48/64/241274864.db2.gz PDGAKINXGFPABJ-UHFFFAOYSA-N 0 0 343.467 5.104 40 70 EKIBRN CC[C@@H](NC(=O)c1ccc(Cl)cc1Cl)c1ccc(C)c(C)c1 ZINC000217856300 535800312 /nfs/dbraw/zinc/80/03/12/535800312.db2.gz QVUHYFPEZDZVTO-QGZVFWFLSA-N 0 0 336.262 5.491 40 70 EKIBRN CC[C@H](NC(=O)c1ccc(Cl)cc1Cl)c1ccc(C)c(C)c1 ZINC000217856365 535874574 /nfs/dbraw/zinc/87/45/74/535874574.db2.gz QVUHYFPEZDZVTO-KRWDZBQOSA-N 0 0 336.262 5.491 40 70 EKIBRN CC[C@@H](NC(=O)c1ccc(Cl)cc1Cl)c1ccc(C)cc1C ZINC000217856461 535800376 /nfs/dbraw/zinc/80/03/76/535800376.db2.gz MKDQOUAWUUZEBM-QGZVFWFLSA-N 0 0 336.262 5.491 40 70 EKIBRN CC[C@H](NC(=O)c1ccc(Cl)cc1Cl)c1ccc(C)cc1C ZINC000217856532 535874152 /nfs/dbraw/zinc/87/41/52/535874152.db2.gz MKDQOUAWUUZEBM-KRWDZBQOSA-N 0 0 336.262 5.491 40 70 EKIBRN CC(C)c1ccc(CCCNC(=O)c2ccc(C(C)(C)C)cc2)cc1 ZINC000217860842 241279449 /nfs/dbraw/zinc/27/94/49/241279449.db2.gz MSTXWVPPUTVENR-UHFFFAOYSA-N 0 0 337.507 5.470 40 70 EKIBRN O=C(/C=C/c1ccccc1Cl)Nc1ccc(OC2CCCC2)cc1 ZINC000217900501 241283469 /nfs/dbraw/zinc/28/34/69/241283469.db2.gz PMBXDRCLPZIISW-NTEUORMPSA-N 0 0 341.838 5.313 40 70 EKIBRN CC[C@@H](NC(=O)/C=C/c1ccccc1Cl)c1ccc(C)c(C)c1 ZINC000217902463 241284337 /nfs/dbraw/zinc/28/43/37/241284337.db2.gz YUGFHKWPGJPQFW-TZZQJPOUSA-N 0 0 327.855 5.238 40 70 EKIBRN CC[C@H](NC(=O)/C=C/c1ccccc1Cl)c1ccc(C)c(C)c1 ZINC000217902522 536144541 /nfs/dbraw/zinc/14/45/41/536144541.db2.gz YUGFHKWPGJPQFW-CVTTXWKISA-N 0 0 327.855 5.238 40 70 EKIBRN CC[C@@H](NC(=O)/C=C/c1ccccc1Cl)c1ccc(C)cc1C ZINC000217902620 241284294 /nfs/dbraw/zinc/28/42/94/241284294.db2.gz OISLCCYURLIMPR-FMAYLGMYSA-N 0 0 327.855 5.238 40 70 EKIBRN CC[C@H](NC(=O)/C=C/c1ccccc1Cl)c1ccc(C)cc1C ZINC000217902689 536144307 /nfs/dbraw/zinc/14/43/07/536144307.db2.gz OISLCCYURLIMPR-RDELFYGPSA-N 0 0 327.855 5.238 40 70 EKIBRN CC(C)c1ccc(CCCNC(=O)/C=C/c2ccccc2Cl)cc1 ZINC000217903854 535371038 /nfs/dbraw/zinc/37/10/38/535371038.db2.gz NLJHXVASMQYYCE-BUHFOSPRSA-N 0 0 341.882 5.226 40 70 EKIBRN C[C@]12C[C@@H]3C[C@](Nc4nc(Cl)nc5ccccc54)(C1)C[C@@](C)(C3)C2 ZINC000217949484 241284898 /nfs/dbraw/zinc/28/48/98/241284898.db2.gz KDJSRQQEECHROQ-FCZGVQRQSA-N 0 0 341.886 5.444 40 70 EKIBRN CC[C@@H](NC(=O)/C=C/c1ccc(C(C)(C)C)cc1)c1ccc(C)c(C)c1 ZINC000217954038 241287379 /nfs/dbraw/zinc/28/73/79/241287379.db2.gz XUYRBZNLTVBSMO-DAXPHYLKSA-N 0 0 349.518 5.882 40 70 EKIBRN CC[C@H](NC(=O)/C=C/c1ccc(C(C)(C)C)cc1)c1ccc(C)c(C)c1 ZINC000217954114 241288785 /nfs/dbraw/zinc/28/87/85/241288785.db2.gz XUYRBZNLTVBSMO-QMUTUGEISA-N 0 0 349.518 5.882 40 70 EKIBRN CC[C@@H](NC(=O)/C=C/c1ccc(C(C)(C)C)cc1)c1ccc(C)cc1C ZINC000217954213 241287541 /nfs/dbraw/zinc/28/75/41/241287541.db2.gz ITMYAYXNJCEBFD-DAXPHYLKSA-N 0 0 349.518 5.882 40 70 EKIBRN CC[C@H](NC(=O)/C=C/c1ccc(C(C)(C)C)cc1)c1ccc(C)cc1C ZINC000217954291 241287520 /nfs/dbraw/zinc/28/75/20/241287520.db2.gz ITMYAYXNJCEBFD-QMUTUGEISA-N 0 0 349.518 5.882 40 70 EKIBRN O=C(/C=C/c1ccc(Cl)cc1)Nc1ccc(OC2CCCC2)cc1 ZINC000217958865 241287504 /nfs/dbraw/zinc/28/75/04/241287504.db2.gz UADJOKLIIQHFSA-VGOFMYFVSA-N 0 0 341.838 5.313 40 70 EKIBRN CC[C@@H](NC(=O)/C=C/c1ccc(Cl)cc1)c1ccc(C)c(C)c1 ZINC000217960680 241288178 /nfs/dbraw/zinc/28/81/78/241288178.db2.gz YBUVGDZBFXSXFC-YRVHBARZSA-N 0 0 327.855 5.238 40 70 EKIBRN CC[C@H](NC(=O)/C=C/c1ccc(Cl)cc1)c1ccc(C)c(C)c1 ZINC000217960749 241287178 /nfs/dbraw/zinc/28/71/78/241287178.db2.gz YBUVGDZBFXSXFC-BEBFYNPSSA-N 0 0 327.855 5.238 40 70 EKIBRN CC[C@@H](NC(=O)/C=C/c1ccc(Cl)cc1)c1ccc(C)cc1C ZINC000217960867 241287833 /nfs/dbraw/zinc/28/78/33/241287833.db2.gz LKHYBHLXELLVKP-YRVHBARZSA-N 0 0 327.855 5.238 40 70 EKIBRN CC[C@H](NC(=O)/C=C/c1ccc(Cl)cc1)c1ccc(C)cc1C ZINC000217960944 241287418 /nfs/dbraw/zinc/28/74/18/241287418.db2.gz LKHYBHLXELLVKP-BEBFYNPSSA-N 0 0 327.855 5.238 40 70 EKIBRN CC(C)c1ccc(CCCNC(=O)/C=C/c2ccc(Cl)cc2)cc1 ZINC000217963319 535370981 /nfs/dbraw/zinc/37/09/81/535370981.db2.gz KDHBMPTWOODCAA-NTEUORMPSA-N 0 0 341.882 5.226 40 70 EKIBRN Cc1ccc(SCC(=O)Nc2ccc(OC3CCCC3)cc2)cc1 ZINC000217976310 241287225 /nfs/dbraw/zinc/28/72/25/241287225.db2.gz LOVLSVVXKBEHJG-UHFFFAOYSA-N 0 0 341.476 5.047 40 70 EKIBRN CC[C@@H](NC(=O)CSc1ccc(Cl)cc1)c1ccc(C)c(C)c1 ZINC000217983013 241287198 /nfs/dbraw/zinc/28/71/98/241287198.db2.gz GHEHIEZTFPHAKY-GOSISDBHSA-N 0 0 347.911 5.316 40 70 EKIBRN CC[C@H](NC(=O)CSc1ccc(Cl)cc1)c1ccc(C)c(C)c1 ZINC000217983107 241288838 /nfs/dbraw/zinc/28/88/38/241288838.db2.gz GHEHIEZTFPHAKY-SFHVURJKSA-N 0 0 347.911 5.316 40 70 EKIBRN CC[C@@H](NC(=O)CSc1ccc(Cl)cc1)c1ccc(C)cc1C ZINC000217983199 241288199 /nfs/dbraw/zinc/28/81/99/241288199.db2.gz KKSGNNBLRUAGEE-GOSISDBHSA-N 0 0 347.911 5.316 40 70 EKIBRN CC[C@H](NC(=O)CSc1ccc(Cl)cc1)c1ccc(C)cc1C ZINC000217983287 241287300 /nfs/dbraw/zinc/28/73/00/241287300.db2.gz KKSGNNBLRUAGEE-SFHVURJKSA-N 0 0 347.911 5.316 40 70 EKIBRN Cc1ccc([C@@H](C)NC(=O)[C@@H](C)Sc2ccc(Cl)cc2)cc1C ZINC000217992161 241290308 /nfs/dbraw/zinc/29/03/08/241290308.db2.gz YLJQZWACLYKMOM-HUUCEWRRSA-N 0 0 347.911 5.315 40 70 EKIBRN Cc1ccc([C@H](C)NC(=O)[C@@H](C)Sc2ccc(Cl)cc2)cc1C ZINC000217992234 241289632 /nfs/dbraw/zinc/28/96/32/241289632.db2.gz YLJQZWACLYKMOM-LSDHHAIUSA-N 0 0 347.911 5.315 40 70 EKIBRN Cc1ccc([C@@H](C)NC(=O)[C@H](C)Sc2ccc(Cl)cc2)cc1C ZINC000217992323 241290908 /nfs/dbraw/zinc/29/09/08/241290908.db2.gz YLJQZWACLYKMOM-CABCVRRESA-N 0 0 347.911 5.315 40 70 EKIBRN Cc1ccc([C@H](C)NC(=O)[C@H](C)Sc2ccc(Cl)cc2)cc1C ZINC000217992390 241290220 /nfs/dbraw/zinc/29/02/20/241290220.db2.gz YLJQZWACLYKMOM-GJZGRUSLSA-N 0 0 347.911 5.315 40 70 EKIBRN CCOc1ccccc1CNc1ccc(Br)c(Cl)c1 ZINC000218004689 564056601 /nfs/dbraw/zinc/05/66/01/564056601.db2.gz ADHAEBHPXALBOO-UHFFFAOYSA-N 0 0 340.648 5.113 40 70 EKIBRN CC[C@@H](NC(=O)CSCc1ccccc1C)c1ccc(C)c(C)c1 ZINC000218017766 241291229 /nfs/dbraw/zinc/29/12/29/241291229.db2.gz FGZJJFFZTRIOLZ-HXUWFJFHSA-N 0 0 341.520 5.113 40 70 EKIBRN CC[C@H](NC(=O)CSCc1ccccc1C)c1ccc(C)c(C)c1 ZINC000218017844 241292058 /nfs/dbraw/zinc/29/20/58/241292058.db2.gz FGZJJFFZTRIOLZ-FQEVSTJZSA-N 0 0 341.520 5.113 40 70 EKIBRN CC[C@@H](NC(=O)CSCc1ccccc1C)c1ccc(C)cc1C ZINC000218017947 241291753 /nfs/dbraw/zinc/29/17/53/241291753.db2.gz CGTJQPCELQWETF-HXUWFJFHSA-N 0 0 341.520 5.113 40 70 EKIBRN CC[C@H](NC(=O)CSCc1ccccc1C)c1ccc(C)cc1C ZINC000218018018 241291531 /nfs/dbraw/zinc/29/15/31/241291531.db2.gz CGTJQPCELQWETF-FQEVSTJZSA-N 0 0 341.520 5.113 40 70 EKIBRN CC[C@@H](NC(=O)CSCc1ccc(C)cc1)c1ccc(C)c(C)c1 ZINC000218024257 241291834 /nfs/dbraw/zinc/29/18/34/241291834.db2.gz SRTPNAPJMDWBPH-HXUWFJFHSA-N 0 0 341.520 5.113 40 70 EKIBRN CC[C@H](NC(=O)CSCc1ccc(C)cc1)c1ccc(C)c(C)c1 ZINC000218024335 241291761 /nfs/dbraw/zinc/29/17/61/241291761.db2.gz SRTPNAPJMDWBPH-FQEVSTJZSA-N 0 0 341.520 5.113 40 70 EKIBRN CC[C@@H](NC(=O)CSCc1ccc(C)cc1)c1ccc(C)cc1C ZINC000218024441 241292456 /nfs/dbraw/zinc/29/24/56/241292456.db2.gz GUDUJKINTZDISL-HXUWFJFHSA-N 0 0 341.520 5.113 40 70 EKIBRN CC[C@H](NC(=O)CSCc1ccc(C)cc1)c1ccc(C)cc1C ZINC000218024530 241291992 /nfs/dbraw/zinc/29/19/92/241291992.db2.gz GUDUJKINTZDISL-FQEVSTJZSA-N 0 0 341.520 5.113 40 70 EKIBRN Cc1ccc(C)c([C@@H](C)NC(=O)CSCc2ccccc2Cl)c1 ZINC000218027609 241291679 /nfs/dbraw/zinc/29/16/79/241291679.db2.gz WHRUSUGUVSTFSR-OAHLLOKOSA-N 0 0 347.911 5.067 40 70 EKIBRN Cc1ccc(C)c([C@H](C)NC(=O)CSCc2ccccc2Cl)c1 ZINC000218027693 241291662 /nfs/dbraw/zinc/29/16/62/241291662.db2.gz WHRUSUGUVSTFSR-HNNXBMFYSA-N 0 0 347.911 5.067 40 70 EKIBRN Cc1ccc([C@@H](C)NC(=O)CSCc2ccccc2Cl)cc1C ZINC000218031184 241291402 /nfs/dbraw/zinc/29/14/02/241291402.db2.gz RVMXPNVOZHSXNR-OAHLLOKOSA-N 0 0 347.911 5.067 40 70 EKIBRN Cc1ccc([C@H](C)NC(=O)CSCc2ccccc2Cl)cc1C ZINC000218031259 241292391 /nfs/dbraw/zinc/29/23/91/241292391.db2.gz RVMXPNVOZHSXNR-HNNXBMFYSA-N 0 0 347.911 5.067 40 70 EKIBRN Cc1ccc(C)c([C@@H](C)NC(=O)CSCc2cccc(Cl)c2)c1 ZINC000218034647 241291638 /nfs/dbraw/zinc/29/16/38/241291638.db2.gz CCCKNSFWLNTPGT-OAHLLOKOSA-N 0 0 347.911 5.067 40 70 EKIBRN Cc1ccc(C)c([C@H](C)NC(=O)CSCc2cccc(Cl)c2)c1 ZINC000218034729 241292122 /nfs/dbraw/zinc/29/21/22/241292122.db2.gz CCCKNSFWLNTPGT-HNNXBMFYSA-N 0 0 347.911 5.067 40 70 EKIBRN Cc1ccc([C@@H](C)NC(=O)CSCc2cccc(Cl)c2)cc1C ZINC000218038103 241292605 /nfs/dbraw/zinc/29/26/05/241292605.db2.gz QWRDILCNTPKHCB-OAHLLOKOSA-N 0 0 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